ASI21274
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.2487   -0.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9625    0.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4559    0.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4559    1.1836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4559   -1.2895    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2487   -0.9027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6856   -0.0737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067    1.6257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9625    1.1836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2487    1.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067    2.4685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4178    0.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4559   -2.1323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1882   -0.9027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9113    1.1974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1225   -0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4317    1.1559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8928   -1.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1882   -2.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8928   -2.1323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  2  9  4  0  0  0  0
  4 10  4  0  0  0  0
  8 11  2  0  0  0  0
  7 12  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  8 15  1  0  0  0  0
 12 16  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  0  0  0  0
  9 10  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI21274

>  <IDNUMBER>
BAS 00327828

>  <Activity>
0
$$$$
ASI27155
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
    0.5264   -0.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3488   -0.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3488   -1.6104    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1101   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0929    0.5368    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5264   -1.6104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7432    0.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9716    1.2697    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6233    1.2697    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1562    1.2697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1562   -0.1755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3949    0.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3949    1.9716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2104    0.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2104    1.9716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7755    0.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7260   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5773   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4492    1.2697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1101   -2.3227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6117    0.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0005   -0.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8160   -0.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1252   -1.6104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7260   -2.3227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0040    1.2697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2289    0.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  6  8  1  0  0  0  0
  9 11  1  0  0  0  0
 10 15  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  2  0  0  0  0
  9 13  1  0  0  0  0
  9 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  2 17  1  0  0  0  0
  4 18  4  0  0  0  0
  5 19  1  0  0  0  0
 10 20  1  0  0  0  0
  7 21  4  0  0  0  0
 17 22  1  0  0  0  0
 19 23  1  0  0  0  0
 23 24  1  0  0  0  0
 18 25  4  0  0  0  0
 25 26  4  0  0  0  0
 22 27  1  0  0  0  0
 24 28  1  0  0  0  0
  3  7  4  0  0  0  0
 21 26  4  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI27155

>  <IDNUMBER>
BAS 00371694

>  <Activity>
0
$$$$
ASI27319
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -1.2150   -0.1456    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6864   -0.8394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6864    0.5404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5221   -0.5826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5221    0.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5903    0.4599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1456    0.0460    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4565    1.1844    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3377   -1.4258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6746    0.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7168   -0.5634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2695   -1.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2695    0.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4527    0.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4527   -0.5634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1694    0.3143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4527    1.5332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1694   -0.1456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4527   -1.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0169    0.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0169   -0.5826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785    0.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1694    1.9548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785   -0.5634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1694   -1.7823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785    1.5332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785   -1.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  2  0  0  0  0
  2  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  4 12  4  0  0  0  0
  5 13  4  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  4  0  0  0  0
 14 17  4  0  0  0  0
 15 18  4  0  0  0  0
 15 19  4  0  0  0  0
 13 20  4  0  0  0  0
 12 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
  4  5  4  0  0  0  0
 20 21  4  0  0  0  0
 24 27  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI27319

>  <IDNUMBER>
BAS 00377548

>  <Activity>
0
$$$$
ASI27164
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
    1.0020   -1.1427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0020   -0.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8026   -1.3810    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2688    0.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2688   -1.5520    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4278   -0.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4278   -1.1427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2688    0.9410    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8026   -0.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2669   -0.7577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4278    1.3503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1487    2.6151    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0775   -2.1385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4278    2.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1610    0.9104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1610    0.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8209    2.1385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1243    3.4524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1610   -1.5520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5643   -2.7801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8841   -2.2608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8942   -0.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6458    2.3768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7353    4.0206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8942   -1.1427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8759   -3.5440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1774   -3.0184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6825   -3.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9758    3.1591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5725    3.8740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6  7  4  0  0  0  0
  5  7  4  0  0  0  0
  4  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 14  1  0  0  0  0
  3 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
  6 16  4  0  0  0  0
 12 17  1  0  0  0  0
 12 18  1  0  0  0  0
  7 19  4  0  0  0  0
 13 20  4  0  0  0  0
 13 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
 19 25  4  0  0  0  0
 20 26  4  0  0  0  0
 21 27  4  0  0  0  0
 27 28  4  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
  9 10  1  0  0  0  0
  4  6  4  0  0  0  0
 22 25  4  0  0  0  0
 26 28  4  0  0  0  0
 29 30  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI27164

>  <IDNUMBER>
BAS 00371730

>  <Activity>
0
$$$$
ASI21875
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
    2.1503    1.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4382    0.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8717    0.5725    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8764   -0.2094    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4429    0.6236    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1503    1.8245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4382   -0.2281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7261    1.0193    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5885   -0.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5838    1.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8764    0.6236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1550   -0.6051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1550    1.0425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4429   -0.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5885   -1.4568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5885   -3.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0127    1.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5885   -3.9376    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    5.7528    2.2294    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.5838    1.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3006    0.5725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0093    0.6236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3006    2.2294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0127    1.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3006   -2.6856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8764   -2.6856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8764   -1.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3006   -1.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7028    1.0425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4 12  1  0  0  0  0
  5 29  1  0  0  0  0
  1  6  2  0  0  0  0
  2  7  2  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  3 10  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  9 15  1  0  0  0  0
 16 26  4  0  0  0  0
 17 24  4  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 10 20  4  0  0  0  0
 10 21  4  0  0  0  0
  8 22  1  0  0  0  0
 20 23  4  0  0  0  0
 21 24  4  0  0  0  0
 25 28  4  0  0  0  0
 26 27  4  0  0  0  0
 15 27  4  0  0  0  0
 15 28  4  0  0  0  0
 22 29  1  0  0  0  0
 17 23  4  0  0  0  0
  4 11  1  0  0  0  0
 16 25  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI21875

>  <IDNUMBER>
BAS 00331602

>  <Activity>
0
$$$$
ASI13847
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.5502    0.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1621   -0.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
 10 14  1  0  0  0  0
  2 11  4  0  0  0  0
  3 12  4  0  0  0  0
  9 13  1  0  0  0  0
 13 14  1  0  0  0  0
  4 15  4  0  0  0  0
  5 16  4  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 20 21  4  0  0  0  0
 19 22  4  0  0  0  0
  6  7  1  0  0  0  0
 16 21  4  0  0  0  0
 15 22  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI13847

>  <IDNUMBER>
BAS 00269717

>  <Activity>
0
$$$$
ASI11037
  Marvin  04201015132D          

 32 34  0  0  0  0            999 V2000
   -2.5057   -1.6029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5368    1.6082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  0  0  0  0
  3 16  1  0  0  0  0
  4  7  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  1  9  2  0  0  0  0
  2 10  2  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 12 21  1  0  0  0  0
 11 22  1  0  0  0  0
 13 23  4  0  0  0  0
 13 24  4  0  0  0  0
 14 25  4  0  0  0  0
 14 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 25 29  4  0  0  0  0
 26 30  4  0  0  0  0
 28 31  4  0  0  0  0
 30 32  4  0  0  0  0
 27 31  4  0  0  0  0
  3 15  1  0  0  0  0
 29 32  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI11037

>  <IDNUMBER>
BAS 00227514

>  <Activity>
0
$$$$
ASI343
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
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   -0.3132    0.3401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9880   -1.7546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  5  6  4  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  3  9  1  0  0  0  0
  2 10  1  0  0  0  0
 11 16  1  0  0  0  0
  5 12  4  0  0  0  0
  6 13  4  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 10 18  4  0  0  0  0
 10 19  4  0  0  0  0
 12 20  4  0  0  0  0
 13 21  4  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 24  4  0  0  0  0
  4  6  4  0  0  0  0
 11 17  1  0  0  0  0
 20 21  4  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI343

>  <IDNUMBER>
BAS 00012473

>  <Activity>
0
$$$$
ASI10886
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -0.2450   -0.0668    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2227   -0.7349    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
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  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
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  3  9  1  0  0  0  0
  8 10  1  0  0  0  0
  4 11  4  0  0  0  0
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 11 15  4  0  0  0  0
 15 16  4  0  0  0  0
 13 17  4  0  0  0  0
 17 18  4  0  0  0  0
  3  5  4  0  0  0  0
 12 16  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10886

>  <IDNUMBER>
BAS 00226476

>  <Activity>
0
$$$$
ASI16411
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
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 10 15  4  0  0  0  0
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 13 21  4  0  0  0  0
 14 20  4  0  0  0  0
  9 15  1  0  0  0  0
  8 16  1  0  0  0  0
  7 17  1  0  0  0  0
  4 18  1  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 15 21  4  0  0  0  0
  6 22  1  0  0  0  0
  2 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  2 17  1  0  0  0  0
 14 19  4  0  0  0  0
  4  6  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16411

>  <IDNUMBER>
BAS 00290335

>  <Activity>
0
$$$$
ASI26545
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  5  8  4  0  0  0  0
  2  9  1  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
  7 12  4  0  0  0  0
 10 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  6 16  4  0  0  0  0
  6 17  4  0  0  0  0
 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 15 21  1  0  0  0  0
 14 22  1  0  0  0  0
 20 23  1  0  0  0  0
 17 24  4  0  0  0  0
 16 25  4  0  0  0  0
 25 26  4  0  0  0  0
 21 22  1  0  0  0  0
 10 12  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26545

>  <IDNUMBER>
BAS 00367500

>  <Activity>
0
$$$$
ASI16437
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
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   -1.6268   -0.9253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  3  4  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  6  9  1  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  9 11  2  0  0  0  0
  2 10  1  0  0  0  0
 11 20  1  0  0  0  0
 12 16  4  0  0  0  0
  3 13  4  0  0  0  0
  6 14  4  0  0  0  0
  4 15  4  0  0  0  0
 14 16  4  0  0  0  0
 10 17  4  0  0  0  0
 13 18  4  0  0  0  0
 15 19  4  0  0  0  0
 17 20  4  0  0  0  0
  7 21  1  0  0  0  0
  8 22  1  0  0  0  0
 16 23  1  0  0  0  0
 10 24  4  0  0  0  0
 24 25  4  0  0  0  0
 25 26  4  0  0  0  0
 22 27  1  0  0  0  0
  3  5  4  0  0  0  0
 18 19  4  0  0  0  0
 20 26  4  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1   1   1
M  STY  1   1 DAT
M  SAL   1  1   1
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI16437

>  <IDNUMBER>
BAS 00290579

>  <Activity>
0
$$$$
ASI14412
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
    0.6493    0.7712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1793    0.7712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3 10  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  1  0  0  0  0
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  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  5 14  4  0  0  0  0
  5 15  4  0  0  0  0
  6 16  1  0  0  0  0
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 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 21  1  0  0  0  0
 18 22  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI14412

>  <IDNUMBER>
BAS 00277188

>  <Activity>
0
$$$$
ASI27142
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
    0.3695    0.2377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0713    0.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6  8  1  0  0  0  0
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 10 11  1  0  0  0  0
  2 12  1  0  0  0  0
  4 13  4  0  0  0  0
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 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 14 18  1  0  0  0  0
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 13 20  4  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
 20 23  4  0  0  0  0
 18 24  1  0  0  0  0
  3  7  4  0  0  0  0
 15 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27142

>  <IDNUMBER>
BAS 00371672

>  <Activity>
0
$$$$
ASI11565
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
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  4  7  1  0  0  0  0
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  7  9  1  0  0  0  0
  4 10  2  0  0  0  0
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 11 12  1  0  0  0  0
  3 13  1  0  0  0  0
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 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
  5  6  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI11565

>  <IDNUMBER>
BAS 00232855

>  <Activity>
0
$$$$
ASI22516
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
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   -0.6546   -1.5376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3 13  1  0  0  0  0
  1  4  4  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  2  7  4  0  0  0  0
  4  8  4  0  0  0  0
  7  9  4  0  0  0  0
  1 10  1  0  0  0  0
 11 19  1  0  0  0  0
  2 12  1  0  0  0  0
 13 18  1  0  0  0  0
  6 14  4  0  0  0  0
  5 15  4  0  0  0  0
  5 16  4  0  0  0  0
  6 17  4  0  0  0  0
 11 18  1  0  0  0  0
 19 20  1  0  0  0  0
  8 20  1  0  0  0  0
 10 21  1  0  0  0  0
 12 22  1  0  0  0  0
 14 23  4  0  0  0  0
 15 24  4  0  0  0  0
 16 25  4  0  0  0  0
 17 26  4  0  0  0  0
 23 27  4  0  0  0  0
 25 28  4  0  0  0  0
  8  9  4  0  0  0  0
 24 28  4  0  0  0  0
 26 27  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI22516

>  <IDNUMBER>
BAS 00335512

>  <Activity>
0
$$$$
ASI12948
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.1152   -1.2714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9217   -1.1842    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3441    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0597   -0.3851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7520   -0.5595    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7011   -2.0198    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.3223    0.8355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5656    2.4593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1199   -2.0379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8355    2.0597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8116   -0.0327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5656    3.2984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5412   -1.3404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5776    1.2242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1380    2.4593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8355    1.2242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2777    2.0597    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.1380   -0.6139    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5776    2.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5194   -2.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3731   -1.3586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3404   -2.7935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7618   -2.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  8 10  1  0  0  0  0
  6  9  1  0  0  0  0
 10 16  4  0  0  0  0
  4 11  2  0  0  0  0
  8 12  2  0  0  0  0
  9 13  4  0  0  0  0
  7 14  1  0  0  0  0
 15 20  4  0  0  0  0
 16 19  4  0  0  0  0
  8 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
  9 21  4  0  0  0  0
 13 22  4  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  2   6   1  17  -1
M  END
>  <NAME>
ASI12948

>  <IDNUMBER>
BAS 00256279

>  <Activity>
0
$$$$
ASI30581
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.5268    1.6112    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1471    1.1323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0992    0.3626    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1837    1.1016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9202    0.3455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9510    1.3136    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4128   -0.3284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0047    1.3136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0844   -1.1049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4276   -2.5930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0992   -3.3662    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.5770   -1.7617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2634   -1.1870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2486   -2.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0821   -1.9362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5086    0.7013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2144    2.0970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3126    0.8860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0183    2.2818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5759    1.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5  7  2  0  0  0  0
  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 15  4  0  0  0  0
 10 11  1  0  0  0  0
  9 12  4  0  0  0  0
  9 13  4  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  3  5  1  0  0  0  0
 19 20  1  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30581

>  <IDNUMBER>
BAS 00395359

>  <Activity>
0
$$$$
ASI4870
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    0.1990    0.0704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5182    0.4768    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1907   -0.7545    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9360    0.4684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2355    0.0622    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6086   -2.4004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8997   -1.9817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4469   -3.2046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2902   -2.5414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6301   -3.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8955   -1.1691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6533    0.0456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9286    0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9360    1.2935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9692   -3.8016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6293    0.0788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2230    1.6997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6491    1.6997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9286    1.3142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3464    0.4975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6293    1.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2230    2.5289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6533    2.5289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3464    1.3017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9526    2.9310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  4  5  1  0  0  0  0
  2  5  1  0  0  0  0
  6  7  4  0  0  0  0
  7 11  1  0  0  0  0
  6  8  4  0  0  0  0
  7  9  4  0  0  0  0
  9 10  4  0  0  0  0
  3 11  2  0  0  0  0
  4 12  2  0  0  0  0
  1 13  1  0  0  0  0
  4 14  1  0  0  0  0
  8 15  1  0  0  0  0
 13 16  4  0  0  0  0
 14 17  4  0  0  0  0
 14 18  4  0  0  0  0
 13 19  4  0  0  0  0
 16 20  4  0  0  0  0
 19 21  4  0  0  0  0
 17 22  4  0  0  0  0
 18 23  4  0  0  0  0
 20 24  4  0  0  0  0
 23 25  4  0  0  0  0
 21 24  4  0  0  0  0
  8 10  4  0  0  0  0
 22 25  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI4870

>  <IDNUMBER>
BAS 00125191

>  <Activity>
0
$$$$
ASI27409
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.2241    0.4941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2565    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2565   -0.1674    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.0396    0.4159    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0342    0.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0342    0.0756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4905   -0.2835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0027    1.9414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2484    2.7299    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5581    1.0477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3222    0.7534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2817   -0.0756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2097   -1.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3916   -1.2043    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1188   -1.9820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7470    1.3231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7470   -0.3267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6696   -1.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1647   -2.7596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8965   -2.2574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4599    0.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4599    0.0918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  4  7  4  0  0  0  0
  2  8  1  0  0  0  0
  8  9  3  0  0  0  0
  4 10  4  0  0  0  0
 10 11  4  0  0  0  0
  7 12  4  0  0  0  0
  7 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
  5  6  4  0  0  0  0
 11 12  4  0  0  0  0
 21 22  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI27409

>  <IDNUMBER>
BAS 00379940

>  <Activity>
0
$$$$
ASI16309
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
    3.3779    1.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7800    0.2506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1249    0.3289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5478    1.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4174   -0.3602    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3466   -0.4229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5270   -0.4229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2948    0.3289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8719   -0.3602    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0671   -0.3602    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6080   -0.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8141   -1.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8403    0.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8270    1.7073    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1851    0.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1851   -1.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0417   -0.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6391   -1.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6391    0.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5997    0.2506    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7800   -1.1747    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.1511    1.7543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3812    0.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3550   -1.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8921   -0.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2993    0.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  4  4  0  0  0  0
  1  4  4  0  0  0  0
  5 11  1  0  0  0  0
  2  6  4  0  0  0  0
  6  7  4  0  0  0  0
  3  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10 18  1  0  0  0  0
 11 16  4  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  1 14  1  0  0  0  0
 15 23  4  0  0  0  0
 16 24  4  0  0  0  0
  9 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
  2 20  1  0  0  0  0
  6 21  1  0  0  0  0
  4 22  1  0  0  0  0
 17 23  4  0  0  0  0
 17 24  4  0  0  0  0
 10 25  1  0  0  0  0
 25 26  1  0  0  0  0
  3  7  4  0  0  0  0
 11 15  4  0  0  0  0
 10 19  1  0  0  0  0
M  CHG  2  10   1  20  -1
M  END
>  <NAME>
ASI16309

>  <IDNUMBER>
BAS 00289716

>  <Activity>
0
$$$$
ASI25851
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    0.1721   -0.4095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6202   -0.4095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3324   -0.8012    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9080   -0.8368    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  2  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  4  0  0  0  0
  1  6  4  0  0  0  0
  7  8  4  0  0  0  0
  5  8  4  0  0  0  0
  6  9  4  0  0  0  0
  3 10  1  0  0  0  0
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 10 12  2  0  0  0  0
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 11 15  4  0  0  0  0
 13 16  4  0  0  0  0
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 15 19  1  0  0  0  0
  7  9  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25851

>  <IDNUMBER>
BAS 00364245

>  <Activity>
0
$$$$
ASI18186
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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  1  6  2  0  0  0  0
  5  7  1  0  0  0  0
  3  8  2  0  0  0  0
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  6 10  1  0  0  0  0
  9 11  4  0  0  0  0
 12 18  4  0  0  0  0
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 10 14  4  0  0  0  0
 10 15  4  0  0  0  0
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 14 17  4  0  0  0  0
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 19 20  4  0  0  0  0
  9 20  4  0  0  0  0
 19 21  4  0  0  0  0
 16 22  1  0  0  0  0
  3  5  1  0  0  0  0
 12 17  4  0  0  0  0
 16 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18186

>  <IDNUMBER>
BAS 00312370

>  <Activity>
0
$$$$
ASI23047
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -0.2975   -0.2278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 15  1  0  0  0  0
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 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
  2  7  1  0  0  0  0
  8  9  4  0  0  0  0
 17 18  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI23047

>  <IDNUMBER>
BAS 00338480

>  <Activity>
0
$$$$
ASI24190
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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 10 15  1  0  0  0  0
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 11 13  1  0  0  0  0
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 15 16  1  0  0  0  0
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 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3  6  4  0  0  0  0
  9 14  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24190

>  <IDNUMBER>
BAS 00344483

>  <Activity>
0
$$$$
ASI21141
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
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 12 14  1  0  0  0  0
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 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 12 20  1  0  0  0  0
 20 21  1  0  0  0  0
  8 22  4  0  0  0  0
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 15 24  1  0  0  0  0
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 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 23 28  4  0  0  0  0
 22 29  4  0  0  0  0
  6  9  4  0  0  0  0
  7 13  4  0  0  0  0
 28 29  4  0  0  0  0
 14 19  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI21141

>  <IDNUMBER>
BAS 00327198

>  <Activity>
0
$$$$
ASI18317
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
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 15 24  1  0  0  0  0
  5 25  1  0  0  0  0
  3 26  4  0  0  0  0
  4 27  4  0  0  0  0
 25 28  1  0  0  0  0
 29 30  4  0  0  0  0
 27 30  4  0  0  0  0
 13 22  1  0  0  0  0
 12 21  1  0  0  0  0
 12 20  1  0  0  0  0
  8 23  1  0  0  0  0
 26 29  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI18317

>  <IDNUMBER>
BAS 00312856

>  <Activity>
0
$$$$
ASI24406
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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   -1.1445    0.7599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3096   -0.2767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1407    0.4222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3565    1.0320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9709    0.5113    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1201    1.3509    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8200   -0.4784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8434    1.2102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8162    1.9326    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  6  7  1  0  0  0  0
  4  7  1  0  0  0  0
  6  8  2  0  0  0  0
  1  9  1  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
  6 12  1  0  0  0  0
  9 13  4  0  0  0  0
  9 14  4  0  0  0  0
  8 15  1  0  0  0  0
 16 18  4  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
 16 19  1  0  0  0  0
 15 20  4  0  0  0  0
 15 21  4  0  0  0  0
 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
  4  5  1  0  0  0  0
 16 17  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24406

>  <IDNUMBER>
BAS 00345428

>  <Activity>
0
$$$$
ASI2810
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    2.0341   -0.1010    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6093    0.2284    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5440    0.5630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2693    0.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0341    1.2482    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2693    0.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8976   -0.2284    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5577   -0.2549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2785    0.6639    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5577    1.4021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  7 13  1  0  0  0  0
  4  8  4  0  0  0  0
  2  9  1  0  0  0  0
  2 10  2  0  0  0  0
  2 11  2  0  0  0  0
  6 12  4  0  0  0  0
  8 13  4  0  0  0  0
  1 14  1  0  0  0  0
  9 15  4  0  0  0  0
  9 16  4  0  0  0  0
 13 17  4  0  0  0  0
  5 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  4  0  0  0  0
 16 21  4  0  0  0  0
 21 22  4  0  0  0  0
 22 23  1  0  0  0  0
 14 24  1  0  0  0  0
 18 25  1  0  0  0  0
  5  6  4  0  0  0  0
 12 17  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2810

>  <IDNUMBER>
BAS 00100051

>  <Activity>
0
$$$$
ASI16290
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -2.1816   -0.3442    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8419   -0.3037    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.3616   -0.3442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6018   -1.0326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6018    0.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9263    0.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9263   -1.0731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6193   -0.3796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3138   -0.3442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4268    0.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.0242    1.7615    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.0720    0.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 16  1  0  0  0  0
  3 14  1  0  0  0  0
  4 10  4  0  0  0  0
  1  5  1  0  0  0  0
  6 13  4  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  3  9  2  0  0  0  0
 10 15  4  0  0  0  0
  5 11  4  0  0  0  0
  5 12  4  0  0  0  0
 13 21  4  0  0  0  0
 14 20  4  0  0  0  0
  9 15  1  0  0  0  0
  8 16  1  0  0  0  0
  7 17  1  0  0  0  0
  4 18  1  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 15 21  4  0  0  0  0
  6 22  1  0  0  0  0
  2 23  1  0  0  0  0
 23 24  1  0  0  0  0
  2 17  1  0  0  0  0
 14 19  4  0  0  0  0
  4  6  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16290

>  <IDNUMBER>
BAS 00289656

>  <Activity>
0
$$$$
ASI7029
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
   -0.8829   -0.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8829   -0.9163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6035   -1.3327    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3198   -0.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1707   -1.3411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6946    0.3207    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1707    1.1578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 20  1  0  0  0  0
  7 10  2  0  0  0  0
  3 11  1  0  0  0  0
  7 12  1  0  0  0  0
 13 18  1  0  0  0  0
 13 14  2  0  0  0  0
  4 15  1  0  0  0  0
  5 16  4  0  0  0  0
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  9 18  1  0  0  0  0
 12 19  1  0  0  0  0
 19 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 16 23  4  0  0  0  0
 22 24  1  0  0  0  0
 21 25  1  0  0  0  0
 17 26  4  0  0  0  0
  5  6  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7029

>  <IDNUMBER>
BAS 00141379

>  <Activity>
0
$$$$
ASI24219
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    1.3870   -0.2630    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2120    1.0043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3 10  1  0  0  0  0
  1  4  1  0  0  0  0
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  1  6  2  0  0  0  0
  1  7  2  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
  5 10  1  0  0  0  0
  3 11  4  0  0  0  0
  3 12  4  0  0  0  0
  9 13  1  0  0  0  0
  8 14  1  0  0  0  0
  4 15  4  0  0  0  0
  4 16  4  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 18 19  4  0  0  0  0
 15 20  4  0  0  0  0
 16 21  4  0  0  0  0
 21 22  4  0  0  0  0
 11 23  1  0  0  0  0
 18 24  1  0  0  0  0
 22 25  1  0  0  0  0
  5 13  1  0  0  0  0
 20 22  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24219

>  <IDNUMBER>
BAS 00344559

>  <Activity>
0
$$$$
ASI8045
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
   -0.8642    0.5022    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1435   -0.7500    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  7 10  4  0  0  0  0
  7 11  4  0  0  0  0
 12 14  4  0  0  0  0
 11 13  4  0  0  0  0
 10 14  4  0  0  0  0
 12 15  1  0  0  0  0
  9 16  4  0  0  0  0
  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
  9 19  4  0  0  0  0
 19 20  4  0  0  0  0
 16 21  4  0  0  0  0
 17 22  4  0  0  0  0
 18 23  4  0  0  0  0
 21 24  4  0  0  0  0
 23 25  4  0  0  0  0
  5  6  1  0  0  0  0
 22 25  4  0  0  0  0
 20 24  4  0  0  0  0
 12 13  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI8045

>  <IDNUMBER>
BAS 00162241

>  <Activity>
0
$$$$
ASI4262
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
   -2.5713   -0.0410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1082   -0.0410    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    0.7240   -0.0410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8103   -0.7687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8103   -2.1906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3401    0.3396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3 12  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  4  0  0  0  0
  4 10  4  0  0  0  0
  7 11  1  0  0  0  0
  6 12  1  0  0  0  0
 13 18  1  0  0  0  0
  8 14  1  0  0  0  0
 15 19  4  0  0  0  0
 13 16  1  0  0  0  0
 16 17  4  0  0  0  0
 14 18  1  0  0  0  0
 10 19  4  0  0  0  0
  9 20  4  0  0  0  0
 15 21  1  0  0  0  0
 17 22  4  0  0  0  0
 14 23  1  0  0  0  0
 24 25  4  0  0  0  0
 16 25  4  0  0  0  0
 24 26  4  0  0  0  0
 22 27  1  0  0  0  0
 15 20  4  0  0  0  0
  3 11  1  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI4262

>  <IDNUMBER>
BAS 00117527

>  <Activity>
0
$$$$
ASI11355
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    1.1183    0.9031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9411    0.0844    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1983    0.7385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1603   -0.0084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4178    1.3082    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.8273    1.3166    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0001    0.8946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2448   -0.7089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3674    0.4135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  9 13  4  0  0  0  0
  9 10  1  0  0  0  0
  7 11  1  0  0  0  0
 12 16  4  0  0  0  0
 13 15  4  0  0  0  0
  6 14  1  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
 20 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  3  4  1  0  0  0  0
 22 23  4  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11355

>  <IDNUMBER>
BAS 00231558

>  <Activity>
0
$$$$
ASI5643
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.4060    0.1013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0743   -0.3990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7241   -0.6048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0253    0.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  6 14  1  0  0  0  0
  3  7  2  0  0  0  0
  8 18  1  0  0  0  0
  9 12  4  0  0  0  0
  2 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  4  0  0  0  0
  9 13  1  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
  5  9  4  0  0  0  0
  8 19  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI5643

>  <IDNUMBER>
BAS 00130536

>  <Activity>
0
$$$$
ASI8902
  Marvin  04201015132D          

 27 30  0  0  1  0            999 V2000
    1.5977    0.4835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8902    0.0884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6823    1.3618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  1  5  4  0  0  0  0
  5  6  4  0  0  0  0
  7 10  1  0  0  0  0
  1  8  1  0  0  0  0
  4  9  4  0  0  0  0
 10 12  1  0  0  0  0
  3 11  4  0  0  0  0
  9 12  4  0  0  0  0
 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
  2 15  1  0  0  0  0
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  8 17  1  0  0  0  0
 11 18  4  0  0  0  0
 19 23  4  0  0  0  0
 19 20  1  0  0  0  0
 17 21  4  0  0  0  0
 17 22  4  0  0  0  0
 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
 13 25  1  0  0  0  0
 14 26  1  0  0  0  0
 26 27  1  0  0  0  0
  3  4  4  0  0  0  0
 19 24  4  0  0  0  0
 12 18  4  0  0  0  0
 25 27  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI8902

>  <IDNUMBER>
BAS 00185505

>  <Activity>
0
$$$$
ASI13600
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.5353   -0.0737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0514    0.3462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6283    0.3462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7598   -0.9071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4232    1.1924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4809   -1.3078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8335    0.9712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  6 10  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  9 16  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  8 12  1  0  0  0  0
  6 13  1  0  0  0  0
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  4 15  4  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
  5 18  4  0  0  0  0
 15 19  4  0  0  0  0
 19 20  4  0  0  0  0
  2  5  4  0  0  0  0
 18 20  4  0  0  0  0
  9 17  1  0  0  0  0
M  CHG  1   6   1
M  STY  1   1 DAT
M  SAL   1  1   2
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI13600

>  <IDNUMBER>
BAS 00266399

>  <Activity>
0
$$$$
ASI29617
  Marvin  04201015132D          

 16 17  0  0  0  0            999 V2000
    1.7284    0.5974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7284    1.4072    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.0861   -1.0601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2962   -0.6493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  4  7  4  0  0  0  0
  1  5  1  0  0  0  0
  6  8  4  0  0  0  0
  7  9  4  0  0  0  0
  8 12  4  0  0  0  0
  9 11  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  9 12  4  0  0  0  0
  6 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 15  1  0  0  0  0
  4  6  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI29617

>  <IDNUMBER>
BAS 00391324

>  <Activity>
0
$$$$
ASI15610
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
   -0.5853   -1.1631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5853   -0.3111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  2  7  4  0  0  0  0
  6  8  4  0  0  0  0
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  3 10  1  0  0  0  0
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  7 13  2  0  0  0  0
 14 21  1  0  0  0  0
 11 15  1  0  0  0  0
  6 16  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 15 22  4  0  0  0  0
 15 23  4  0  0  0  0
 22 24  4  0  0  0  0
 23 25  4  0  0  0  0
 25 26  4  0  0  0  0
  3  5  4  0  0  0  0
  7  9  4  0  0  0  0
 14 20  1  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1  14   1
M  STY  1   1 DAT
M  SAL   1  1   9
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI15610

>  <IDNUMBER>
BAS 00286871

>  <Activity>
0
$$$$
ASI21686
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -2.0864   -0.3348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3436   -1.1187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1642   -1.3514    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    2.5354   -0.4083    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  3  7  2  0  0  0  0
  8 12  4  0  0  0  0
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  7 10  1  0  0  0  0
  2 11  2  0  0  0  0
 10 12  4  0  0  0  0
 10 13  4  0  0  0  0
  4 14  2  0  0  0  0
  8 15  1  0  0  0  0
  6 16  1  0  0  0  0
  9 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3  5  1  0  0  0  0
  6  9  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI21686

>  <IDNUMBER>
BAS 00330692

>  <Activity>
0
$$$$
ASI29509
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
    2.2267   -0.4246    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6416    0.3066    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2 14  1  0  0  0  0
  2  3  1  0  0  0  0
  4  8  4  0  0  0  0
  3  5  4  0  0  0  0
  3  6  4  0  0  0  0
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  1  9  1  0  0  0  0
  4 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  9 13  1  0  0  0  0
 14 15  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 19  1  0  0  0  0
  4  7  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI29509

>  <IDNUMBER>
BAS 00390564

>  <Activity>
0
$$$$
ASI2651
  Marvin  04201015132D          

 27 31  0  0  0  0            999 V2000
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  2 17  1  0  0  0  0
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  8 11  1  0  0  0  0
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 13 25  1  0  0  0  0
  3 14  4  0  0  0  0
  3 15  4  0  0  0  0
 16 18  4  0  0  0  0
 17 24  1  0  0  0  0
 15 18  4  0  0  0  0
 14 19  4  0  0  0  0
  2 20  1  0  0  0  0
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 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
 21 26  1  0  0  0  0
 20 27  1  0  0  0  0
  7 11  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 16 19  4  0  0  0  0
 13 26  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI2651

>  <IDNUMBER>
BAS 00096510

>  <Activity>
0
$$$$
ASI31343
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
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  1  2  4  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
 13 22  4  0  0  0  0
 12 23  4  0  0  0  0
  4  5  4  0  0  0  0
 15 21  4  0  0  0  0
 14 20  4  0  0  0  0
  9 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI31343

>  <IDNUMBER>
BAS 00401150

>  <Activity>
0
$$$$
ASI22536
  Marvin  04201015132D          

 20 20  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  1  0  0  0  0
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  2  7  2  0  0  0  0
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 10 13  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  4  0  0  0  0
  9 13  1  0  0  0  0
  5 14  1  0  0  0  0
  8 15  1  0  0  0  0
 10 16  1  0  0  0  0
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 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  6  8  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI22536

>  <IDNUMBER>
BAS 00335702

>  <Activity>
0
$$$$
ASI6560
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
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 11 14  4  0  0  0  0
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 14 17  4  0  0  0  0
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 11 20  4  0  0  0  0
 16 21  1  0  0  0  0
 10 22  4  0  0  0  0
 20 23  4  0  0  0  0
 23 24  4  0  0  0  0
 17 25  1  0  0  0  0
 19 26  4  0  0  0  0
 22 27  4  0  0  0  0
  9 13  1  0  0  0  0
  8 10  4  0  0  0  0
 26 27  4  0  0  0  0
 15 21  1  0  0  0  0
 17 24  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI6560

>  <IDNUMBER>
BAS 00138316

>  <Activity>
0
$$$$
ASI12544
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
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 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
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  8 16  4  0  0  0  0
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 10 18  4  0  0  0  0
 12 19  4  0  0  0  0
 15 20  1  0  0  0  0
 16 21  4  0  0  0  0
 17 22  4  0  0  0  0
 18 23  4  0  0  0  0
 21 24  4  0  0  0  0
  6 10  4  0  0  0  0
  7  9  1  0  0  0  0
 22 23  4  0  0  0  0
 19 24  4  0  0  0  0
M  CHG  2   5   1  14  -1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI12544

>  <IDNUMBER>
BAS 00253368

>  <Activity>
0
$$$$
ASI24402
  Marvin  04201015132D          

 27 30  0  0  1  0            999 V2000
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  2 11  2  0  0  0  0
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 10 15  1  0  0  0  0
  4 16  4  0  0  0  0
  9 17  4  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
 14 20  4  0  0  0  0
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 17 23  4  0  0  0  0
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 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
 26 27  4  0  0  0  0
  5  6  1  0  0  0  0
 14 19  4  0  0  0  0
 20 24  4  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI24402

>  <IDNUMBER>
BAS 00345424

>  <Activity>
0
$$$$
ASI21475
  Marvin  04201015132D          

 27 30  0  0  1  0            999 V2000
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  2  9  1  0  0  0  0
  3 10  4  0  0  0  0
  8 11  1  0  0  0  0
  7 12  4  0  0  0  0
  8 13  1  0  0  0  0
 10 14  4  0  0  0  0
  9 15  1  0  0  0  0
 11 16  2  0  0  0  0
 11 17  1  0  0  0  0
 12 18  4  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
  7 21  4  0  0  0  0
 10 22  4  0  0  0  0
 14 23  4  0  0  0  0
 24 25  4  0  0  0  0
 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
 26 27  4  0  0  0  0
 12 15  1  0  0  0  0
 18 24  4  0  0  0  0
  5 14  4  0  0  0  0
 23 27  4  0  0  0  0
M  CHG  2   2   1  17  -1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI21475

>  <IDNUMBER>
BAS 00329359

>  <Activity>
0
$$$$
ASI11354
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.7590   -0.4082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2968    0.2582    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  9 13  4  0  0  0  0
  9 10  1  0  0  0  0
  7 11  1  0  0  0  0
 12 15  4  0  0  0  0
 13 16  4  0  0  0  0
  6 14  1  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 24 25  4  0  0  0  0
  3  4  1  0  0  0  0
 23 25  4  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11354

>  <IDNUMBER>
BAS 00231557

>  <Activity>
0
$$$$
ASI55
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
   -0.0937   -0.7115    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.9100   -0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1545    0.0717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4798    0.5460    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  2  6  4  0  0  0  0
  5  7  4  0  0  0  0
  8  9  4  0  0  0  0
  6  9  4  0  0  0  0
 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
  1 12  1  0  0  0  0
 10 13  2  0  0  0  0
 11 14  2  0  0  0  0
  4 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
  3 18  1  0  0  0  0
 19 22  1  0  0  0  0
 20 21  1  0  0  0  0
 12 21  1  0  0  0  0
 15 22  1  0  0  0  0
 11 23  1  0  0  0  0
 10 24  1  0  0  0  0
  4  5  4  0  0  0  0
  7  8  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI55

>  <IDNUMBER>
BAS 00004267

>  <Activity>
0
$$$$
ASI22318
  Marvin  04201015132D          

 18 19  0  0  1  0            999 V2000
   -0.8978    0.0406    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3485    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0062   -0.4064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0702    0.2143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4447    0.6946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1860   -0.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3055    0.5283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4767   -0.1219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3166   -1.6922    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
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  3  9  2  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
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  2 13  1  0  0  0  0
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 13 15  1  0  0  0  0
 12 16  1  0  0  0  0
 11 17  1  0  0  0  0
  2 18  1  0  0  0  0
 10 12  4  0  0  0  0
  6 15  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22318

>  <IDNUMBER>
BAS 00333956

>  <Activity>
0
$$$$
ASI30588
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    0.9023   -0.4170    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3564   -0.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
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  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  4  9  2  0  0  0  0
  6 10  4  0  0  0  0
 10 11  1  0  0  0  0
  6 12  4  0  0  0  0
  8 13  1  0  0  0  0
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 10 15  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 16 19  4  0  0  0  0
 18 20  1  0  0  0  0
  2  5  4  0  0  0  0
 17 20  1  0  0  0  0
 15 19  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI30588

>  <IDNUMBER>
BAS 00395367

>  <Activity>
0
$$$$
ASI22577
  Marvin  04201015132D          

 29 32  0  0  1  0            999 V2000
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  2  3  1  0  0  0  0
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 12 14  1  0  0  0  0
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 15 16  1  0  0  0  0
 13 16  1  0  0  0  0
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  5 18  1  0  0  0  0
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  8 22  4  0  0  0  0
 17 23  1  0  0  0  0
 19 24  4  0  0  0  0
 20 25  4  0  0  0  0
 21 26  4  0  0  0  0
 22 27  4  0  0  0  0
 26 28  4  0  0  0  0
 24 29  4  0  0  0  0
 25 28  4  0  0  0  0
 27 29  4  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI22577

>  <IDNUMBER>
BAS 00335918

>  <Activity>
0
$$$$
ASI22271
  Marvin  04201015132D          

 27 28  0  0  1  0            999 V2000
    1.0918    0.4469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
  4  6  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
  7  9  1  0  0  0  0
  3 10  4  0  0  0  0
  3 11  4  0  0  0  0
  2 12  2  0  0  0  0
  7 13  2  0  0  0  0
 14 15  4  0  0  0  0
 11 15  4  0  0  0  0
 10 16  4  0  0  0  0
  8 17  2  0  0  0  0
  1 18  1  0  0  0  0
  8 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
  4 22  1  0  0  0  0
 19 23  1  0  0  0  0
 18 24  1  0  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
  4  5  1  0  0  0  0
 14 16  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI22271

>  <IDNUMBER>
BAS 00333799

>  <Activity>
0
$$$$
ASI33398
  Marvin  04201015132D          

 17 19  0  0  0  0            999 V2000
   -0.2271   -0.1358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2696    0.6960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6314   -0.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  1  0  0  0  0
  4  6  4  0  0  0  0
  5  7  1  0  0  0  0
  2  8  2  0  0  0  0
  9 14  1  0  0  0  0
  4 10  4  0  0  0  0
  6 11  4  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 10 16  4  0  0  0  0
 16 17  4  0  0  0  0
  3  6  4  0  0  0  0
  9 15  1  0  0  0  0
 11 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI33398

>  <IDNUMBER>
BAS 00411552

>  <Activity>
0
$$$$
ASI21128
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
   -0.6130    0.0590    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3204   -0.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0277    0.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3204    1.3086    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0277    0.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1592    1.2733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3027   -1.1966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1297   -0.3360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0122   -0.3007    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.7587   -0.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
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  3  7  1  0  0  0  0
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  1  9  1  0  0  0  0
 10 14  1  0  0  0  0
  4 11  4  0  0  0  0
  6 12  4  0  0  0  0
 13 15  1  0  0  0  0
 13 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
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  9 18  1  0  0  0  0
 11 19  4  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 12 22  4  0  0  0  0
  4  6  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI21128

>  <IDNUMBER>
BAS 00327130

>  <Activity>
0
$$$$
ASI14903
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.4036    0.1205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4036    0.9608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
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  7 10  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  1  0  0  0  0
  8 10  1  0  0  0  0
  4 11  4  0  0  0  0
  5 12  4  0  0  0  0
  5 13  4  0  0  0  0
  4 14  4  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
 18 22  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI14903

>  <IDNUMBER>
BAS 00282583

>  <Activity>
0
$$$$
ASI16324
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
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  1  5  1  0  0  0  0
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  4  7  1  0  0  0  0
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  2 10  1  0  0  0  0
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 13 18  4  0  0  0  0
  9 14  1  0  0  0  0
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 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 10 19  1  0  0  0  0
 20 21  4  0  0  0  0
  7 21  4  0  0  0  0
  6 22  4  0  0  0  0
 20 23  4  0  0  0  0
 16 24  4  0  0  0  0
 19 25  4  0  0  0  0
 19 26  4  0  0  0  0
 22 27  4  0  0  0  0
 27 28  4  0  0  0  0
 25 29  4  0  0  0  0
 26 30  4  0  0  0  0
 30 31  4  0  0  0  0
  2 14  1  0  0  0  0
 13 17  4  0  0  0  0
 29 31  4  0  0  0  0
 16 23  4  0  0  0  0
 24 28  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16324

>  <IDNUMBER>
BAS 00289810

>  <Activity>
0
$$$$
ASI22018
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
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  3 11  1  0  0  0  0
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 14 15  1  0  0  0  0
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 16 18  1  0  0  0  0
 19 20  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  5 10  1  0  0  0  0
  3  4  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI22018

>  <IDNUMBER>
BAS 00332353

>  <Activity>
0
$$$$
ASI11537
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -1.2538    0.2610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6360    0.3169    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  4  7  1  0  0  0  0
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  6  9  4  0  0  0  0
  4 10  2  0  0  0  0
  9 11  4  0  0  0  0
 12 20  1  0  0  0  0
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 13 14  2  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
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  6 18  1  0  0  0  0
  5 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 11 22  1  0  0  0  0
  8 11  4  0  0  0  0
 12 21  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI11537

>  <IDNUMBER>
BAS 00232443

>  <Activity>
0
$$$$
ASI23298
  Marvin  04201015132D          

 32 36  0  0  0  0            999 V2000
    2.7892    0.9936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7866    0.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
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  4  6  4  0  0  0  0
  7 12  1  0  0  0  0
  3  8  1  0  0  0  0
  9 10  1  0  0  0  0
  2 10  1  0  0  0  0
  7 11  1  0  0  0  0
 12 18  1  0  0  0  0
 13 17  1  0  0  0  0
  8 14  2  0  0  0  0
 11 15  1  0  0  0  0
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  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
  8 19  1  0  0  0  0
  3 20  4  0  0  0  0
  5 21  4  0  0  0  0
 20 22  4  0  0  0  0
 15 23  4  0  0  0  0
 15 24  4  0  0  0  0
 16 25  4  0  0  0  0
 16 26  4  0  0  0  0
 25 27  4  0  0  0  0
 26 28  4  0  0  0  0
 23 29  4  0  0  0  0
 24 30  4  0  0  0  0
 28 31  4  0  0  0  0
 30 32  4  0  0  0  0
  2  6  4  0  0  0  0
 21 22  4  0  0  0  0
  7 13  1  0  0  0  0
 27 31  4  0  0  0  0
 29 32  4  0  0  0  0
M  CHG  2   9   1  19  -1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI23298

>  <IDNUMBER>
BAS 00340391

>  <Activity>
0
$$$$
ASI11233
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
   -2.2900    0.6604    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2900   -1.4858    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.5202    1.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5095   -0.7669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9249    2.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6947    1.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7504    2.0716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4883    0.6391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2 15  1  0  0  0  0
  3  7  4  0  0  0  0
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  5  9  2  0  0  0  0
  6 10  2  0  0  0  0
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  1 13  4  0  0  0  0
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 15 22  1  0  0  0  0
  1 16  1  0  0  0  0
 17 20  4  0  0  0  0
 18 19  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 16 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 21 24  1  0  0  0  0
  3 18  4  0  0  0  0
  4 17  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI11233

>  <IDNUMBER>
BAS 00229902

>  <Activity>
0
$$$$
ASI25423
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
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 11 12  1  0  0  0  0
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 12 15  4  0  0  0  0
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 14 17  4  0  0  0  0
 13 18  4  0  0  0  0
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 16 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
  3 10  1  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25423

>  <IDNUMBER>
BAS 00356648

>  <Activity>
0
$$$$
ASI30389
  Marvin  04201015132D          

 34 37  0  0  0  0            999 V2000
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  7  9  4  0  0  0  0
 29 33  1  0  0  0  0
  6 12  4  0  0  0  0
 31 34  1  0  0  0  0
M  CHG  2  13   1  14   1
M  END
>  <NAME>
ASI30389

>  <IDNUMBER>
BAS 00394574

>  <Activity>
0
$$$$
ASI23005
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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 13 15  1  0  0  0  0
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 17 20  4  0  0  0  0
 18 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  5  4  0  0  0  0
  7  8  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI23005

>  <IDNUMBER>
BAS 00338301

>  <Activity>
0
$$$$
1w4l_GL8
  Marvin  04201014582D          

 39 44  0  0  0  0            999 V2000
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 30 39  1  6  0  0  0
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 36 35  1  6  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <Activity>
1

>  <PDB_ID>
1w4l_GL8

$$$$
ASI21822
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
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  2  9  2  0  0  0  0
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 17 18  1  0  0  0  0
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 10 12  4  0  0  0  0
 16 18  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI21822

>  <IDNUMBER>
BAS 00331507

>  <Activity>
0
$$$$
ASI23296
  Marvin  04201015132D          

 29 33  0  0  0  0            999 V2000
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 17 23  4  0  0  0  0
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 27 29  4  0  0  0  0
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M  CHG  1   6   1
M  STY  1   1 DAT
M  SAL   1  1   2
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI23296

>  <IDNUMBER>
BAS 00340385

>  <Activity>
0
$$$$
ASI31371
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
  6 15  4  0  0  0  0
  7 16  4  0  0  0  0
  9 17  4  0  0  0  0
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 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
 19 22  4  0  0  0  0
  4  5  1  0  0  0  0
 17 22  4  0  0  0  0
 18 21  4  0  0  0  0
M  CHG  2   4   1   8   1
M  END
>  <NAME>
ASI31371

>  <IDNUMBER>
BAS 00401543

>  <Activity>
0
$$$$
ASI28371
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.7608    0.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3782   -2.2920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  2  0  0  0  0
  2  4  4  0  0  0  0
  3  5  1  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  5  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  8 11  1  0  0  0  0
  2 12  1  0  0  0  0
 10 13  4  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
 16 19  4  0  0  0  0
 15 20  4  0  0  0  0
 18 21  4  0  0  0  0
 19 22  4  0  0  0  0
  4  7  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI28371

>  <IDNUMBER>
BAS 00383199

>  <Activity>
0
$$$$
ASI17978
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.6024    0.4841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1184    1.1079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  2  7  1  0  0  0  0
  4  8  4  0  0  0  0
  7  9  3  0  0  0  0
  4 10  4  0  0  0  0
 10 11  4  0  0  0  0
  8 12  4  0  0  0  0
  5 13  1  0  0  0  0
 14 16  1  0  0  0  0
  6 15  1  0  0  0  0
  8 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 13 20  1  0  0  0  0
 15 21  1  0  0  0  0
 19 22  1  0  0  0  0
  5  6  4  0  0  0  0
 11 12  4  0  0  0  0
 20 21  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI17978

>  <IDNUMBER>
BAS 00311431

>  <Activity>
0
$$$$
ASI227
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.2273   -0.4584    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7006    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8299   -0.1368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  1  0  0  0  0
  5  9  4  0  0  0  0
  7 10  4  0  0  0  0
  8 11  2  0  0  0  0
  1 12  1  0  0  0  0
  4 13  1  0  0  0  0
  2 14  1  0  0  0  0
  8 15  1  0  0  0  0
 15 16  1  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
 16 19  1  0  0  0  0
  4  5  4  0  0  0  0
  9 10  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI227

>  <IDNUMBER>
BAS 00009535

>  <Activity>
0
$$$$
ASI15613
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.3860   -0.7554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3860    0.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0863   -1.1745    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8087    0.0883    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0863    0.4853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5201   -1.1745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0863    1.3400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  6  7  4  0  0  0  0
  4  7  4  0  0  0  0
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  2  9  4  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  2  0  0  0  0
 13 19  1  0  0  0  0
  6 14  1  0  0  0  0
  4 15  1  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  6  8  4  0  0  0  0
  5  9  4  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI15613

>  <IDNUMBER>
BAS 00286876

>  <Activity>
0
$$$$
2gyu_HI6
  Marvin  04201014582D          

 21 22  0  0  0  0            999 V2000
   19.9035   11.8725    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.1891   11.4600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.1891    8.9850    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4 21  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  1  0  0  0  0
  7 20  4  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 16  4  0  0  0  0
 11 12  4  0  0  0  0
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 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  2   7   1  11   1
M  END
>  <Activity>
1

>  <PDB_ID>
2gyu_HI6

$$$$
ASI15383
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.8653   -0.3944    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5717    0.1021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3 10  2  0  0  0  0
 11 15  4  0  0  0  0
  7 12  1  0  0  0  0
 13 22  1  0  0  0  0
 14 18  4  0  0  0  0
 15 17  4  0  0  0  0
 11 16  1  0  0  0  0
 12 17  4  0  0  0  0
 12 18  4  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 16 23  1  0  0  0  0
 16 24  1  0  0  0  0
  4  5  1  0  0  0  0
 13 21  1  0  0  0  0
 11 14  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15383

>  <IDNUMBER>
BAS 00285544

>  <Activity>
0
$$$$
ASI31899
  Marvin  04201015132D          

 16 16  0  0  0  0            999 V2000
   -0.1371    0.3881    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.7373    0.4114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8564   -0.0466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5821    0.8201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2949   -0.3260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5537    1.1099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0206    0.8201    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5782    0.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7373   -0.4191    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5782   -1.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0089   -1.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  8  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  1  6  2  0  0  0  0
  2  7  2  0  0  0  0
  8 12  1  0  0  0  0
  3  9  4  0  0  0  0
  3 10  4  0  0  0  0
  2 11  1  0  0  0  0
  4 12  1  0  0  0  0
 10 13  4  0  0  0  0
  9 14  4  0  0  0  0
 13 15  4  0  0  0  0
 15 16  1  0  0  0  0
 14 15  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI31899

>  <IDNUMBER>
BAS 00403978

>  <Activity>
0
$$$$
ASI12601
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.7848    0.7552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1132    1.2423    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2927   -0.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5486    0.7626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5363   -0.0344    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8438   -0.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5892    1.0209    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6506   -0.4600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3702    1.0455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2263   -1.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2017    0.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0025   -1.8647    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    3.0233   -0.8979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0320   -0.3296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9963    0.7134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7207    0.4969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2890   -0.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6322   -0.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4169   -0.6543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  2  0  0  0  0
  1  7  2  0  0  0  0
  6  8  1  0  0  0  0
  4  9  2  0  0  0  0
  8 10  4  0  0  0  0
  7 11  1  0  0  0  0
 10 12  1  0  0  0  0
  8 13  4  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 13 17  4  0  0  0  0
 17 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  4  1  0  0  0  0
 19 21  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI12601

>  <IDNUMBER>
BAS 00253527

>  <Activity>
0
$$$$
ASI16605
  Marvin  04201015132D          

 30 34  0  0  1  0            999 V2000
   -2.0396   -0.2671    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9542    0.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8512   -0.4805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7231    0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2677    0.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1716    0.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4027   -0.0641    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8551   -0.1709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3668   -0.7796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8329   -0.6835    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.0153   -0.9398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2464    1.1105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5979   -0.4805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5812    0.1922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7620    0.4485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3174   -0.8757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8375   -1.0892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5485   -1.1961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4485    0.3416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  6  7  1  0  0  0  0
  7 16  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  1  0  0  0  0
 10 19  1  0  0  0  0
  8 11  4  0  0  0  0
  6 12  2  0  0  0  0
  9 13  1  0  0  0  0
  8 14  4  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 11 17  4  0  0  0  0
 14 18  4  0  0  0  0
 13 19  1  0  0  0  0
 10 20  1  0  0  0  0
 10 21  1  0  0  0  0
 13 22  1  0  0  0  0
  2 23  4  0  0  0  0
  3 24  4  0  0  0  0
  5 25  4  0  0  0  0
  4 26  4  0  0  0  0
 24 27  4  0  0  0  0
 28 30  4  0  0  0  0
 27 29  4  0  0  0  0
 23 30  4  0  0  0  0
  4  5  4  0  0  0  0
 25 29  4  0  0  0  0
 26 28  4  0  0  0  0
  7 15  1  0  0  0  0
 17 18  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI16605

>  <IDNUMBER>
BAS 00291886

>  <Activity>
0
$$$$
ASI23400
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
   -0.7848   -0.1076    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3880    1.1530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2040    1.1530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1218    0.3598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4334    0.3683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8018   -0.9320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6743    0.2040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2493    0.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3201   -1.3541    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1558    1.7734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7621    1.7451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0878   -1.3598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5695    1.5638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5355    2.1955    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.1048   -2.1870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  9 13  1  0  0  0  0
  2 10  4  0  0  0  0
  3 11  4  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
  7 16  4  0  0  0  0
  8 17  4  0  0  0  0
 15 18  1  0  0  0  0
 14 19  1  0  0  0  0
 12 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
  2  3  4  0  0  0  0
 15 17  4  0  0  0  0
 10 14  4  0  0  0  0
 23 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI23400

>  <IDNUMBER>
BAS 00340846

>  <Activity>
0
$$$$
ASI28452
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.6141   -0.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1139    1.2944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1994   -0.4848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  4 10  1  0  0  0  0
  5  9  4  0  0  0  0
  6 12  1  0  0  0  0
  7 11  2  0  0  0  0
  1  8  4  0  0  0  0
  8  9  4  0  0  0  0
  7 10  1  0  0  0  0
  1 11  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  2  0  0  0  0
  2 14  1  0  0  0  0
  3 15  1  0  0  0  0
  9 16  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  2  5  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI28452

>  <IDNUMBER>
BAS 00384334

>  <Activity>
0
$$$$
ASI30158
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    0.0733   -0.2061    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5025   -0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3559   -0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3559   -1.0307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5089    0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5089    1.0398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  4  0  0  0  0
  2  3  1  0  0  0  0
  1  4  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  1 10  4  0  0  0  0
  3 11  1  0  0  0  0
 12 13  4  0  0  0  0
 10 13  4  0  0  0  0
  9 14  4  0  0  0  0
  9 15  4  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  4  0  0  0  0
 14 19  4  0  0  0  0
 18 20  4  0  0  0  0
  2 12  4  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30158

>  <IDNUMBER>
BAS 00393722

>  <Activity>
0
$$$$
ASI8546
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
    2.4609   -1.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.3656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2422   -0.3656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -1.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0390    1.0547    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0233   -1.6874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8593   -0.3656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7593   -1.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6749   -0.5437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0047   -1.0828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6655    1.0547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0047    0.3375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8015    0.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2093    1.0547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4468    0.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4468    1.7484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2577    1.7484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2858    0.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  1  4  1  0  0  0  0
  5 14  1  0  0  0  0
  1  6  4  0  0  0  0
  1  7  4  0  0  0  0
  6  8  4  0  0  0  0
  7  9  4  0  0  0  0
  2 10  2  0  0  0  0
 11 17  1  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  1  0  0  0  0
  8  9  4  0  0  0  0
 11 18  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI8546

>  <IDNUMBER>
BAS 00166244

>  <Activity>
0
$$$$
ASI19917
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
   -0.6098    0.1085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0180    0.8216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067    0.0982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1679   -0.4909    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6149    0.8113    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6149   -0.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8241    0.6511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2273    1.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5994    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8861   -0.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4365   -0.6356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6924    2.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067   -1.3487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8396   -1.3590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3048    2.9662    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4210   -2.0566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6304   -2.0566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5090    2.2066    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.8706    0.0775    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5217    1.1059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8086   -2.8008    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6302   -0.5064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7647    0.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6252   -2.8215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2658    0.7338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3124   -0.0465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  1  4  4  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  2  7  4  0  0  0  0
  5  8  1  0  0  0  0
  2  9  1  0  0  0  0
  4 10  4  0  0  0  0
  6 11  4  0  0  0  0
  8 12  1  0  0  0  0
  6 13  4  0  0  0  0
 11 14  4  0  0  0  0
 12 15  2  0  0  0  0
 16 17  4  0  0  0  0
 13 17  4  0  0  0  0
 12 18  1  0  0  0  0
 11 19  1  0  0  0  0
  7 20  4  0  0  0  0
 16 21  1  0  0  0  0
 10 22  4  0  0  0  0
 19 23  1  0  0  0  0
 21 24  1  0  0  0  0
 20 25  4  0  0  0  0
 22 26  4  0  0  0  0
  7 10  4  0  0  0  0
  8  9  1  0  0  0  0
 25 26  4  0  0  0  0
 14 16  4  0  0  0  0
M  CHG  2   5   1  18  -1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI19917

>  <IDNUMBER>
BAS 00319122

>  <Activity>
0
$$$$
ASI27395
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
    0.7556    0.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2986    0.8688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2986   -0.4525    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4797    0.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4797   -0.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5836    0.1991    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5565    1.6515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9954   -0.4932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3664    1.8054    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5836   -1.2127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8189   -0.4932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0136    2.2624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1991    1.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3394   -1.9321    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1991   -0.6290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7556   -1.2127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7239   -2.6244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4797   -1.9321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8959   -2.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7873    2.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9140    0.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9140   -0.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3077    2.7149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
  8 11  2  0  0  0  0
  7 12  1  0  0  0  0
  4 13  1  0  0  0  0
 14 16  1  0  0  0  0
  5 15  1  0  0  0  0
 10 16  1  0  0  0  0
 17 19  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 12 20  1  0  0  0  0
 13 21  1  0  0  0  0
 15 22  1  0  0  0  0
 20 23  1  0  0  0  0
  4  5  4  0  0  0  0
 21 22  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI27395

>  <IDNUMBER>
BAS 00379907

>  <Activity>
0
$$$$
ASI17981
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.8043    0.0158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3090    0.6940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0923    0.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0923   -0.3996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3090   -0.6729    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0315    0.0158    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0829    1.4720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8020   -0.8201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4312   -0.7045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6665    2.0345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8020   -1.5876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0315   -1.4299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8663   -0.0999    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.8020    0.8411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2670   -0.7045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2997    1.6928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6443   -0.3259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5013   -0.3996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5013    0.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3996    1.1144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2752    0.2524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8757   -1.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1093    1.3459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0690    0.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6800   -1.3248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2845   -0.7412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  4  5  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  2  0  0  0  0
  9 12  2  0  0  0  0
 13 15  1  0  0  0  0
  3 14  1  0  0  0  0
  9 15  1  0  0  0  0
  7 16  1  0  0  0  0
 13 17  1  0  0  0  0
  8 18  1  0  0  0  0
 14 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 17 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
 25 26  1  0  0  0  0
  3  4  4  0  0  0  0
 18 19  1  0  0  0  0
 24 26  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI17981

>  <IDNUMBER>
BAS 00311438

>  <Activity>
0
$$$$
ASI30099
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.8739   -0.5586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3192   -1.1652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4549    0.1755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4310   -0.8260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6999   -0.5586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3512    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1029   -1.2809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9817    0.5387    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4549   -1.9952    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7981    0.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9050   -1.2809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7478    0.2713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1029    0.1556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2881   -2.0272    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3624    0.8021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9210    0.1556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3480   -0.5746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1908    1.6121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1286    0.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7814    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7470    1.0894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5675    1.8994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  1  0  0  0  0
  5  7  4  0  0  0  0
  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  7 11  4  0  0  0  0
  8 12  1  0  0  0  0
  5 13  4  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  4  0  0  0  0
 16 17  4  0  0  0  0
 15 18  4  0  0  0  0
 15 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  6  1  0  0  0  0
 11 17  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI30099

>  <IDNUMBER>
BAS 00393531

>  <Activity>
0
$$$$
ASI30162
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    0.7192   -0.2840    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1438   -0.2840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8584    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4338    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7283   -0.2840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0046    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4292    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5730   -0.2840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7283   -1.1040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1576   -0.2840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4292    0.9620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8584    0.9573    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  3 12  1  0  0  0  0
  1 13  4  0  0  0  0
 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
 10 16  4  0  0  0  0
 17 19  4  0  0  0  0
 14 18  1  0  0  0  0
 13 19  4  0  0  0  0
  2 17  4  0  0  0  0
 14 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30162

>  <IDNUMBER>
BAS 00393739

>  <Activity>
0
$$$$
ASI1032
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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    0.6028    0.4790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
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  1  6  1  0  0  0  0
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 12 13  4  0  0  0  0
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 16 17  1  0  0  0  0
 15 18  1  0  0  0  0
  3  5  1  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI1032

>  <IDNUMBER>
BAS 00060469

>  <Activity>
0
$$$$
ASI10914
  Marvin  04201015132D          

 20 20  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
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  1  4  2  0  0  0  0
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 12 13  1  0  0  0  0
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 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
  6  9  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10914

>  <IDNUMBER>
BAS 00226683

>  <Activity>
0
$$$$
2cmf_F11
  Marvin  04201014582D          

 35 40  0  0  0  0            999 V2000
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 31 32  4  0  0  0  0
 32 33  4  0  0  0  0
 33 34  4  0  0  0  0
 34 35  4  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
2cmf_F11

$$$$
ASI27149
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
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 13 20  1  0  0  0  0
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 22 25  1  0  0  0  0
 20 26  1  0  0  0  0
  3  7  4  0  0  0  0
 16 24  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27149

>  <IDNUMBER>
BAS 00371687

>  <Activity>
0
$$$$
ASI22489
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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 16 21  1  0  0  0  0
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  8 19  1  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI22489

>  <IDNUMBER>
BAS 00334925

>  <Activity>
0
$$$$
ASI27146
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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  3  7  4  0  0  0  0
 21 25  4  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI27146

>  <IDNUMBER>
BAS 00371678

>  <Activity>
0
$$$$
ASI10852
  Marvin  04201015132D          

 18 19  0  0  1  0            999 V2000
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 17 18  4  0  0  0  0
  2 14  1  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10852

>  <IDNUMBER>
BAS 00226280

>  <Activity>
0
$$$$
ASI14614
  Marvin  04201015132D          

 34 38  0  0  0  0            999 V2000
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 10 20  1  0  0  0  0
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 10 18  1  0  0  0  0
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 30 34  4  0  0  0  0
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 27 28  4  0  0  0  0
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 31 33  4  0  0  0  0
 29 34  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI14614

>  <IDNUMBER>
BAS 00280457

>  <Activity>
0
$$$$
ASI19238
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
  7  9  4  0  0  0  0
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M  CHG  1  16   1
M  STY  1   1 DAT
M  SAL   1  1   7
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI19238

>  <IDNUMBER>
BAS 00316181

>  <Activity>
0
$$$$
ASI6559
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
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 26 27  4  0  0  0  0
 16 22  1  0  0  0  0
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M  CHG  1   4   1
M  END
>  <NAME>
ASI6559

>  <IDNUMBER>
BAS 00138315

>  <Activity>
0
$$$$
ASI13067
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.2023   -0.4272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9398    0.3539    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1312   -0.4272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1342    0.3539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5218   -0.9063    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9865   -0.6866    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8910   -0.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4922   -0.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2794   -0.4059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5937   -0.1282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3509    1.0344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3993   -0.3814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8928    0.1312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5763   -1.1992    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4259   -1.1992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6861   -0.1190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3426    0.6439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9407    1.2053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4259    0.6774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7188    0.9520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0279    0.1648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1918   -1.4799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2995    0.4486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0392    1.2572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8387    1.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  4  0  0  0  0
  6 10  1  0  0  0  0
  4 11  2  0  0  0  0
 10 12  4  0  0  0  0
  9 13  4  0  0  0  0
 12 14  1  0  0  0  0
  9 15  1  0  0  0  0
 13 16  1  0  0  0  0
  8 17  4  0  0  0  0
 17 18  4  0  0  0  0
 10 19  4  0  0  0  0
 18 20  4  0  0  0  0
 12 21  4  0  0  0  0
 15 22  1  0  0  0  0
 16 23  1  0  0  0  0
 19 24  4  0  0  0  0
 24 25  4  0  0  0  0
  3  4  1  0  0  0  0
 21 25  4  0  0  0  0
 13 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI13067

>  <IDNUMBER>
BAS 00257781

>  <Activity>
0
$$$$
ASI5644
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
    0.7942   -0.1559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5180    0.2765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0810   -0.1307    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2318   -0.1559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7942   -0.9601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4835   -0.9601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0754    0.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9406    0.2765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6494   -0.1206    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3572    0.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6334   -0.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7949    0.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0810   -0.9601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5180    1.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2318    1.4980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5036   -0.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7949   -1.3672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9406    1.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3 10  1  0  0  0  0
  2  4  4  0  0  0  0
  1  5  2  0  0  0  0
  6 16  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  4  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
  7 11  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  2 14  4  0  0  0  0
 14 15  4  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  4  0  0  0  0
  8 18  4  0  0  0  0
  6 17  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI5644

>  <IDNUMBER>
BAS 00130537

>  <Activity>
0
$$$$
ASI20065
  Marvin  04201015132D          

 28 33  0  0  1  0            999 V2000
    0.9033   -0.6407    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3844   -0.1409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5254   -1.3422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3492   -0.4004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0769   -1.0539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9225   -0.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0187   -0.1409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8104    1.3871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8164   -1.3422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6568    0.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0757   -0.6407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7266   -0.4581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9701    0.3428    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8328   -1.8035    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8328    0.2947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3844    1.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3192   -2.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1922    0.4965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8863   -0.4869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7870    0.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3839    0.9258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4229    1.6946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1170   -1.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7175    1.0411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4019   -1.1180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0336    1.3422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6337    1.7555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4410    1.9349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  1 12  1  0  0  0  0
 12 13  1  0  0  0  0
  3 14  2  0  0  0  0
  2 15  2  0  0  0  0
  8 16  4  0  0  0  0
  9 17  4  0  0  0  0
 10 18  4  0  0  0  0
 11 19  4  0  0  0  0
 13 20  1  0  0  0  0
 13 21  1  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 27 28  1  0  0  0  0
  4  5  1  0  0  0  0
  9 11  4  0  0  0  0
  8 10  4  0  0  0  0
 26 28  1  0  0  0  0
 23 25  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI20065

>  <IDNUMBER>
BAS 00319565

>  <Activity>
0
$$$$
ASI24142
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.2164   -0.1775    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0154   -0.4162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3939   -0.7601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5204    0.2497    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.2041   -1.2152    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0056    0.6825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2108   -1.5592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1930   -0.5493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3805    0.2497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9809   -1.5814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7934    0.8879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5660    1.2651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7645   -1.1153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4094    0.2441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8799   -0.3829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7190   -1.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0321    1.6869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3496    2.0365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5636   -0.9045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2084    0.4550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4495    2.2806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7910   -0.1165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
  8 13  4  0  0  0  0
  8 14  4  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
 15 16  1  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24142

>  <IDNUMBER>
BAS 00344298

>  <Activity>
0
$$$$
ASI10938
  Marvin  04201015132D          

 31 33  0  0  1  0            999 V2000
    3.0432    0.3528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4946    0.9538    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6840    0.7721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8537    0.5346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8055   -0.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3319    1.1914    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.1619   -0.3354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4232   -0.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3786   -1.0412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1285    1.3731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5925   -0.9364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7819   -0.7547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500   -0.0140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1891   -0.8525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4962    1.0062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9620   -0.5555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7302    0.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5303    0.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1607   -0.3878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5101    0.3843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1467    1.9984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9984   -0.6219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1052    1.3276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6092   -1.9426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8126   -1.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9383    0.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1856   -1.3556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7446   -1.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5315    0.0489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5148    1.0377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3219    0.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6 10  1  0  0  0  0
  7 11  4  0  0  0  0
  4  8  4  0  0  0  0
  5  9  4  0  0  0  0
  3 10  1  0  0  0  0
 11 12  1  0  0  0  0
 12 18  1  0  0  0  0
  3 13  2  0  0  0  0
  9 14  4  0  0  0  0
  6 15  1  0  0  0  0
  7 16  4  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
  6 20  1  0  0  0  0
  6 21  1  0  0  0  0
  5 22  1  0  0  0  0
  4 23  1  0  0  0  0
 24 25  4  0  0  0  0
 11 25  4  0  0  0  0
  7 26  4  0  0  0  0
 24 27  4  0  0  0  0
 14 28  1  0  0  0  0
 16 29  4  0  0  0  0
 26 30  4  0  0  0  0
 30 31  4  0  0  0  0
  8 14  4  0  0  0  0
 16 27  4  0  0  0  0
 29 31  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI10938

>  <IDNUMBER>
BAS 00226779

>  <Activity>
0
$$$$
ASI15374
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -1.1902    1.1019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4584    1.4471    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2817    0.1132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1298    0.8423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0881    0.2679    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0497   -0.6351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8644   -0.7236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9193    1.4996    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0270   -1.5630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4909   -0.8865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  8  2  0  0  0  0
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 12 13  4  0  0  0  0
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  3  4  1  0  0  0  0
 24 26  4  0  0  0  0
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M  CHG  1   8   1
M  END
>  <NAME>
ASI15374

>  <IDNUMBER>
BAS 00285524

>  <Activity>
0
$$$$
ASI24432
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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 11 13  4  0  0  0  0
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  6 15  4  0  0  0  0
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 18 20  4  0  0  0  0
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 16 20  4  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
  4  5  1  0  0  0  0
 18 19  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24432

>  <IDNUMBER>
BAS 00345469

>  <Activity>
0
$$$$
ASI14584
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
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  2  5  4  0  0  0  0
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  8 13  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   1   1
M  STY  1   1 DAT
M  SAL   1  1   1
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI14584

>  <IDNUMBER>
BAS 00279464

>  <Activity>
0
$$$$
ASI28879
  Marvin  04201015132D          

 31 36  0  0  1  0            999 V2000
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 27 31  1  0  0  0  0
  5  7  4  0  0  0  0
 19 21  1  0  0  0  0
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 26 31  1  0  0  0  0
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M  CHG  1  14   1
M  END
>  <NAME>
ASI28879

>  <IDNUMBER>
BAS 00386722

>  <Activity>
0
$$$$
ASI22385
  Marvin  04201015132D          

 19 22  0  0  1  0            999 V2000
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 17 18  4  0  0  0  0
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 13 19  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI22385

>  <IDNUMBER>
BAS 00334615

>  <Activity>
0
$$$$
ASI28813
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
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    2.4883   -3.1436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  1  5  1  0  0  0  0
  2  6  4  0  0  0  0
  7 12  1  0  0  0  0
  5  8  1  0  0  0  0
  9 14  1  0  0  0  0
  4 10  4  0  0  0  0
  5 11  2  0  0  0  0
  9 12  1  0  0  0  0
  6 13  4  0  0  0  0
  8 14  1  0  0  0  0
 10 15  4  0  0  0  0
 13 16  4  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
 15 22  1  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
  4  6  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI28813

>  <IDNUMBER>
BAS 00386252

>  <Activity>
0
$$$$
ASI23372
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  6 10  1  0  0  0  0
  6  7  3  0  0  0  0
  8 15  1  0  0  0  0
  9 13  1  0  0  0  0
  1 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 14  1  0  0  0  0
 11 13  1  0  0  0  0
  8 14  1  0  0  0  0
  7 15  1  0  0  0  0
  3 16  4  0  0  0  0
  2 17  4  0  0  0  0
  4 18  4  0  0  0  0
  5 19  4  0  0  0  0
  9 20  1  0  0  0  0
 21 22  1  0  0  0  0
 20 22  1  0  0  0  0
 23 26  4  0  0  0  0
 24 25  4  0  0  0  0
 16 25  4  0  0  0  0
 17 26  4  0  0  0  0
  4  5  4  0  0  0  0
 18 23  4  0  0  0  0
 19 24  4  0  0  0  0
  9 12  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI23372

>  <IDNUMBER>
BAS 00340766

>  <Activity>
0
$$$$
ASI15793
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
   -1.9436   -0.4606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7484   -0.4606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1533   -1.1641    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7484   -1.8677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3124    1.7209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  5  6  4  0  0  0  0
  3  7  1  0  0  0  0
  2  8  4  0  0  0  0
  3  9  4  0  0  0  0
 10 16  1  0  0  0  0
  8 11  4  0  0  0  0
 12 18  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 10 18  1  0  0  0  0
  5 19  1  0  0  0  0
 15 20  1  0  0  0  0
  6 21  1  0  0  0  0
 20 22  4  0  0  0  0
 20 23  4  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
 22 26  4  0  0  0  0
 23 27  4  0  0  0  0
 27 28  4  0  0  0  0
  4  6  4  0  0  0  0
  9 11  4  0  0  0  0
 10 17  1  0  0  0  0
 21 25  1  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15793

>  <IDNUMBER>
BAS 00287760

>  <Activity>
0
$$$$
ASI31880
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
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    3.0041   -1.0698    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1577    0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4328   -0.3554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1834   -1.0698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3370    1.1980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3370   -0.4579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5129    0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8283    0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5790    1.0918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5790   -0.3554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4032   -0.3554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4032    1.0918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0041    0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6526    0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  4  0  0  0  0
  1  3  1  0  0  0  0
  4 14  4  0  0  0  0
  5 15  4  0  0  0  0
  1  6  2  0  0  0  0
  1  7  2  0  0  0  0
  1  8  1  0  0  0  0
  9 13  4  0  0  0  0
  3 10  4  0  0  0  0
  3 11  4  0  0  0  0
 11 12  4  0  0  0  0
 10 13  4  0  0  0  0
 14 19  4  0  0  0  0
 15 17  1  0  0  0  0
  2 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
 15 19  4  0  0  0  0
  4 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
  9 12  4  0  0  0  0
  2  4  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI31880

>  <IDNUMBER>
BAS 00403826

>  <Activity>
0
$$$$
ASI3314
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    1.0180    1.2741    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3194    1.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1976   -1.6933    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8483   -0.9880    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.3693   -1.6933    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.9069   -2.4418    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
  9 13  1  0  0  0  0
  2 10  2  0  0  0  0
  6 11  2  0  0  0  0
  3 12  2  0  0  0  0
  6 13  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
  9 16  2  0  0  0  0
 16 17  1  0  0  0  0
 18 24  4  0  0  0  0
 19 20  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 18 22  1  0  0  0  0
 23 25  4  0  0  0  0
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 17 25  4  0  0  0  0
 17 26  4  0  0  0  0
 19 27  1  0  0  0  0
 27 28  1  0  0  0  0
  4  5  1  0  0  0  0
 19 21  4  0  0  0  0
 18 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3314

>  <IDNUMBER>
BAS 00105050

>  <Activity>
0
$$$$
ASI24642
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
    0.1874   -0.6128    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  9 13  1  0  0  0  0
  4 14  4  0  0  0  0
  5 15  4  0  0  0  0
  8 16  4  0  0  0  0
 13 17  1  0  0  0  0
 12 18  4  0  0  0  0
 15 19  4  0  0  0  0
 14 20  4  0  0  0  0
 16 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  5  4  0  0  0  0
 19 20  4  0  0  0  0
 12 17  1  0  0  0  0
 18 22  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24642

>  <IDNUMBER>
BAS 00347355

>  <Activity>
0
$$$$
ASI14743
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
   -2.9086   -0.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2144    0.3671    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4973   -0.8720    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7831    1.1846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  5  1  0  0  0  0
  4 10  4  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  1  0  0  0  0
  1  8  2  0  0  0  0
  9 20  1  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
  3 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  4  0  0  0  0
 13 15  4  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
  9 21  1  0  0  0  0
  4 11  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI14743

>  <IDNUMBER>
BAS 00281501

>  <Activity>
0
$$$$
ASI23293
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.7020    0.1086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6872    0.1086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1510    0.7992    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1411    0.7992    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2052   -0.5377    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  1  3  2  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  7 13  1  0  0  0  0
  1  8  1  0  0  0  0
  6  9  1  0  0  0  0
  5 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 14  1  0  0  0  0
 11 13  1  0  0  0  0
  8 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
  9 15  1  0  0  0  0
  7 12  1  0  0  0  0
 10 16  1  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI23293

>  <IDNUMBER>
BAS 00340382

>  <Activity>
0
$$$$
ASI10564
  Marvin  04201015132D          

 20 23  0  0  0  0            999 V2000
   -0.4397   -0.1162    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2375    0.3639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1220    0.3891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8339    1.1674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2577   -1.3797    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7133   -2.2035    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0613    0.1719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9255    0.2426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5559    1.7739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1884    1.6274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4562    0.8743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3797    1.5768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  8 15  1  0  0  0  0
  2  9  4  0  0  0  0
  3 10  4  0  0  0  0
  5 11  4  0  0  0  0
  4 12  4  0  0  0  0
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  7 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 17 19  4  0  0  0  0
  9 18  4  0  0  0  0
 10 19  4  0  0  0  0
 18 20  4  0  0  0  0
  4  5  4  0  0  0  0
  8 16  1  0  0  0  0
 11 17  4  0  0  0  0
 12 20  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10564

>  <IDNUMBER>
BAS 00222462

>  <Activity>
0
$$$$
ASI11179
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
   -1.5793   -0.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8297   -0.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2471   -1.3358    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7861   -1.1340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6507   -0.0626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3288    0.6017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9011   -0.8488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1600   -0.5844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6226   -0.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6628    1.3601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3270    0.2226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5113    0.5148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  2  6  1  0  0  0  0
  3  7  4  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  6 10  2  0  0  0  0
  8 11  2  0  0  0  0
 12 14  1  0  0  0  0
  6 13  1  0  0  0  0
  9 14  1  0  0  0  0
  7 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 15 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5  7  4  0  0  0  0
 22 24  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI11179

>  <IDNUMBER>
BAS 00229073

>  <Activity>
0
$$$$
ASI30663
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -2.4498   -0.5155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4498    0.3194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
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  2  9  4  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
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 13 19  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 13 18  1  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   8
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI30663

>  <IDNUMBER>
BAS 00396117

>  <Activity>
0
$$$$
ASI21155
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.3434    0.1605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3733   -1.0751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2438   -0.2314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  4  0  0  0  0
  2  3  1  0  0  0  0
  1  4  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  4  0  0  0  0
  2  8  4  0  0  0  0
  3  9  2  0  0  0  0
  3 10  1  0  0  0  0
  7 11  4  0  0  0  0
 12 16  1  0  0  0  0
  7 13  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 10 18  4  0  0  0  0
 10 19  4  0  0  0  0
 13 20  1  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
  8 11  4  0  0  0  0
 12 17  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI21155

>  <IDNUMBER>
BAS 00327258

>  <Activity>
0
$$$$
ASI22620
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.2983    1.0347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060    0.2936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5127    1.0347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7364    0.2284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0047   -0.2190    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7830    1.7385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5474    0.0140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6267    1.7246    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4029    0.0979    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0487    1.6919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7711   -0.7783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8576   -2.8105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1021    2.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2811    1.6360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  2  0  0  0  0
  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  7 11  1  0  0  0  0
 11 12  4  0  0  0  0
 12 13  4  0  0  0  0
 13 14  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
 17 18  4  0  0  0  0
 11 18  4  0  0  0  0
 17 19  4  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 21 23  1  0  0  0  0
  4  5  1  0  0  0  0
 22 23  1  0  0  0  0
 13 19  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22620

>  <IDNUMBER>
BAS 00336198

>  <Activity>
0
$$$$
ASI18193
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
    0.9301   -0.6404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6189    0.1252    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2110    0.0680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3041   -1.1735    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3971   -0.7262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7029   -0.9194    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7406    0.7012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1842   -1.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3361   -0.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8245   -0.5116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5954    0.6404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1125    0.5188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2537    1.1448    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.2002    0.4150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1053   -0.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7029    0.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5866   -0.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7386   -0.1681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8227    0.9301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2305   -0.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3397    0.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.5363    0.7334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 11 13  1  0  0  0  0
  9 14  4  0  0  0  0
  9 15  4  0  0  0  0
 10 16  4  0  0  0  0
 10 17  4  0  0  0  0
 15 18  4  0  0  0  0
 14 19  4  0  0  0  0
 17 20  4  0  0  0  0
 16 21  4  0  0  0  0
 12 22  1  0  0  0  0
 22 23  1  0  0  0  0
  3  5  1  0  0  0  0
 11 18  4  0  0  0  0
 12 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18193

>  <IDNUMBER>
BAS 00312380

>  <Activity>
0
$$$$
ASI9156
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.2920    0.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4670    0.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0545   -0.6188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0545    0.7963    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1974    0.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1170    0.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5294   -0.6188    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.5581   -0.2865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7930    0.5070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7849   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7849    0.7963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7760   -0.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4180    0.8823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2143    1.0885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2920    0.9081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2920   -0.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8133   -1.0427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9420   -1.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2427   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6037    0.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  5 11  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  8 12  1  0  0  0  0
  8  9  2  0  0  0  0
  3 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
 13 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  9 20  1  0  0  0  0
  5 10  1  0  0  0  0
  9 14  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI9156

>  <IDNUMBER>
BAS 00190121

>  <Activity>
0
$$$$
ASI13907
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
   -0.9712   -0.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1381   -0.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3335    1.3026    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.1573    1.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2670   -0.8193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9712   -0.9343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7950   -0.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9712    0.7226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2670    0.5984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5004    1.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1000    0.5984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3335    0.4741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3335    2.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1573    2.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1573    0.4741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9904    1.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2092    0.5984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2092   -0.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6799   -2.1770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0423   -0.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0423    0.5984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2670   -2.1770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9712   -2.5867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4519   -0.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3 10  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  2  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  2  9  1  0  0  0  0
 10 11  1  0  0  0  0
  9 11  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  7 17  4  0  0  0  0
  6 18  4  0  0  0  0
  6 19  4  0  0  0  0
  7 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
 22 26  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI13907

>  <IDNUMBER>
BAS 00271556

>  <Activity>
0
$$$$
ASI21706
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.0559   -0.1818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7831    0.2237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0559   -1.0068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4962   -1.0068    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6525    0.2237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3656   -0.1818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3656   -1.0068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5428    0.4661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1678    0.7831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0742    0.2284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0835   -1.4123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3356    1.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7199    1.2725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2140   -1.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0695    1.0487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7966   -0.9881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  4  9  1  0  0  0  0
  1  5  4  0  0  0  0
  3  6  4  0  0  0  0
  5  7  4  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  7 10  4  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
  7 13  1  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
  4 18  1  0  0  0  0
 17 19  1  0  0  0  0
 13 20  1  0  0  0  0
 14 21  1  0  0  0  0
  4  8  1  0  0  0  0
  6 10  4  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI21706

>  <IDNUMBER>
BAS 00330940

>  <Activity>
0
$$$$
ASI16287
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
   -1.5160   -0.4668    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0318    0.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2907    0.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4725    0.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1787   -0.4668    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2136    0.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4463   -0.5454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7729   -0.4668    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7082   -0.4668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8311   -1.2536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  5  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  6  9  4  0  0  0  0
  7 22  1  0  0  0  0
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  2  9  4  0  0  0  0
 10 20  1  0  0  0  0
  1 11  1  0  0  0  0
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 13 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  7 17  1  0  0  0  0
 11 18  4  0  0  0  0
 11 19  4  0  0  0  0
 20 25  4  0  0  0  0
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
  5 23  1  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 17 26  1  0  0  0  0
 26 27  4  0  0  0  0
 26 28  4  0  0  0  0
 27 29  4  0  0  0  0
 28 30  4  0  0  0  0
 30 31  4  0  0  0  0
  7 21  1  0  0  0  0
 20 24  4  0  0  0  0
 29 31  4  0  0  0  0
  4  6  4  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI16287

>  <IDNUMBER>
BAS 00289650

>  <Activity>
0
$$$$
ASI16197
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    0.5755   -0.3600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3861   -0.3600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3191   -1.0751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  4  0  0  0  0
  3  7  1  0  0  0  0
  3  8  4  0  0  0  0
  7  9  2  0  0  0  0
  6 10  4  0  0  0  0
  6 11  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  7 14  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
 13 17  1  0  0  0  0
 12 18  1  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
  8 10  4  0  0  0  0
 17 20  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI16197

>  <IDNUMBER>
BAS 00289040

>  <Activity>
0
$$$$
ASI24201
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
    0.5784   -0.1605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3212   -0.8956    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6755   -0.8956    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    3.4668    0.5224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9070   -1.6121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9070   -0.1791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1609   -0.8770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4069    1.2725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8922    1.2203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  1  0  0  0  0
  3  5  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  4  0  0  0  0
  1  6  4  0  0  0  0
  1  7  1  0  0  0  0
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  3  9  1  0  0  0  0
 10 17  1  0  0  0  0
 11 16  1  0  0  0  0
  2 12  1  0  0  0  0
 13 15  4  0  0  0  0
  9 14  1  0  0  0  0
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  4 17  1  0  0  0  0
  8 18  1  0  0  0  0
  3 19  1  0  0  0  0
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 12 21  4  0  0  0  0
 12 22  4  0  0  0  0
 14 23  1  0  0  0  0
 14 24  1  0  0  0  0
 14 25  1  0  0  0  0
 21 26  4  0  0  0  0
 22 27  4  0  0  0  0
 27 28  4  0  0  0  0
  5 13  4  0  0  0  0
  2 11  1  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24201

>  <IDNUMBER>
BAS 00344505

>  <Activity>
0
$$$$
ASI10926
  Marvin  04201015132D          

 22 22  0  0  0  0            999 V2000
    1.0836    0.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2343   -1.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5201   -2.2492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3530    0.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0836    0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5201    0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8101   -0.9892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8101    0.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9183   -0.0657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  6  1  0  0  0  0
  4  9  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  2  0  0  0  0
  2  8  2  0  0  0  0
  9 13  4  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
  3 16  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  2 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10926

>  <IDNUMBER>
BAS 00226745

>  <Activity>
0
$$$$
ASI13363
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
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  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
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  2  9  1  0  0  0  0
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 11 22  1  0  0  0  0
  1 12  1  0  0  0  0
 13 20  4  0  0  0  0
  7 14  4  0  0  0  0
 14 15  4  0  0  0  0
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 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 16 22  1  0  0  0  0
 17 23  1  0  0  0  0
  4 24  1  0  0  0  0
 11 25  1  0  0  0  0
 14 26  4  0  0  0  0
 15 27  4  0  0  0  0
 25 28  1  0  0  0  0
 27 29  4  0  0  0  0
 26 30  4  0  0  0  0
  5  6  4  0  0  0  0
 13 21  4  0  0  0  0
 10 15  4  0  0  0  0
 29 30  4  0  0  0  0
 11 23  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI13363

>  <IDNUMBER>
BAS 00262404

>  <Activity>
0
$$$$
ASI24409
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
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   -2.2089    0.5654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  4  8  1  0  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  5  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  2 11  2  0  0  0  0
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  7 13  4  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 13 16  4  0  0  0  0
  7 17  4  0  0  0  0
 17 18  4  0  0  0  0
 18 19  4  0  0  0  0
 14 20  4  0  0  0  0
 14 21  4  0  0  0  0
 16 22  1  0  0  0  0
 15 23  4  0  0  0  0
 15 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
 20 27  4  0  0  0  0
 21 28  4  0  0  0  0
 26 29  4  0  0  0  0
 28 30  4  0  0  0  0
  5  6  1  0  0  0  0
 16 19  4  0  0  0  0
 27 30  4  0  0  0  0
 25 29  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24409

>  <IDNUMBER>
BAS 00345431

>  <Activity>
0
$$$$
ASI27786
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
   -0.5446    0.1997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1513   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4204    0.6354    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  4  0  0  0  0
  1  7  4  0  0  0  0
  8  9  4  0  0  0  0
  7  9  4  0  0  0  0
 10 22  1  0  0  0  0
 11 20  1  0  0  0  0
  6 12  1  0  0  0  0
  3 13  1  0  0  0  0
  9 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  4 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 15 22  1  0  0  0  0
 13 23  1  0  0  0  0
  6  8  4  0  0  0  0
 11 19  1  0  0  0  0
 10 21  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI27786

>  <IDNUMBER>
BAS 00381027

>  <Activity>
0
$$$$
ASI2654
  Marvin  04201015132D          

 25 29  0  0  0  0            999 V2000
   -1.6556   -0.9707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8656   -0.8446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1472   -1.6219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0549   -0.9707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9540   -1.3488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9834    1.2311    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.5884   -1.6219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9540   -0.4412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0549   -0.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6011    2.7775    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5673   -0.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3320   -1.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7773   -0.5841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  9 20  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
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 13 24  1  0  0  0  0
  2 14  4  0  0  0  0
  2 15  4  0  0  0  0
 16 18  4  0  0  0  0
 14 17  4  0  0  0  0
 15 18  4  0  0  0  0
 16 19  1  0  0  0  0
 20 21  1  0  0  0  0
 19 21  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7 11  1  0  0  0  0
  6 10  1  0  0  0  0
  6 12  1  0  0  0  0
 16 17  4  0  0  0  0
 13 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI2654

>  <IDNUMBER>
BAS 00096543

>  <Activity>
0
$$$$
ASI1137
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.4452    0.0891    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.2747    1.2580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  9  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  1  7  1  0  0  0  0
  5  8  4  0  0  0  0
  9 11  1  0  0  0  0
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  1 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  4  0  0  0  0
 12 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
  4 18  1  0  0  0  0
 17 19  4  0  0  0  0
  6 20  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
 22 23  1  0  0  0  0
  2  3  4  0  0  0  0
  6  8  4  0  0  0  0
 16 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI1137

>  <IDNUMBER>
BAS 00066295

>  <Activity>
0
$$$$
ASI12100
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    1.2730   -0.1560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1968   -0.1560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  7  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  2  9  1  0  0  0  0
  5 10  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  4  0  0  0  0
  5 13  2  0  0  0  0
  5 14  2  0  0  0  0
 12 15  4  0  0  0  0
  9 16  2  0  0  0  0
 10 17  4  0  0  0  0
 11 18  2  0  0  0  0
 19 20  4  0  0  0  0
 17 20  4  0  0  0  0
  1 21  1  0  0  0  0
  9 22  1  0  0  0  0
 11 23  1  0  0  0  0
 15 24  4  0  0  0  0
 19 25  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
  4  6  2  0  0  0  0
 15 19  4  0  0  0  0
 26 27  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12100

>  <IDNUMBER>
BAS 00243329

>  <Activity>
0
$$$$
ASI18709
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -1.2848   -0.1856    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4641   -0.1856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3183    1.6190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9744   -1.7898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8789    2.1908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1972   -2.5659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0561    1.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8975    1.9087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7293    1.8307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  3  6  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  4  0  0  0  0
  8 11  4  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 11 20  4  0  0  0  0
 10 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  5  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI18709

>  <IDNUMBER>
BAS 00314494

>  <Activity>
0
$$$$
ASI47
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.1284   -1.0993    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1284    0.2399    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3544   -0.4130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9068   -0.8454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9068   -0.0112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6210   -1.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1227    1.0491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6210    0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1116   -1.8972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3436   -0.8566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1830   -0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3436    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9263    1.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0690   -1.3141    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1579    2.0117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4927    0.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9152   -2.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9531    2.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2879    0.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5306    1.6099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  4  6  4  0  0  0  0
  2  7  1  0  0  0  0
  5  8  4  0  0  0  0
  1  9  1  0  0  0  0
  6 10  4  0  0  0  0
  3 11  1  0  0  0  0
 10 12  4  0  0  0  0
  7 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  4  0  0  0  0
 13 16  4  0  0  0  0
  9 17  1  0  0  0  0
 15 18  4  0  0  0  0
 16 19  4  0  0  0  0
 19 20  4  0  0  0  0
  2  5  4  0  0  0  0
  8 12  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI47

>  <IDNUMBER>
BAS 00004243

>  <Activity>
0
$$$$
ASI31324
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -0.6501   -0.6824    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6609   -1.0209    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1128   -1.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6125   -0.2150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1934    0.0107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4506   -0.8113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9664   -0.1934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2572    0.3008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6817    0.6071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7616   -0.3224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1760    1.2518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8865    0.7092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3646   -1.4238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3707   -2.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0638    2.1276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5480    1.4829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8590    1.9987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7576    2.9013    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.0309    0.0107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1067    1.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4668   -2.2566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0967   -2.7724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7515    1.6387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6541    0.5265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5252    1.3539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9187   -2.8422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  4  5  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  4  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  9 11  4  0  0  0  0
  9 12  4  0  0  0  0
  2 13  1  0  0  0  0
  3 14  1  0  0  0  0
 15 16  4  0  0  0  0
 12 16  4  0  0  0  0
 11 17  4  0  0  0  0
 15 18  1  0  0  0  0
  8 19  4  0  0  0  0
  8 20  4  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
 20 23  4  0  0  0  0
 19 24  4  0  0  0  0
 23 25  4  0  0  0  0
 22 26  1  0  0  0  0
  2  4  4  0  0  0  0
 21 26  1  0  0  0  0
 15 17  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI31324

>  <IDNUMBER>
BAS 00401024

>  <Activity>
0
$$$$
ASI11232
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
   -1.2141    0.7453    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2609   -0.6656    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.4515    1.4718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4702   -1.3921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8780    2.1890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3093   -1.3921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6219    1.4718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0718   -0.6656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7171    2.1890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7077   -0.6656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7077   -2.1093    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4796    2.8827    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0234    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3844    0.7453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8531    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6219    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8531   -1.3921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0718   -2.1093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8358    0.7453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4280    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2609   -2.1093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 15  1  0  0  0  0
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  1  7  4  0  0  0  0
  2  8  4  0  0  0  0
  5  9  2  0  0  0  0
  6 10  2  0  0  0  0
  6 11  1  0  0  0  0
  5 12  1  0  0  0  0
 13 14  1  0  0  0  0
  1 14  1  0  0  0  0
 13 15  1  0  0  0  0
  1 16  4  0  0  0  0
  2 17  4  0  0  0  0
 18 21  4  0  0  0  0
 19 20  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
  3 19  4  0  0  0  0
  4 18  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI11232

>  <IDNUMBER>
BAS 00229901

>  <Activity>
0
$$$$
ASI8000
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
    0.4367   -0.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3548   -0.3412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0008   -0.7187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5732   -1.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2866    0.9689    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7915    0.3502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4776    0.6778    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0926    0.2956    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.9651   -0.7552    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.7825   -1.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.7241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3783   -1.3420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8560   -0.5232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9022    0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5284    0.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7468    0.0227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7567   -0.9599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1388    1.2464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7877    1.6831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3382    0.6232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3298   -0.3594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5929    1.8650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1115    0.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  5  7  4  0  0  0  0
  2  6  4  0  0  0  0
  1  7  4  0  0  0  0
  8 13  1  0  0  0  0
  9 12  1  0  0  0  0
  3 10  4  0  0  0  0
 10 11  4  0  0  0  0
  4 12  1  0  0  0  0
  3 13  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
  9 16  4  0  0  0  0
  9 17  4  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  5  6  4  0  0  0  0
  4 11  4  0  0  0  0
 18 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  2   8   1   9   1
M  END
>  <NAME>
ASI8000

>  <IDNUMBER>
BAS 00161876

>  <Activity>
0
$$$$
ASI4793
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
    0.2868    0.3361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9929   -0.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4286   -0.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2868    1.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1409    0.3361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4286    1.5664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1409    1.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7082    0.3361    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9929   -0.9127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9929   -2.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7082    1.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8593   -0.0555    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8593    1.5448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9929    1.5664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2868   -2.1430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7082   -2.1430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2868   -1.3136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5593    0.3731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5747    1.1286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  5  7  4  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
 10 16  4  0  0  0  0
 11 14  1  0  0  0  0
  5 12  1  0  0  0  0
  7 13  1  0  0  0  0
  4 14  1  0  0  0  0
 15 18  4  0  0  0  0
 16 17  4  0  0  0  0
  9 17  4  0  0  0  0
  9 18  4  0  0  0  0
 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
  6  7  4  0  0  0  0
  8 11  1  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI4793

>  <IDNUMBER>
BAS 00123870

>  <Activity>
0
$$$$
ASI1974
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
   -0.6371    1.9563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3618    0.7058    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.3618    1.5323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0900    0.7058    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0900    1.5323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6371    0.3079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7981    1.9302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1670    0.3363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4802   -0.8573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1670   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4849    1.5229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 25 26  4  0  0  0  0
  4  6  1  0  0  0  0
 24 26  4  0  0  0  0
 16 17  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI1974

>  <IDNUMBER>
BAS 00086953

>  <Activity>
0
$$$$
ASI31966
  Marvin  04201015132D          

 18 19  0  0  1  0            999 V2000
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 15 18  1  0  0  0  0
  3  5  1  0  0  0  0
  8  9  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI31966

>  <IDNUMBER>
BAS 00404380

>  <Activity>
0
$$$$
ASI10794
  Marvin  04201015132D          

 33 36  0  0  1  0            999 V2000
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 29 32  1  0  0  0  0
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 16 19  4  0  0  0  0
  3  5  1  0  0  0  0
 28 32  1  0  0  0  0
 30 33  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI10794

>  <IDNUMBER>
BAS 00225296

>  <Activity>
0
$$$$
ASI18198
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
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 15 18  4  0  0  0  0
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 17 20  4  0  0  0  0
 16 21  4  0  0  0  0
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 22 23  1  0  0  0  0
  3  5  1  0  0  0  0
 11 18  4  0  0  0  0
 12 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18198

>  <IDNUMBER>
BAS 00312398

>  <Activity>
0
$$$$
ASI15437
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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 13 17  4  0  0  0  0
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 14 19  1  0  0  0  0
 11 20  1  0  0  0  0
  3  6  4  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15437

>  <IDNUMBER>
BAS 00285744

>  <Activity>
0
$$$$
ASI2637
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 16 20  4  0  0  0  0
 18 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2637

>  <IDNUMBER>
BAS 00096424

>  <Activity>
0
$$$$
ASI11625
  Marvin  04201015132D          

 30 32  0  0  1  0            999 V2000
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    3.2563   -0.2194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  5  1  0  0  0  0
  6 18  1  0  0  0  0
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  3  9  4  0  0  0  0
  3 10  4  0  0  0  0
 11 14  4  0  0  0  0
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 13 16  4  0  0  0  0
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 10 17  4  0  0  0  0
 18 21  1  0  0  0  0
 19 27  1  0  0  0  0
  7 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
 13 23  1  0  0  0  0
 19 24  1  0  0  0  0
  4 25  1  0  0  0  0
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 22 27  1  0  0  0  0
 15 28  1  0  0  0  0
 20 29  1  0  0  0  0
 23 30  1  0  0  0  0
  4  6  1  0  0  0  0
 13 17  4  0  0  0  0
  2  7  4  0  0  0  0
M  CHG  1  19   1
M  END
>  <NAME>
ASI11625

>  <IDNUMBER>
BAS 00233343

>  <Activity>
0
$$$$
ASI16282
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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   -2.4802   -0.9659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4 14  1  0  0  0  0
  5 16  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  4  0  0  0  0
  2  8  4  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
  7 13  4  0  0  0  0
 14 18  4  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
  8 17  4  0  0  0  0
 12 18  4  0  0  0  0
 11 19  4  0  0  0  0
 17 20  4  0  0  0  0
 17 21  1  0  0  0  0
  7 22  1  0  0  0  0
  5 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5 15  1  0  0  0  0
 14 19  4  0  0  0  0
 13 20  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI16282

>  <IDNUMBER>
BAS 00289636

>  <Activity>
0
$$$$
ASI27152
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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 12 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 13 21  4  0  0  0  0
 15 22  1  0  0  0  0
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 21 24  4  0  0  0  0
 18 25  1  0  0  0  0
 20 26  1  0  0  0  0
  3  7  4  0  0  0  0
 17 24  4  0  0  0  0
 22 23  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27152

>  <IDNUMBER>
BAS 00371690

>  <Activity>
0
$$$$
ASI29619
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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   -1.1442   -0.5437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14 18  1  0  0  0  0
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 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 15 16  1  0  0  0  0
 10 12  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI29619

>  <IDNUMBER>
BAS 00391348

>  <Activity>
0
$$$$
ASI54
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  1 10  1  0  0  0  0
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 15 18  1  0  0  0  0
 16 17  1  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
  4  5  4  0  0  0  0
  7  8  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI54

>  <IDNUMBER>
BAS 00004266

>  <Activity>
0
$$$$
ASI17906
  Marvin  04201015132D          

 31 35  0  0  1  0            999 V2000
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 18 19  4  0  0  0  0
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 18 21  1  0  0  0  0
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 27 31  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  4  0  0  0  0
 18 20  4  0  0  0  0
 28 31  1  0  0  0  0
 29 30  4  0  0  0  0
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M  STY  1   1 DAT
M  SAL   1  1   7
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI17906

>  <IDNUMBER>
BAS 00308606

>  <Activity>
0
$$$$
ASI6556
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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  2 11  1  0  0  0  0
  1 12  1  0  0  0  0
 10 13  1  0  0  0  0
  4 14  4  0  0  0  0
 12 15  1  0  0  0  0
 14 16  4  0  0  0  0
  5 17  4  0  0  0  0
  8 18  4  0  0  0  0
 16 19  4  0  0  0  0
 20 21  4  0  0  0  0
 17 21  4  0  0  0  0
 11 15  1  0  0  0  0
 18 20  4  0  0  0  0
 10 19  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI6556

>  <IDNUMBER>
BAS 00138277

>  <Activity>
0
$$$$
ASI25549
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
  6 17  1  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI25549

>  <IDNUMBER>
BAS 00363521

>  <Activity>
0
$$$$
ASI27383
  Marvin  04201015132D          

 18 18  0  0  1  0            999 V2000
    1.8432    0.1226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  4  7  4  0  0  0  0
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 10 12  4  0  0  0  0
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 16 17  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 10 11  4  0  0  0  0
M  CHG  2   8   1   9  -1
M  END
>  <NAME>
ASI27383

>  <IDNUMBER>
BAS 00379778

>  <Activity>
0
$$$$
ASI14624
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -2.2146    0.5934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 12  1  0  0  0  0
  1  3  1  0  0  0  0
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 13 18  1  0  0  0  0
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 11 16  4  0  0  0  0
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 16 23  1  0  0  0  0
 21 24  4  0  0  0  0
 22 25  4  0  0  0  0
 10 16  4  0  0  0  0
  2 13  1  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI14624

>  <IDNUMBER>
BAS 00280481

>  <Activity>
0
$$$$
ASI4791
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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 12 17  4  0  0  0  0
 13 19  1  0  0  0  0
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 11 16  4  0  0  0  0
 10 17  4  0  0  0  0
 12 18  1  0  0  0  0
  4 19  1  0  0  0  0
 15 20  1  0  0  0  0
 14 21  1  0  0  0  0
  6  7  4  0  0  0  0
  8 13  1  0  0  0  0
 12 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI4791

>  <IDNUMBER>
BAS 00123866

>  <Activity>
0
$$$$
ASI44
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  6 10  4  0  0  0  0
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 16 18  4  0  0  0  0
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  3  5  4  0  0  0  0
  7 12  4  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI44

>  <IDNUMBER>
BAS 00004236

>  <Activity>
0
$$$$
ASI31930
  Marvin  04201015132D          

 20 23  0  0  0  0            999 V2000
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  2  6  1  0  0  0  0
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  1  4  4  0  0  0  0
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  2 10  1  0  0  0  0
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 12 13  1  0  0  0  0
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 10 16  1  0  0  0  0
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 14 18  4  0  0  0  0
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 17 20  1  0  0  0  0
  2  7  1  0  0  0  0
  5  9  4  0  0  0  0
 18 19  4  0  0  0  0
 16 20  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI31930

>  <IDNUMBER>
BAS 00404112

>  <Activity>
0
$$$$
ASI12609
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.8808    0.6693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 20 21  4  0  0  0  0
  3  4  1  0  0  0  0
 19 21  4  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12609

>  <IDNUMBER>
BAS 00253552

>  <Activity>
0
$$$$
ASI14956
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 10 12  4  0  0  0  0
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 11 13  4  0  0  0  0
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 17 21  1  0  0  0  0
  3  5  1  0  0  0  0
  7 10  4  0  0  0  0
 14 17  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI14956

>  <IDNUMBER>
BAS 00282844

>  <Activity>
0
$$$$
ASI135
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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 19 23  4  0  0  0  0
 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI135

>  <IDNUMBER>
BAS 00006052

>  <Activity>
0
$$$$
ASI12511
  Marvin  04201015132D          

 18 18  0  0  1  0            999 V2000
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 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
  5  7  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI12511

>  <IDNUMBER>
BAS 00249938

>  <Activity>
0
$$$$
1e66_HUX
  Marvin  04201014582D          

 21 24  0  0  0  0            999 V2000
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 18 19  4  0  0  0  0
 19 20  4  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
1e66_HUX

$$$$
ASI9159
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.9746    0.5235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2561    0.9496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  4  9  1  0  0  0  0
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  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
 10 13  1  0  0  0  0
  5 14  1  0  0  0  0
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  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  9 18  1  0  0  0  0
 13 19  4  0  0  0  0
 13 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 22 23  4  0  0  0  0
  6  8  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI9159

>  <IDNUMBER>
BAS 00190146

>  <Activity>
0
$$$$
ASI24489
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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   -0.3655    0.0040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  4  0  0  0  0
  1  5  1  0  0  0  0
  2  6  2  0  0  0  0
  1  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 10  1  0  0  0  0
  5 11  4  0  0  0  0
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  3 13  2  0  0  0  0
  9 14  2  0  0  0  0
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 16 17  4  0  0  0  0
 11 17  4  0  0  0  0
 16 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 15 21  4  0  0  0  0
 15 22  4  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
 24 27  1  0  0  0  0
 26 28  4  0  0  0  0
  2  4  1  0  0  0  0
 12 16  4  0  0  0  0
 23 27  1  0  0  0  0
 25 28  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI24489

>  <IDNUMBER>
BAS 00345628

>  <Activity>
0
$$$$
ASI30190
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.2926    1.8248    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0258   -0.5214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3570   -0.9342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0576   -0.5431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3 11  4  0  0  0  0
  4 10  1  0  0  0  0
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  5  8  1  0  0  0  0
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  2 10  1  0  0  0  0
 11 19  4  0  0  0  0
  2 12  2  0  0  0  0
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  1 14  4  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 17 20  4  0  0  0  0
  4 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  4  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
  7 16  4  0  0  0  0
  3  5  4  0  0  0  0
  8  9  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30190

>  <IDNUMBER>
BAS 00393842

>  <Activity>
0
$$$$
ASI24407
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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   -1.1445    0.7599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 18  4  0  0  0  0
 13 17  4  0  0  0  0
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 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
  4  5  1  0  0  0  0
 16 17  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24407

>  <IDNUMBER>
BAS 00345429

>  <Activity>
0
$$$$
ASI11490
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
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 12 17  1  0  0  0  0
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 14 19  4  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 19 22  4  0  0  0  0
  3  5  4  0  0  0  0
 13 17  1  0  0  0  0
 18 22  4  0  0  0  0
 20 21  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11490

>  <IDNUMBER>
BAS 00232206

>  <Activity>
0
$$$$
ASI17344
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
   -0.6180   -0.8433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6180    0.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0869   -0.3991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3325    0.4184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0869    0.4184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3325   -0.3991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6180   -1.6672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6180    1.6544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0966   -2.0793    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1223    2.0760    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5256   -2.8968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5868    2.9257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0277   -0.8433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7821   -0.8433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0277    0.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7821    0.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8014   -1.6447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8497    1.6383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0966    2.9257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0772   -2.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7885   -3.3152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5739    2.0631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8337    3.3506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5127   -2.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7519   -0.3991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7519    0.4184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5256    0.4184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5256   -0.3991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  4  0  0  0  0
  1  3  4  0  0  0  0
  4  6  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
 11 21  1  0  0  0  0
 12 23  1  0  0  0  0
  6 13  4  0  0  0  0
  3 14  4  0  0  0  0
  4 15  4  0  0  0  0
  5 16  4  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
  9 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 17 24  1  0  0  0  0
 13 25  4  0  0  0  0
 25 26  4  0  0  0  0
 27 28  4  0  0  0  0
 14 28  4  0  0  0  0
  2  4  4  0  0  0  0
 11 24  1  0  0  0  0
 16 27  4  0  0  0  0
 15 26  4  0  0  0  0
 12 22  1  0  0  0  0
M  CHG  2   9   1  10   1
M  END
>  <NAME>
ASI17344

>  <IDNUMBER>
BAS 00295782

>  <Activity>
0
$$$$
ASI11489
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.7256   -0.1354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5586   -0.1354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5586   -1.5765    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3194   -0.8636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9649   -0.8636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3092    0.5698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7256   -1.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5263    0.5698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7656    1.2827    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.9454   -0.1354    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1820    1.9930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9454    1.2827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1105    0.4778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7722   -0.6873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5161   -0.8636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8566    0.1303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3194   -2.2817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6011    2.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8924    1.5816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4590    2.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9301   -1.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5161   -2.2817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  7  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  6  8  1  0  0  0  0
  9 12  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
  8 12  1  0  0  0  0
  2 13  1  0  0  0  0
  5 14  1  0  0  0  0
  4 15  4  0  0  0  0
 13 16  1  0  0  0  0
  7 17  4  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 15 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  5  4  0  0  0  0
 14 16  1  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11489

>  <IDNUMBER>
BAS 00232203

>  <Activity>
0
$$$$
ASI7025
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.5861   -0.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3052    0.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5861   -0.8979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3052   -1.3094    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0161   -0.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0161   -0.8979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1247    0.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1247   -1.3219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9847    0.3367    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1247    1.1723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3052    1.1640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8355   -0.0624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7311    0.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5547    0.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2572   -0.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7311   -1.3094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7163    0.7482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4045   -0.3949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5856    1.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7163    1.5630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4461   -0.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4461   -0.8979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  9 15  1  0  0  0  0
  7 10  2  0  0  0  0
  2 11  1  0  0  0  0
  7 12  1  0  0  0  0
  5 13  4  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
  6 16  4  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
 17 20  1  0  0  0  0
 13 21  4  0  0  0  0
 16 22  4  0  0  0  0
  5  6  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1   9   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI7025

>  <IDNUMBER>
BAS 00141373

>  <Activity>
0
$$$$
ASI6606
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.1931    0.3742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6196    0.1489    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8490   -0.1529    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0117    0.5351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2192    0.7364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4142   -1.0864    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2090   -0.2776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8490   -1.0019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5952    1.1467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9978    1.5491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3579    1.9353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5571    0.3138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5571   -1.4243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5651    2.1366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4828    1.1467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3117    1.1226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9171    2.5349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5571   -2.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2773   -1.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9855   -1.4444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2493   -2.6676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9935   -2.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  4  5  4  0  0  0  0
  2  5  1  0  0  0  0
  6  7  3  0  0  0  0
  4  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  4  0  0  0  0
  5 10  4  0  0  0  0
 11 14  4  0  0  0  0
  3 12  1  0  0  0  0
  8 13  1  0  0  0  0
 10 14  4  0  0  0  0
  1 15  1  0  0  0  0
 15 16  1  0  0  0  0
 11 17  1  0  0  0  0
 13 18  4  0  0  0  0
 13 19  4  0  0  0  0
 19 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
 12 16  1  0  0  0  0
  9 11  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI6606

>  <IDNUMBER>
BAS 00139211

>  <Activity>
0
$$$$
ASI16216
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
    1.4260    0.3157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4260    1.1254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1287    1.5329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1287   -0.0865    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8417    1.1254    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0051    1.1254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0051    0.3157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8417    0.3157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7181   -0.0865    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4157    0.3157    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7028   -0.0865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7028    1.5329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5649   -0.0968    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1287    2.3732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4157    1.1254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490   -0.0968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490   -0.9421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8671   -1.3699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4208   -1.3699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8671   -2.1949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4208   -2.1949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490   -2.6226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  5  8  4  0  0  0  0
  2  6  4  0  0  0  0
  7  9  4  0  0  0  0
  4  8  4  0  0  0  0
  1  9  4  0  0  0  0
 10 11  1  0  0  0  0
  7 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  2  0  0  0  0
  3 14  1  0  0  0  0
 12 15  1  0  0  0  0
 10 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  6  7  4  0  0  0  0
  3  5  4  0  0  0  0
 10 15  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1  10   1
M  STY  2   1 DAT   2 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  SAL   2  1   5
M  SDT   2 MRV_IMPLICIT_H                                        
M  SDD   2     0.0000    0.0000    DR    ALL  0       0  
M  SED   2 IMPL_H1
M  END
>  <NAME>
ASI16216

>  <IDNUMBER>
BAS 00289255

>  <Activity>
0
$$$$
ASI27612
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
   -0.6547   -0.4844    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1834    0.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6547    0.8445    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4403   -0.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4403    0.5892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6481    0.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3928   -1.2963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1261    0.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9165   -0.7201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3928    1.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2783   -0.2160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9444    0.5565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7480   -0.8445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1474   -0.6415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1474    1.0017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0966   -0.3339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8741    0.5892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8741   -0.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  6  8  4  0  0  0  0
  6  9  4  0  0  0  0
  3 10  1  0  0  0  0
 11 12  4  0  0  0  0
  8 12  4  0  0  0  0
  9 13  4  0  0  0  0
  4 14  4  0  0  0  0
  5 15  4  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  4  0  0  0  0
 14 19  4  0  0  0  0
  3  5  4  0  0  0  0
 18 19  4  0  0  0  0
 11 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI27612

>  <IDNUMBER>
BAS 00380647

>  <Activity>
0
$$$$
ASI30192
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -0.3014    1.9388    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3704    0.5891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5072   -2.8637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3018   -0.2330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3 11  4  0  0  0  0
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  3  6  1  0  0  0  0
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  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  2 10  1  0  0  0  0
 11 20  4  0  0  0  0
  2 12  2  0  0  0  0
  1 13  1  0  0  0  0
  1 14  4  0  0  0  0
  1 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
 18 21  4  0  0  0  0
  4 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  4  0  0  0  0
 13 22  1  0  0  0  0
 22 23  4  0  0  0  0
 22 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
 26 27  4  0  0  0  0
  7 16  4  0  0  0  0
 25 27  4  0  0  0  0
  3  5  4  0  0  0  0
  8  9  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30192

>  <IDNUMBER>
BAS 00393859

>  <Activity>
0
$$$$
ASI21556
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
    0.1877   -0.1546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1877    0.6899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5243   -0.5520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  3  5  1  0  0  0  0
  1  4  4  0  0  0  0
  1  5  1  0  0  0  0
  3  6  1  0  0  0  0
  2  7  4  0  0  0  0
  4  8  4  0  0  0  0
  8  9  4  0  0  0  0
  2 10  1  0  0  0  0
 11 15  1  0  0  0  0
 11 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
  6 10  1  0  0  0  0
  7  9  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI21556

>  <IDNUMBER>
BAS 00329587

>  <Activity>
0
$$$$
ASI21238
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
    0.0817   -0.8748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1400   -0.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8864   -1.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5133   -1.4464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2480    0.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9448    0.1516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1081   -1.9012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8545    0.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6523    1.6795    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  1  6  1  0  0  0  0
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  6 10  1  0  0  0  0
  3 11  1  0  0  0  0
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 12 13  1  0  0  0  0
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 13 18  1  0  0  0  0
 13 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 15 22  1  0  0  0  0
 14 23  1  0  0  0  0
 16 24  4  0  0  0  0
 17 25  4  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
  9 10  1  0  0  0  0
  4  7  4  0  0  0  0
 23 28  1  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI21238

>  <IDNUMBER>
BAS 00327490

>  <Activity>
0
$$$$
ASI25551
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.8922   -0.4421    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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  2  4  1  0  0  0  0
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  4  7  4  0  0  0  0
  4  8  4  0  0  0  0
  9 10  4  0  0  0  0
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  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  9 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  6 17  1  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI25551

>  <IDNUMBER>
BAS 00363527

>  <Activity>
0
$$$$
ASI17606
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    2.3010   -0.7659    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  4  3  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  5 10  4  0  0  0  0
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 12 13  1  0  0  0  0
 13 14  4  0  0  0  0
 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
  1 16  1  0  0  0  0
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 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
  2  7  1  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI17606

>  <IDNUMBER>
BAS 00297184

>  <Activity>
0
$$$$
ASI211
  Marvin  04201015132D          

 13 14  0  0  0  0            999 V2000
    0.6771   -0.4949    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1610    0.1795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1060   -0.2366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2704    0.9923    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.7347   -1.4601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  4  7  4  0  0  0  0
  1  8  1  0  0  0  0
  9 10  4  0  0  0  0
  7 10  4  0  0  0  0
  2 11  1  0  0  0  0
  9 12  1  0  0  0  0
  8 13  1  0  0  0  0
  3  5  4  0  0  0  0
  6  9  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI211

>  <IDNUMBER>
BAS 00009490

>  <Activity>
0
$$$$
ASI23947
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.2526    0.4270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
  6 10  1  0  0  0  0
  9 11  4  0  0  0  0
  9 12  4  0  0  0  0
 10 13  4  0  0  0  0
 10 14  4  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 16 19  4  0  0  0  0
 18 20  4  0  0  0  0
  3  4  1  0  0  0  0
 15 19  4  0  0  0  0
 17 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI23947

>  <IDNUMBER>
BAS 00342584

>  <Activity>
0
$$$$
ASI33357
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.7087   -0.9149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2142   -0.2406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2692   -1.7399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9964   -1.3327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  2  4  1  0  0  0  0
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  3  6  4  0  0  0  0
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  1  8  1  0  0  0  0
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  6 12  4  0  0  0  0
  9 13  4  0  0  0  0
  8 14  1  0  0  0  0
 12 15  4  0  0  0  0
 13 16  1  0  0  0  0
  7 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
  5  6  4  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   4   1
M  STY  1   1 DAT
M  SAL   1  1   3
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI33357

>  <IDNUMBER>
BAS 00411374

>  <Activity>
0
$$$$
ASI10849
  Marvin  04201015132D          

 18 19  0  0  1  0            999 V2000
    1.7944    0.7141    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.4256    0.7141    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9607    0.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6923   -0.7105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5437    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5116   -0.7105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9321    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2791    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7514    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9607   -0.7105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1968    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1968    1.4283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7514   -1.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1646   -0.7105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1501    0.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 13  1  0  0  0  0
  1  3  1  0  0  0  0
  4  8  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  4  0  0  0  0
  5  8  1  0  0  0  0
  7  9  4  0  0  0  0
  5 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 16  4  0  0  0  0
  6 16  4  0  0  0  0
 15 17  4  0  0  0  0
  9 18  1  0  0  0  0
  2 14  1  0  0  0  0
  9 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10849

>  <IDNUMBER>
BAS 00226274

>  <Activity>
0
$$$$
ASI23366
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
   -0.8512    0.0781    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1874    0.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1718   -2.0017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  2 11  4  0  0  0  0
  3 12  4  0  0  0  0
  5 13  4  0  0  0  0
  4 14  4  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
 17 19  4  0  0  0  0
 11 18  4  0  0  0  0
 12 19  4  0  0  0  0
 18 20  4  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 22 23  1  0  0  0  0
  4  5  4  0  0  0  0
 13 17  4  0  0  0  0
 14 20  4  0  0  0  0
 21 23  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI23366

>  <IDNUMBER>
BAS 00340750

>  <Activity>
0
$$$$
ASI27352
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
   -1.6353   -0.2163    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115   -0.2163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  5  1  0  0  0  0
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  7 10  1  0  0  0  0
  5 11  4  0  0  0  0
  4 12  4  0  0  0  0
  3 13  2  0  0  0  0
  9 14  1  0  0  0  0
  9 15  2  0  0  0  0
 16 28  1  0  0  0  0
 14 17  4  0  0  0  0
 14 18  4  0  0  0  0
 19 20  4  0  0  0  0
 11 20  4  0  0  0  0
 21 22  4  0  0  0  0
 18 22  4  0  0  0  0
 17 23  4  0  0  0  0
 19 24  1  0  0  0  0
 21 25  1  0  0  0  0
 10 26  1  0  0  0  0
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 27 28  1  0  0  0  0
 26 29  1  0  0  0  0
  2  4  1  0  0  0  0
 16 29  1  0  0  0  0
 12 19  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI27352

>  <IDNUMBER>
BAS 00379513

>  <Activity>
0
$$$$
ASI24410
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
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    1.7920    0.6804    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 26 29  4  0  0  0  0
 28 30  4  0  0  0  0
  5  6  1  0  0  0  0
 14 20  4  0  0  0  0
 27 30  4  0  0  0  0
 25 29  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24410

>  <IDNUMBER>
BAS 00345432

>  <Activity>
0
$$$$
ASI30582
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
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 10 13  1  0  0  0  0
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 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
  4  5  4  0  0  0  0
 10 14  1  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI30582

>  <IDNUMBER>
BAS 00395360

>  <Activity>
0
$$$$
ASI18451
  Marvin  04201015132D          

 31 33  0  0  0  0            999 V2000
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 22 26  4  0  0  0  0
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 29 31  1  0  0  0  0
  6 17  1  0  0  0  0
 20 21  4  0  0  0  0
 22 27  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18451

>  <IDNUMBER>
BAS 00313368

>  <Activity>
0
$$$$
ASI7784
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
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 18 21  1  0  0  0  0
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M  CHG  1   3   1
M  END
>  <NAME>
ASI7784

>  <IDNUMBER>
BAS 00159148

>  <Activity>
0
$$$$
ASI8532
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 20 21  4  0  0  0  0
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M  CHG  1   8   1
M  END
>  <NAME>
ASI8532

>  <IDNUMBER>
BAS 00166061

>  <Activity>
0
$$$$
ASI8047
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
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  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  3  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  7  8  4  0  0  0  0
  4  9  1  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
  7 12  4  0  0  0  0
  8 13  4  0  0  0  0
 10 14  4  0  0  0  0
 10 15  4  0  0  0  0
  9 16  4  0  0  0  0
  9 17  4  0  0  0  0
 12 18  4  0  0  0  0
 18 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 21 24  4  0  0  0  0
 23 25  4  0  0  0  0
  5  6  1  0  0  0  0
 22 25  4  0  0  0  0
 13 19  4  0  0  0  0
 20 24  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI8047

>  <IDNUMBER>
BAS 00162243

>  <Activity>
0
$$$$
ASI19872
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.2891   -0.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2891   -1.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0146   -0.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0146   -1.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7291   -0.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7291   -1.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4255    0.5891    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1291   -1.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1364   -1.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1364   -0.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  1  7  4  0  0  0  0
  6  8  4  0  0  0  0
  7  9  1  0  0  0  0
 10 11  4  0  0  0  0
  7 11  4  0  0  0  0
 12 14  1  0  0  0  0
  9 13  1  0  0  0  0
 13 14  1  0  0  0  0
  6 15  4  0  0  0  0
  8 16  4  0  0  0  0
 12 17  1  0  0  0  0
 12 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 16 21  4  0  0  0  0
 15 22  4  0  0  0  0
  4  8  4  0  0  0  0
  5 10  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI19872

>  <IDNUMBER>
BAS 00318987

>  <Activity>
0
$$$$
ASI15612
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.7719   -0.6811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7719    0.1702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4880   -0.2383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4755   -1.0896    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1850   -0.6811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1850    0.1702    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3337   -0.1589    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9171   -1.1124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4755    1.3961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4970    0.7151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2270    1.8275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  4  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  2  7  4  0  0  0  0
  6  8  4  0  0  0  0
  8  9  4  0  0  0  0
  3 10  1  0  0  0  0
  8 11  1  0  0  0  0
  7 12  2  0  0  0  0
  5 13  1  0  0  0  0
 14 18  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 13 20  1  0  0  0  0
 13 21  1  0  0  0  0
  3  5  4  0  0  0  0
  7  9  4  0  0  0  0
 14 19  1  0  0  0  0
M  CHG  1  14   1
M  STY  1   1 DAT
M  SAL   1  1   9
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI15612

>  <IDNUMBER>
BAS 00286875

>  <Activity>
0
$$$$
ASI31263
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
   -1.1962    0.2410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8694    0.7232    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4464   -0.5458    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1917    0.7232    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.5244    0.2366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0105    0.8733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9461   -0.0636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6596    1.3555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1274   -0.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1365    1.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5517    0.2366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3386    0.3957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7973   -1.1781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8707   -0.2366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6206   -1.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  4 10  4  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  9 11  4  0  0  0  0
 10 12  4  0  0  0  0
  7 11  4  0  0  0  0
  7 12  4  0  0  0  0
  8 13  1  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
 13 16  4  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
  5  6  4  0  0  0  0
  4  9  4  0  0  0  0
 18 19  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI31263

>  <IDNUMBER>
BAS 00399705

>  <Activity>
0
$$$$
ASI23367
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
   -0.9319   -0.0231    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3226    1.2386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5267    1.2386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5715    0.4485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2662    0.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9319   -0.8653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3818    0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5412    0.2807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2762   -1.2531    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8956    1.8522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0290    1.8377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1910   -1.2299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6972    1.6699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8509    1.6699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9461    0.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4296    2.2804    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2528    2.3036    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.1967   -2.0721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  9 13  1  0  0  0  0
  2 10  4  0  0  0  0
  3 11  4  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
  7 16  4  0  0  0  0
  8 17  4  0  0  0  0
 15 18  1  0  0  0  0
 14 19  1  0  0  0  0
 12 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
  2  3  4  0  0  0  0
 15 17  4  0  0  0  0
 10 14  4  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI23367

>  <IDNUMBER>
BAS 00340752

>  <Activity>
0
$$$$
ASI968
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
   -0.3556    0.5243    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0757    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7961   -1.1396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7961   -1.9646    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  4  0  0  0  0
  5 11  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  4  0  0  0  0
  8  9  1  0  0  0  0
  1  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  2 12  4  0  0  0  0
  3 13  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
 12 16  4  0  0  0  0
 16 17  4  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 17  4  0  0  0  0
 19 21  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI968

>  <IDNUMBER>
BAS 00053867

>  <Activity>
0
$$$$
ASI334
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
    0.0606   -0.6833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6556   -1.1020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6556   -1.9340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0938   -1.1020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  5  6  4  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  2  9  1  0  0  0  0
  1 10  1  0  0  0  0
  5 11  4  0  0  0  0
  6 12  4  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 10 15  4  0  0  0  0
 10 16  4  0  0  0  0
 11 17  4  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 12 20  4  0  0  0  0
 16 21  4  0  0  0  0
 15 22  4  0  0  0  0
 21 23  4  0  0  0  0
 18 24  1  0  0  0  0
  4  6  4  0  0  0  0
 22 23  4  0  0  0  0
 17 20  4  0  0  0  0
 19 24  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI334

>  <IDNUMBER>
BAS 00012426

>  <Activity>
0
$$$$
ASI17582
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
   -1.5101   -1.0602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2973    2.2331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2250   -2.3134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9358   -1.9117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9439    1.4820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6909   -1.1566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6466    2.0603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  4  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  5 14  1  0  0  0  0
  6  9  4  0  0  0  0
  7 10  4  0  0  0  0
  1  8  1  0  0  0  0
  9 11  4  0  0  0  0
 10 18  1  0  0  0  0
 10 11  4  0  0  0  0
  2 12  1  0  0  0  0
 13 23  1  0  0  0  0
 14 16  1  0  0  0  0
  6 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
 13 18  1  0  0  0  0
  3 19  1  0  0  0  0
  3 20  1  0  0  0  0
  8 21  4  0  0  0  0
  8 22  4  0  0  0  0
 17 23  1  0  0  0  0
 12 24  1  0  0  0  0
 22 25  4  0  0  0  0
 21 26  4  0  0  0  0
 26 27  4  0  0  0  0
  3  5  1  0  0  0  0
 25 27  4  0  0  0  0
  2  6  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI17582

>  <IDNUMBER>
BAS 00297077

>  <Activity>
0
$$$$
ASI27808
  Marvin  04201015132D          

 19 21  0  0  1  0            999 V2000
    0.0439    0.0089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1845   -0.8346    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8083    0.2461    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6062    0.5887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0280   -1.0191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9769    0.9314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5  8  4  0  0  0  0
  6 17  1  0  0  0  0
  7 15  1  0  0  0  0
  4  8  4  0  0  0  0
  3  9  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  4  0  0  0  0
  5 14  4  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  4  0  0  0  0
  7 18  1  0  0  0  0
  6 16  1  0  0  0  0
 14 19  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI27808

>  <IDNUMBER>
BAS 00381069

>  <Activity>
0
$$$$
ASI31731
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
   -3.0907   -0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2504   -0.1497    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7382   -0.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9654   -0.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5011    0.5650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1342    0.5505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3222    0.5650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8254   -0.8548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8254    0.5650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  6  1  0  0  0  0
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  1  8  2  0  0  0  0
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  2 11  1  0  0  0  0
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 14 20  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
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 10 18  4  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
  7 21  1  0  0  0  0
  5 22  4  0  0  0  0
 22 23  4  0  0  0  0
 23 24  4  0  0  0  0
 17 25  4  0  0  0  0
 17 26  4  0  0  0  0
 25 27  4  0  0  0  0
 26 28  4  0  0  0  0
 28 29  4  0  0  0  0
  7 15  1  0  0  0  0
 18 24  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI31731

>  <IDNUMBER>
BAS 00403017

>  <Activity>
0
$$$$
ASI21816
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    0.3272    0.4089    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7275   -0.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0689   -0.8566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0230    0.6715    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
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  4  9  2  0  0  0  0
  6 10  4  0  0  0  0
 11 16  1  0  0  0  0
 10 12  1  0  0  0  0
  6 13  4  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 10 18  4  0  0  0  0
 13 19  4  0  0  0  0
 19 20  4  0  0  0  0
  2  5  4  0  0  0  0
 11 17  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI21816

>  <IDNUMBER>
BAS 00331495

>  <Activity>
0
$$$$
ASI18328
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.5639   -0.3904    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  3  7  4  0  0  0  0
  5  8  4  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  4  0  0  0  0
  8 12  4  0  0  0  0
 10 13  2  0  0  0  0
  4 14  1  0  0  0  0
 10 15  1  0  0  0  0
  7 16  4  0  0  0  0
 11 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
  2  3  4  0  0  0  0
  7 11  4  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  2   1   1  15  -1
M  END
>  <NAME>
ASI18328

>  <IDNUMBER>
BAS 00313003

>  <Activity>
0
$$$$
ASI27168
  Marvin  04201015132D          

 38 43  0  0  0  0            999 V2000
    2.5272    0.1104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  2  4  4  0  0  0  0
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  7  8  1  0  0  0  0
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 11 14  1  0  0  0  0
 15 21  1  0  0  0  0
  9 16  4  0  0  0  0
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 18 24  1  0  0  0  0
 19 23  1  0  0  0  0
  7 20  1  0  0  0  0
 14 21  1  0  0  0  0
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 16 25  4  0  0  0  0
 25 26  1  0  0  0  0
  6 27  4  0  0  0  0
  9 28  4  0  0  0  0
 10 29  4  0  0  0  0
 28 30  4  0  0  0  0
 20 31  4  0  0  0  0
 20 32  4  0  0  0  0
 30 33  4  0  0  0  0
 27 34  4  0  0  0  0
 29 35  4  0  0  0  0
 31 36  4  0  0  0  0
 32 37  4  0  0  0  0
 37 38  4  0  0  0  0
 12 13  1  0  0  0  0
  4  6  4  0  0  0  0
 34 35  4  0  0  0  0
 25 33  4  0  0  0  0
  8 19  1  0  0  0  0
 36 38  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI27168

>  <IDNUMBER>
BAS 00371740

>  <Activity>
0
$$$$
ASI24405
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
   -1.2660   -0.1454    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3129    0.6846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4783   -0.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0281    0.3469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5252    0.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1347    1.2050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7971    0.4361    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.9506    1.2754    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.9882   -0.5533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0163    1.1347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1735   -1.1394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6471    1.8568    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4476    0.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  6  7  1  0  0  0  0
  4  7  1  0  0  0  0
  6  8  2  0  0  0  0
  1  9  1  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
  6 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  4  0  0  0  0
  9 15  4  0  0  0  0
 13 16  4  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 21 23  4  0  0  0  0
  4  5  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24405

>  <IDNUMBER>
BAS 00345427

>  <Activity>
0
$$$$
ASI16335
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -2.3331   -0.0455    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9920   -0.0455    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9881   -0.0101    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4069    0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5082   -0.0455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6470   -0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2319    0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7482   -0.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7482    0.6832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0729    0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0729   -0.7743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1670   -0.0455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5732   -0.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5732    0.6832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4719   -0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2429    0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2429   -0.7743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8131   -0.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6267   -1.4880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4466   -1.4880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 12  1  0  0  0  0
  3 13  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  1  0  0  0  0
  6  7  4  0  0  0  0
  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  5 10  4  0  0  0  0
  5 11  4  0  0  0  0
 12 16  4  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
  6 15  4  0  0  0  0
 10 16  4  0  0  0  0
 11 17  4  0  0  0  0
  3 18  1  0  0  0  0
 19 20  4  0  0  0  0
  7 20  4  0  0  0  0
  6 21  4  0  0  0  0
 19 22  4  0  0  0  0
 15 23  4  0  0  0  0
 18 24  1  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  3 14  1  0  0  0  0
 12 17  4  0  0  0  0
 15 22  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI16335

>  <IDNUMBER>
BAS 00289865

>  <Activity>
0
$$$$
ASI23364
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
   -0.6770   -0.0473    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3865    1.1699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0348    1.1699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3865    0.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0348    0.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7418    1.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1034    1.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8128    1.1699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2030    1.5931    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
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  3  9  4  0  0  0  0
  2 10  4  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
  9 13  4  0  0  0  0
 14 16  4  0  0  0  0
 12 15  1  0  0  0  0
  7 16  4  0  0  0  0
  8 17  4  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 11 20  1  0  0  0  0
 15 21  1  0  0  0  0
 15 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  2  3  4  0  0  0  0
 13 17  4  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI23364

>  <IDNUMBER>
BAS 00340748

>  <Activity>
0
$$$$
ASI21472
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -0.2729    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4605    0.6225    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2729   -0.6311    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2729    1.8504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8931   -1.0404    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
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   -1.7055    1.8504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  4  6  4  0  0  0  0
  7  8  1  0  0  0  0
  3  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
 13 18  1  0  0  0  0
  6 14  4  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  4 17  4  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 20 21  4  0  0  0  0
 17 21  4  0  0  0  0
  6  9  1  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  2   2   1  11  -1
M  END
>  <NAME>
ASI21472

>  <IDNUMBER>
BAS 00329355

>  <Activity>
0
$$$$
ASI24202
  Marvin  04201015132D          

 26 30  0  0  0  0            999 V2000
   -0.0897   -1.2862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0119   -2.1238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6580   -0.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8435   -2.2674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323   -1.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8076   -0.8734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8076    1.6034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8076   -0.0419    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.5255    1.1965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0897    1.1965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8076    2.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8794   -0.1676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5205   -2.7699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1127   -3.0392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0281   -1.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0897    2.8297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5743   -3.6853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2434   -0.5445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2333   -3.5596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6691    0.0478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0897    3.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8076    4.0681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  7  9  1  0  0  0  0
  6  8  1  0  0  0  0
  9 13  1  0  0  0  0
 10 12  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
  3 14  4  0  0  0  0
  2 15  4  0  0  0  0
  4 16  4  0  0  0  0
  5 17  4  0  0  0  0
 11 18  4  0  0  0  0
 11 19  4  0  0  0  0
 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
 15 22  4  0  0  0  0
 14 23  4  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 25 26  4  0  0  0  0
  4  5  4  0  0  0  0
  7 10  1  0  0  0  0
 17 21  4  0  0  0  0
 16 20  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24202

>  <IDNUMBER>
BAS 00344512

>  <Activity>
0
$$$$
ASI16178
  Marvin  04201015132D          

 20 21  0  0  1  0            999 V2000
    1.1000    0.9744    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1000    0.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3414    0.1494    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3745   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8183   -0.2489    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5366    0.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3745    1.3940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7875    0.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0621   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5366    0.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3414    0.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2620    1.3774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7875    0.9957    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4845   -0.2489    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2099    0.1967    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2774   -0.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0668   -0.7136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2774   -1.5173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9672   -1.9629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6524   -1.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3 11  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  8  9  1  0  0  0  0
  3  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  6 12  2  0  0  0  0
  8 13  2  0  0  0  0
  8 14  1  0  0  0  0
 14 15  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  5 10  1  0  0  0  0
  3  4  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI16178

>  <IDNUMBER>
BAS 00288939

>  <Activity>
0
$$$$
ASI15575
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.7545   -0.4765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7545    0.3574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0050   -0.7496    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4815   -0.0795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0050    0.5957    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4692   -0.8885    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1840   -0.4765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1840    0.3574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4692    0.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2905   -0.1539    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8988   -0.8885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4692    1.5735    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9386   -0.2928    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2928    1.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4692   -1.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6479   -0.8885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7671    0.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4621   -0.9530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6010    0.4765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1070    1.5735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  2  9  4  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 13 18  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 13 19  1  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   8
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI15575

>  <IDNUMBER>
BAS 00286811

>  <Activity>
0
$$$$
ASI29620
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    1.6287   -0.6140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2517   -0.6140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1896   -0.6140    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6287    0.1825    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5002   -1.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8937   -1.0004    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3185   -1.0004    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2517    0.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9724   -1.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9724    0.6377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7097   -0.6425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7097    0.1825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4399   -1.0573    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5619    0.6092    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0274    0.1825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0274   -0.6140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5002   -1.8373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5619    1.4342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1422    1.8610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5149    1.8610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8179    1.4461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2190    1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  1  4  2  0  0  0  0
  3  5  2  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  4  0  0  0  0
  2  9  4  0  0  0  0
  8 10  4  0  0  0  0
  9 11  4  0  0  0  0
 11 12  4  0  0  0  0
 11 13  1  0  0  0  0
  8 14  1  0  0  0  0
  4 15  1  0  0  0  0
  7 16  1  0  0  0  0
  5 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 15 16  1  0  0  0  0
 10 12  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI29620

>  <IDNUMBER>
BAS 00391349

>  <Activity>
0
$$$$
ASI4070
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.0733   -0.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3528    0.6507    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7698   -0.2978    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6232   -0.7607    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1971    1.2830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0172   -1.0906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4525   -0.5865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2968    2.5202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0035    1.1088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0733    2.0528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5533    1.7229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4765    2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8282    3.1387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8282   -1.2693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4674   -1.7091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9794   -1.2188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7229    0.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7905   -1.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5522    0.3390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0710   -2.0573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7285   -2.4834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0654   -0.2795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5167   -2.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  8 11  4  0  0  0  0
  5  9  4  0  0  0  0
  5 10  4  0  0  0  0
  9 11  4  0  0  0  0
 10 12  4  0  0  0  0
  8 13  1  0  0  0  0
  6 14  4  0  0  0  0
  6 15  4  0  0  0  0
  7 16  4  0  0  0  0
  7 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  8 12  4  0  0  0  0
 18 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI4070

>  <IDNUMBER>
BAS 00114508

>  <Activity>
0
$$$$
ASI9729
  Marvin  04201015132D          

 14 14  0  0  0  0            999 V2000
    2.1823    0.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718   -0.9528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1823    1.5971    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5042    0.3528    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3816   -0.5092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0592   -0.5092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3816    0.3148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9429    0.3655    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0592    0.3148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718   -1.7767    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.7690    0.7352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718    0.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1105   -0.9148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8203   -0.4965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  4  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  5  7  4  0  0  0  0
  6  9  4  0  0  0  0
  7 12  4  0  0  0  0
  1  8  1  0  0  0  0
  9 11  1  0  0  0  0
  2 10  1  0  0  0  0
  4 11  1  0  0  0  0
  9 12  4  0  0  0  0
  5 13  1  0  0  0  0
 13 14  1  0  0  0  0
  2  5  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI9729

>  <IDNUMBER>
BAS 00208215

>  <Activity>
0
$$$$
ASI27614
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.2249   -0.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6920   -0.7725    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6920    0.5519    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4688   -0.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  4  7  4  0  0  0  0
  4  8  4  0  0  0  0
  2  9  1  0  0  0  0
  7 10  4  0  0  0  0
  3 11  1  0  0  0  0
  8 12  4  0  0  0  0
 12 13  4  0  0  0  0
  5 14  4  0  0  0  0
  7 15  1  0  0  0  0
  6 16  4  0  0  0  0
 12 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  4  0  0  0  0
 16 21  4  0  0  0  0
  5  6  4  0  0  0  0
 20 21  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI27614

>  <IDNUMBER>
BAS 00380650

>  <Activity>
0
$$$$
ASI29508
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    2.0620    0.9389    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6523   -1.1921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3092   -1.1921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8950    2.3427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3 11  4  0  0  0  0
  4 14  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  2  9  4  0  0  0  0
  2 10  4  0  0  0  0
  9 11  4  0  0  0  0
 10 12  4  0  0  0  0
  3 13  1  0  0  0  0
 14 16  1  0  0  0  0
  5 15  1  0  0  0  0
 15 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 19  1  0  0  0  0
  3 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI29508

>  <IDNUMBER>
BAS 00390561

>  <Activity>
0
$$$$
ASI22432
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.6899   -0.3138    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3941    0.1772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2755    1.0108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6899   -1.1666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2300    1.6432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2109   -0.0815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8264   -0.0551    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0348    1.5259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6397    1.2695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3438    0.7713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5618    2.1606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9008   -2.4960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  2  0  0  0  0
  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  7 11  1  0  0  0  0
 12 15  4  0  0  0  0
 11 13  4  0  0  0  0
 11 14  4  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 12 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
  4  5  1  0  0  0  0
 21 23  1  0  0  0  0
 12 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22432

>  <IDNUMBER>
BAS 00334746

>  <Activity>
0
$$$$
ASI11315
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.9267   -2.0524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7119   -1.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7302   -2.2712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7779   -3.0905    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4892   -2.7683    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0500   -3.4086    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2887   -0.6682    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1114   -1.0500    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1478    0.9944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3524    0.7637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3428    1.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3865   -1.7342    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7796    1.3364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3341   -0.2267    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7541    2.3705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7365    0.4296    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0818    0.1233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9904    2.1399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9251    3.1780    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2864    0.3659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6881    1.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  1  5  4  0  0  0  0
  5  6  4  0  0  0  0
  2  7  1  0  0  0  0
  2  8  2  0  0  0  0
  9 10  4  0  0  0  0
 10 20  1  0  0  0  0
  9 11  4  0  0  0  0
  3 12  1  0  0  0  0
 10 13  4  0  0  0  0
  8 14  1  0  0  0  0
 15 18  4  0  0  0  0
  9 16  1  0  0  0  0
  7 17  1  0  0  0  0
 13 18  4  0  0  0  0
 15 19  1  0  0  0  0
 14 20  1  0  0  0  0
 17 21  4  0  0  0  0
 17 22  4  0  0  0  0
 22 23  4  0  0  0  0
 21 24  4  0  0  0  0
 24 25  4  0  0  0  0
  4  6  4  0  0  0  0
 23 25  4  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI11315

>  <IDNUMBER>
BAS 00231326

>  <Activity>
0
$$$$
ASI17991
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.6078   -0.3511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1109    0.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8918    0.0682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8918   -0.7546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1109   -1.0271    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.2148   -0.3511    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8856    1.1109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6235   -1.0637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5992   -1.1791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0856   -0.5345    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4516   -1.0637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4830    1.6611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2148   -1.7817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5992   -1.9441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5992    0.4821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1048    1.3258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3066   -0.7546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3066    0.0682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7520    0.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2017    1.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  4  5  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  4  9  1  0  0  0  0
 10 11  1  0  0  0  0
  8 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  2  0  0  0  0
  9 14  2  0  0  0  0
  3 15  1  0  0  0  0
  7 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
  3  4  4  0  0  0  0
 17 20  1  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI17991

>  <IDNUMBER>
BAS 00311487

>  <Activity>
0
$$$$
2gyw_OBI
  Marvin  04201014582D          

 21 22  0  0  0  0            999 V2000
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    6.7910   -9.6867    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.7910  -10.5117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5054  -10.9242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2199  -10.5117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2199   -9.6867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5054   -9.2742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9344  -10.9242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3633  -10.9242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0765   -6.7992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0765   -5.9742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4 21  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  1  0  0  0  0
  7 20  4  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 16  4  0  0  0  0
 11 12  4  0  0  0  0
 12 13  4  0  0  0  0
 13 14  4  0  0  0  0
 14 15  4  0  0  0  0
 14 17  1  0  0  0  0
 15 16  4  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  2   7   1  11   1
M  END
>  <Activity>
1

>  <PDB_ID>
2gyw_OBI

$$$$
ASI11068
  Marvin  04201015132D          

 21 21  0  0  1  0            999 V2000
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M  CHG  1   9   1
M  END
>  <NAME>
ASI11068

>  <IDNUMBER>
BAS 00227801

>  <Activity>
0
$$$$
ASI15034
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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 18 21  1  0  0  0  0
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 22 23  4  0  0  0  0
  4 13  1  0  0  0  0
 12 17  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI15034

>  <IDNUMBER>
BAS 00283301

>  <Activity>
0
$$$$
ASI28712
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
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 27 28  4  0  0  0  0
  4  5  4  0  0  0  0
 24 25  1  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI28712

>  <IDNUMBER>
BAS 00385838

>  <Activity>
0
$$$$
ASI23374
  Marvin  04201015132D          

 21 24  0  0  0  0            999 V2000
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 10 18  1  0  0  0  0
 15 21  4  0  0  0  0
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M  CHG  1   7   1
M  END
>  <NAME>
ASI23374

>  <IDNUMBER>
BAS 00340769

>  <Activity>
0
$$$$
ASI15462
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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 22 23  1  0  0  0  0
  4  5  1  0  0  0  0
 21 23  1  0  0  0  0
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M  CHG  1   8   1
M  END
>  <NAME>
ASI15462

>  <IDNUMBER>
BAS 00285831

>  <Activity>
0
$$$$
ASI16408
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
  3  9  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  6 19  1  0  0  0  0
  4  7  4  0  0  0  0
  8 11  2  0  0  0  0
  9 14  4  0  0  0  0
  1 10  1  0  0  0  0
  5 11  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
 14 22  4  0  0  0  0
 15 23  4  0  0  0  0
 10 16  4  0  0  0  0
 10 17  4  0  0  0  0
  8 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
 21 24  4  0  0  0  0
 18 22  4  0  0  0  0
 18 23  4  0  0  0  0
 16 24  4  0  0  0  0
 17 25  4  0  0  0  0
 21 26  1  0  0  0  0
  6 27  1  0  0  0  0
 27 28  1  0  0  0  0
  5  7  4  0  0  0  0
 21 25  4  0  0  0  0
  9 15  4  0  0  0  0
  6 20  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI16408

>  <IDNUMBER>
BAS 00290305

>  <Activity>
0
$$$$
ASI25557
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
   -0.5603   -0.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  5  9  4  0  0  0  0
  5 10  4  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  4  0  0  0  0
 12 16  4  0  0  0  0
  9 17  4  0  0  0  0
 10 18  4  0  0  0  0
 14 19  1  0  0  0  0
 16 20  4  0  0  0  0
 13 21  1  0  0  0  0
 18 22  4  0  0  0  0
 17 22  4  0  0  0  0
 19 21  1  0  0  0  0
 15 20  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25557

>  <IDNUMBER>
BAS 00363569

>  <Activity>
0
$$$$
ASI8663
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    1.3177   -0.2750    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0052    0.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0052    0.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2286   -0.7105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8766    0.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250   -0.7105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5411   -0.2980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6609   -1.5355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  4  9  1  0  0  0  0
  1  5  1  0  0  0  0
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  1  7  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  1  0  0  0  0
  5 10  1  0  0  0  0
  3 11  4  0  0  0  0
  3 12  4  0  0  0  0
  4 13  4  0  0  0  0
  4 14  4  0  0  0  0
  7 15  1  0  0  0  0
  6 16  1  0  0  0  0
 12 17  4  0  0  0  0
 11 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI8663

>  <IDNUMBER>
BAS 00170244

>  <Activity>
0
$$$$
ASI27586
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
   -0.5775    0.2914    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0648    0.9536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6675   -0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8489    0.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4780   -0.4132    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1309   -0.4132    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.8105   -1.1761    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8105    1.7694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  9 15  1  0  0  0  0
  3 10  2  0  0  0  0
  2 11  2  0  0  0  0
  5 12  2  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  4 17  1  0  0  0  0
  6 18  4  0  0  0  0
  7 19  4  0  0  0  0
  9 20  1  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
  6  7  4  0  0  0  0
 21 22  4  0  0  0  0
  9 16  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27586

>  <IDNUMBER>
BAS 00380531

>  <Activity>
0
$$$$
ASI11142
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    1.4598    1.1028    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4598    0.2871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2230    1.3583    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5146   -0.6617    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5603    0.7282    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7667    1.5964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3373   -0.7702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8520   -0.1120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4131   -1.4983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6699   -1.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  5  1  0  0  0  0
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  6 10  1  0  0  0  0
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 10 13  4  0  0  0  0
  6 14  2  0  0  0  0
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 13 16  4  0  0  0  0
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 10 18  4  0  0  0  0
 12 19  2  0  0  0  0
 20 21  4  0  0  0  0
 18 21  4  0  0  0  0
  2 22  1  0  0  0  0
  8 23  1  0  0  0  0
 12 24  1  0  0  0  0
 16 25  4  0  0  0  0
 20 26  4  0  0  0  0
 25 27  4  0  0  0  0
 26 28  4  0  0  0  0
  3  4  1  0  0  0  0
 16 20  4  0  0  0  0
 27 28  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI11142

>  <IDNUMBER>
BAS 00228480

>  <Activity>
0
$$$$
ASI30573
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.4308    0.7509    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0712    0.0105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5  7  2  0  0  0  0
  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 20  1  0  0  0  0
 11 16  4  0  0  0  0
 11 12  1  0  0  0  0
  9 13  4  0  0  0  0
  9 14  4  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  3  5  1  0  0  0  0
 10 19  1  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30573

>  <IDNUMBER>
BAS 00395328

>  <Activity>
0
$$$$
ASI16203
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -2.3210    0.2785    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5674    0.5674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1995    0.9215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6517   -0.6980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4029   -0.5777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2281   -0.5364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4866    0.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9170    0.2201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  4  0  0  0  0
  3  8  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  7 15  1  0  0  0  0
  8 10  4  0  0  0  0
  2  9  1  0  0  0  0
  5 10  4  0  0  0  0
  3 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 18 19  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  7 14  1  0  0  0  0
  2  3  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI16203

>  <IDNUMBER>
BAS 00289076

>  <Activity>
0
$$$$
ASI24195
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -0.3850    0.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0332    0.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3182    0.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3182   -0.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0332   -0.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3850   -0.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1354    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7639    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8582    0.2789    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7639    1.5518    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3182   -1.7757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2843   -0.5343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7639    3.1979    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3182    1.5243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2843    0.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5653   -0.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0293   -2.1843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3811   -3.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0332   -3.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3222   -3.4257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  4  6  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  4 11  1  0  0  0  0
 12 22  1  0  0  0  0
 13 20  1  0  0  0  0
  3 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 11 23  4  0  0  0  0
 11 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
 26 27  4  0  0  0  0
  4  5  4  0  0  0  0
 12 21  1  0  0  0  0
 13 19  1  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  2   9   1  10   1
M  END
>  <NAME>
ASI24195

>  <IDNUMBER>
BAS 00344495

>  <Activity>
0
$$$$
ASI5497
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
    0.9463    0.0876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3669    0.8017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4896   -0.5257    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1731    0.6177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2256   -0.2016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1139    0.0876    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0296    1.5641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3067   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1927    1.6648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1139   -1.3275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5378   -1.3231    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1172   -0.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5115    2.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7820    1.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9441   -0.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3571   -1.3231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7995   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7601   -2.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8214    2.8258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5969   -0.6309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5969   -2.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0174   -1.3275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  2  0  0  0  0
 11 12  1  0  0  0  0
  8 12  1  0  0  0  0
  7 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
  4  5  4  0  0  0  0
 21 23  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI5497

>  <IDNUMBER>
BAS 00128147

>  <Activity>
0
$$$$
ASI24389
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
   -0.9130   -0.4681    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9130    0.3801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1344   -0.7138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1344    0.6442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3337   -0.0464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6268   -0.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6036    0.8852    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8456    1.3812    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1529   -1.5109    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1772   -0.0464    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6706    2.7993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3359   -0.4681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6268   -1.7148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0496   -1.7148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3359   -2.1181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0496   -0.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5989    0.6627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4239    0.6627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7819   -2.1365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6706    1.3812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8456    2.7993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0924    2.0903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7819   -2.9847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  2  0  0  0  0
  8 18  1  0  0  0  0
  3  9  2  0  0  0  0
  5 10  1  0  0  0  0
 11 22  1  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
 14 16  4  0  0  0  0
 13 15  4  0  0  0  0
 12 16  4  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 14 19  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 19 24  1  0  0  0  0
  4  5  1  0  0  0  0
 14 15  4  0  0  0  0
 11 23  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24389

>  <IDNUMBER>
BAS 00345392

>  <Activity>
0
$$$$
ASI22403
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -1.7836    0.9290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2736    2.9153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7836    2.2869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9223   -0.2061    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.2364    2.2869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9223    1.9829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9255    0.5641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2466   -0.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
 15 17  4  0  0  0  0
 15 18  4  0  0  0  0
 16 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 22 25  4  0  0  0  0
 24 26  4  0  0  0  0
  2  9  1  0  0  0  0
  2  8  1  0  0  0  0
 23 26  4  0  0  0  0
 21 25  4  0  0  0  0
M  CHG  2   4   1   5   1
M  END
>  <NAME>
ASI22403

>  <IDNUMBER>
BAS 00334658

>  <Activity>
0
$$$$
ASI7304
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
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    0.3758    1.2800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1029   -0.1575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4890   -0.8585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 21  4  0  0  0  0
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  4  5  4  0  0  0  0
 19 22  4  0  0  0  0
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  7 20  4  0  0  0  0
 15 28  1  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI7304

>  <IDNUMBER>
BAS 00148458

>  <Activity>
0
$$$$
ASI6604
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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  1  3  2  0  0  0  0
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  4  8  1  0  0  0  0
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 12 16  4  0  0  0  0
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 11 16  4  0  0  0  0
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 18 20  4  0  0  0  0
 20 21  4  0  0  0  0
 15 22  1  0  0  0  0
 13 19  1  0  0  0  0
  9 12  4  0  0  0  0
 15 21  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI6604

>  <IDNUMBER>
BAS 00139203

>  <Activity>
0
$$$$
ASI26543
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    1.4675    0.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  4  0  0  0  0
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 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
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 20 24  1  0  0  0  0
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 17 26  4  0  0  0  0
 25 27  4  0  0  0  0
 22 23  1  0  0  0  0
 10 12  4  0  0  0  0
 26 27  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26543

>  <IDNUMBER>
BAS 00367493

>  <Activity>
0
$$$$
ASI24411
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
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 16 18  4  0  0  0  0
 10 17  1  0  0  0  0
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 17 23  4  0  0  0  0
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 23 25  4  0  0  0  0
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 21 27  4  0  0  0  0
 22 28  4  0  0  0  0
 26 29  4  0  0  0  0
 28 30  4  0  0  0  0
  5  6  1  0  0  0  0
 16 19  4  0  0  0  0
 27 30  4  0  0  0  0
 25 29  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24411

>  <IDNUMBER>
BAS 00345433

>  <Activity>
0
$$$$
ASI23038
  Marvin  04201015132D          

 19 22  0  0  0  0            999 V2000
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  4 10  4  0  0  0  0
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 12 19  1  0  0  0  0
 10 13  4  0  0  0  0
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 11 16  4  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 12 18  1  0  0  0  0
  2  3  4  0  0  0  0
  4  9  4  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI23038

>  <IDNUMBER>
BAS 00338425

>  <Activity>
0
$$$$
ASI10870
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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  1 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 16  4  0  0  0  0
  3 16  4  0  0  0  0
  2 17  4  0  0  0  0
 15 18  4  0  0  0  0
  7 19  4  0  0  0  0
 17 20  4  0  0  0  0
 20 21  4  0  0  0  0
  5 14  1  0  0  0  0
  7 18  4  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10870

>  <IDNUMBER>
BAS 00226354

>  <Activity>
0
$$$$
ASI6547
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
    0.7953   -0.5188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0969   -0.9165    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7953    0.3201    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6256    0.3201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3433   -0.9407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  1  7  2  0  0  0  0
  6  8  2  0  0  0  0
  5  9  2  0  0  0  0
  7 10  1  0  0  0  0
  4 11  1  0  0  0  0
  4 12  1  0  0  0  0
 10 13  4  0  0  0  0
 10 14  4  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 13 21  4  0  0  0  0
 14 22  4  0  0  0  0
 22 23  4  0  0  0  0
  4  6  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI6547

>  <IDNUMBER>
BAS 00138223

>  <Activity>
0
$$$$
ASI24145
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -0.2504   -1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5746   -1.0128    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9927   -0.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5523   -0.2616    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9837    1.1201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8177   -0.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2750    1.8266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  3  8  4  0  0  0  0
  8  9  4  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  4  0  0  0  0
  9 13  4  0  0  0  0
  7 14  4  0  0  0  0
 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  4  0  0  0  0
 17 18  4  0  0  0  0
 15 16  1  0  0  0  0
  7 13  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI24145

>  <IDNUMBER>
BAS 00344305

>  <Activity>
0
$$$$
ASI15977
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.3181   -0.2503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9118    0.4677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1040    0.2976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1448   -0.2503    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5417    0.4677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3181    1.1763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3920    0.4677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9118    1.9275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1070   -1.6866    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.5653   -0.9637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6897   -1.7243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8991    1.1102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2833    1.4173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  2  9  4  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 13 18  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  1  0  0  0  0
 21 22  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 13 19  1  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   8
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI15977

>  <IDNUMBER>
BAS 00288310

>  <Activity>
0
$$$$
ASI27138
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.0042    0.3320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7540    0.6806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3322   -0.6336    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9240   -0.4897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4318    0.1854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3265    0.8078    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5797   -0.9710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4233    0.4731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8508    0.6142    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0927    0.9544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5146   -0.3431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8204    1.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1688   -0.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2036    0.5201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4401    1.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9310   -0.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5022   -1.7844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6822    0.3735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4028   -0.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  6  8  1  0  0  0  0
  9 10  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
  4 13  4  0  0  0  0
  5 14  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
  7 17  4  0  0  0  0
 14 18  1  0  0  0  0
 13 19  4  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  3  7  4  0  0  0  0
 17 22  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27138

>  <IDNUMBER>
BAS 00371666

>  <Activity>
0
$$$$
ASI7038
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.6911    0.0679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6911   -0.7710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4102    0.4754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1172    0.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0400    0.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8883    0.4914    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.4102   -2.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 17  1  0  0  0  0
  7 10  2  0  0  0  0
  3 11  1  0  0  0  0
  7 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
 13 20  1  0  0  0  0
 14 21  4  0  0  0  0
 15 22  4  0  0  0  0
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
  5  6  4  0  0  0  0
 21 22  4  0  0  0  0
 23 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7038

>  <IDNUMBER>
BAS 00141391

>  <Activity>
0
$$$$
ASI6086
  Marvin  04201015132D          

 20 21  0  0  1  0            999 V2000
    1.2475    0.6182    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1825    0.6182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8975    0.1937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8975   -0.6517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1825    1.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1676   -1.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2475   -1.0428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  3  5  4  0  0  0  0
  6 11  1  0  0  0  0
  6  7  2  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  5 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  3 14  4  0  0  0  0
  5 15  4  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  4  0  0  0  0
 18 19  4  0  0  0  0
 17 20  1  0  0  0  0
 16 20  1  0  0  0  0
 15 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI6086

>  <IDNUMBER>
BAS 00134206

>  <Activity>
0
$$$$
ASI3273
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
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  1  3  1  0  0  0  0
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  3  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  4  0  0  0  0
 10 11  1  0  0  0  0
  7 12  4  0  0  0  0
 10 13  4  0  0  0  0
  9 14  4  0  0  0  0
  9 15  4  0  0  0  0
  8 16  4  0  0  0  0
  8 17  4  0  0  0  0
 12 18  4  0  0  0  0
 18 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 21 24  4  0  0  0  0
 23 25  4  0  0  0  0
  5  6  1  0  0  0  0
 22 25  4  0  0  0  0
 13 19  4  0  0  0  0
 20 24  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI3273

>  <IDNUMBER>
BAS 00104608

>  <Activity>
0
$$$$
ASI24222
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
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   -1.7079   -0.8725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7079   -0.0418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  8  1  0  0  0  0
  4  6  4  0  0  0  0
  5  9  3  0  0  0  0
  1  6  4  0  0  0  0
  7 17  1  0  0  0  0
  1  8  1  0  0  0  0
  9 19  1  0  0  0  0
  1 10  4  0  0  0  0
  2 11  1  0  0  0  0
 12 14  4  0  0  0  0
 11 13  1  0  0  0  0
 10 14  4  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 19 21  1  0  0  0  0
 10 20  1  0  0  0  0
  7 21  1  0  0  0  0
  2 22  1  0  0  0  0
  2 23  1  0  0  0  0
 13 24  1  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
  4 12  4  0  0  0  0
  7 18  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI24222

>  <IDNUMBER>
BAS 00344567

>  <Activity>
0
$$$$
ASI43
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -0.1565   -1.1241    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5692   -0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8822   -0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  4  6  4  0  0  0  0
  5  7  4  0  0  0  0
  3  8  1  0  0  0  0
  1  9  1  0  0  0  0
  6 10  4  0  0  0  0
  2 11  1  0  0  0  0
 10 12  4  0  0  0  0
 10 13  1  0  0  0  0
  8 14  4  0  0  0  0
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 15 16  4  0  0  0  0
 14 17  4  0  0  0  0
 16 18  4  0  0  0  0
  3  5  4  0  0  0  0
  7 12  4  0  0  0  0
 17 18  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI43

>  <IDNUMBER>
BAS 00004234

>  <Activity>
0
$$$$
ASI24435
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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  3  5  1  0  0  0  0
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  3  9  2  0  0  0  0
 10 23  1  0  0  0  0
  6 11  4  0  0  0  0
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 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
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 14 17  1  0  0  0  0
 18 19  1  0  0  0  0
 19 22  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
 13 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  4  5  1  0  0  0  0
 14 15  4  0  0  0  0
 10 24  1  0  0  0  0
M  CHG  2   8   1  13   1
M  END
>  <NAME>
ASI24435

>  <IDNUMBER>
BAS 00345482

>  <Activity>
0
$$$$
ASI1065
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
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  8 14  4  0  0  0  0
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 16 17  1  0  0  0  0
 18 24  4  0  0  0  0
 19 20  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 18 22  1  0  0  0  0
 23 25  4  0  0  0  0
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 17 25  4  0  0  0  0
 17 26  4  0  0  0  0
 19 27  1  0  0  0  0
 27 28  1  0  0  0  0
  4  5  1  0  0  0  0
 19 21  4  0  0  0  0
 18 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI1065

>  <IDNUMBER>
BAS 00063131

>  <Activity>
0
$$$$
ASI8459
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  4  0  0  0  0
  5  9  4  0  0  0  0
  6 10  4  0  0  0  0
  6 11  4  0  0  0  0
  7 12  4  0  0  0  0
  7 13  4  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 10 16  4  0  0  0  0
 11 17  4  0  0  0  0
  8 18  4  0  0  0  0
  9 19  4  0  0  0  0
 15 20  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
 18 22  4  0  0  0  0
 16 21  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI8459

>  <IDNUMBER>
BAS 00165516

>  <Activity>
0
$$$$
ASI24470
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
  3  5  4  0  0  0  0
  2  4  4  0  0  0  0
  5  6  4  0  0  0  0
  1  6  4  0  0  0  0
  7 10  1  0  0  0  0
  8 13  1  0  0  0  0
  3  9  1  0  0  0  0
  9 10  1  0  0  0  0
  1 11  4  0  0  0  0
  2 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  2  0  0  0  0
 15 22  4  0  0  0  0
  6 16  4  0  0  0  0
 11 17  4  0  0  0  0
 17 18  4  0  0  0  0
 17 19  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
 22 24  4  0  0  0  0
 23 25  4  0  0  0  0
 12 24  4  0  0  0  0
 12 25  4  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 27 28  1  0  0  0  0
  3  4  4  0  0  0  0
 16 18  4  0  0  0  0
 15 23  4  0  0  0  0
 26 28  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24470

>  <IDNUMBER>
BAS 00345562

>  <Activity>
0
$$$$
ASI24396
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
   -0.9746   -0.1934    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9746    0.6446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6762   -0.5916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6421    1.1377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0872   -1.2439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6762   -1.4260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
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  5  7  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
 10 19  4  0  0  0  0
  6 11  4  0  0  0  0
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 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
 15 16  4  0  0  0  0
 12 16  4  0  0  0  0
 11 17  4  0  0  0  0
 15 18  1  0  0  0  0
 13 19  4  0  0  0  0
 10 20  4  0  0  0  0
 13 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  5  1  0  0  0  0
 15 17  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24396

>  <IDNUMBER>
BAS 00345404

>  <Activity>
0
$$$$
ASI72
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    1.0050   -0.7431    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  3  8  1  0  0  0  0
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 10 11  1  0  0  0  0
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 11 15  4  0  0  0  0
  9 16  1  0  0  0  0
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 12 19  1  0  0  0  0
 18 20  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
  3  5  4  0  0  0  0
  7 15  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI72

>  <IDNUMBER>
BAS 00004307

>  <Activity>
0
$$$$
ASI7901
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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  8 10  1  0  0  0  0
 11 12  1  0  0  0  0
 10 12  1  0  0  0  0
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 11 15  1  0  0  0  0
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 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 18 21  4  0  0  0  0
 17 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 24  4  0  0  0  0
  3  5  4  0  0  0  0
 21 24  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI7901

>  <IDNUMBER>
BAS 00160587

>  <Activity>
0
$$$$
ASI10933
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
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  2  3  1  0  0  0  0
  3  5  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  5  9  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  7 12  4  0  0  0  0
  6 13  4  0  0  0  0
  6 14  4  0  0  0  0
  7 15  4  0  0  0  0
  8 16  1  0  0  0  0
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 13 18  4  0  0  0  0
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 15 20  4  0  0  0  0
 12 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
 20 23  4  0  0  0  0
 18 22  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10933

>  <IDNUMBER>
BAS 00226760

>  <Activity>
0
$$$$
ASI23063
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
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  1  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  1  0  0  0  0
  4 11  1  0  0  0  0
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  5 14  4  0  0  0  0
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 10 16  4  0  0  0  0
 10 17  4  0  0  0  0
 18 19  4  0  0  0  0
 15 19  4  0  0  0  0
 17 20  4  0  0  0  0
 16 21  4  0  0  0  0
 20 22  4  0  0  0  0
  6  9  1  0  0  0  0
  3  5  4  0  0  0  0
 14 18  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI23063

>  <IDNUMBER>
BAS 00338559

>  <Activity>
0
$$$$
ASI490
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  4  0  0  0  0
  5 10  4  0  0  0  0
 11 14  1  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
  8 14  1  0  0  0  0
  9 15  4  0  0  0  0
 15 16  4  0  0  0  0
 13 17  4  0  0  0  0
 12 18  4  0  0  0  0
 18 19  4  0  0  0  0
  3  5  4  0  0  0  0
 17 19  4  0  0  0  0
 10 16  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI490

>  <IDNUMBER>
BAS 00017731

>  <Activity>
0
$$$$
ASI18785
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    3.0534   -0.8964    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  7  2  0  0  0  0
  3  5  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  1  0  0  0  0
  6  9  4  0  0  0  0
  7 12  1  0  0  0  0
  5  8  4  0  0  0  0
  8  9  4  0  0  0  0
  1 10  4  0  0  0  0
  1 11  4  0  0  0  0
 12 16  4  0  0  0  0
  6 13  1  0  0  0  0
  1 14  1  0  0  0  0
 11 15  4  0  0  0  0
 10 16  4  0  0  0  0
  3 17  4  0  0  0  0
  4 18  4  0  0  0  0
 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
 12 15  4  0  0  0  0
  4  6  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18785

>  <IDNUMBER>
BAS 00314954

>  <Activity>
0
$$$$
1q84_TZ4
  Marvin  04201014582D          

 50 57  0  0  0  0            999 V2000
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 39 40  4  0  0  0  0
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M  CHG  1  12   1
M  STY  1   1 DAT
M  SAL   1  1  39
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <Activity>
1

>  <PDB_ID>
1q84_TZ4

$$$$
ASI27133
  Marvin  04201015132D          

 29 33  0  0  0  0            999 V2000
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    3.2772   -1.3603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6  7  4  0  0  0  0
  5  7  4  0  0  0  0
  4  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 14  1  0  0  0  0
  3 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 16 21  1  0  0  0  0
  6 17  4  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
  7 20  4  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 13 23  4  0  0  0  0
 13 24  4  0  0  0  0
 17 25  4  0  0  0  0
 20 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 27 29  4  0  0  0  0
  9 10  1  0  0  0  0
  4  6  4  0  0  0  0
 25 26  4  0  0  0  0
 28 29  4  0  0  0  0
 16 22  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI27133

>  <IDNUMBER>
BAS 00371651

>  <Activity>
0
$$$$
ASI31983
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -2.4689   -0.8645    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2080   -0.0740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1059   -1.2890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0631    0.6035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6908    0.9112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3435    1.3863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6238   -0.0234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9556   -0.4478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8124    1.8302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  1  0  0  0  0
  5  7  1  0  0  0  0
  3  6  1  0  0  0  0
  2  7  1  0  0  0  0
  4  8  2  0  0  0  0
  8  9  1  0  0  0  0
 10 13  4  0  0  0  0
  9 11  4  0  0  0  0
  9 12  4  0  0  0  0
 11 13  4  0  0  0  0
 12 14  4  0  0  0  0
 10 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  2 19  1  0  0  0  0
 15 20  1  0  0  0  0
  5  6  1  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI31983

>  <IDNUMBER>
BAS 00404527

>  <Activity>
0
$$$$
ASI24057
  Marvin  04201015132D          

 27 29  0  0  0  0            999 V2000
   -1.1790    0.2803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5516   -0.4122    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0199    0.2803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4362    0.9893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2729    0.9728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7231   -0.4328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6646    0.2803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7749    0.9893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9845   -1.1253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9638    0.3174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4362   -0.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2565   -0.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3438   -1.1459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3232    0.2803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5 18  1  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  8 16  4  0  0  0  0
  9 14  4  0  0  0  0
  1 10  2  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
  3 13  4  0  0  0  0
 13 14  4  0  0  0  0
 15 21  4  0  0  0  0
 16 20  4  0  0  0  0
  4 17  1  0  0  0  0
 12 18  1  0  0  0  0
 11 19  1  0  0  0  0
 17 20  4  0  0  0  0
 17 21  4  0  0  0  0
  7 22  1  0  0  0  0
  9 23  1  0  0  0  0
  5 24  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
 24 27  1  0  0  0  0
  7  9  4  0  0  0  0
  8 15  4  0  0  0  0
  5 19  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24057

>  <IDNUMBER>
BAS 00343503

>  <Activity>
0
$$$$
ASI7026
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.5910   -0.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3011    0.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5910   -0.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3011   -1.3134    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0153   -0.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1436    0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1519    1.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3011    1.1616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8496   -0.0574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9799    0.3366    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.7336    0.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7336   -1.3134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6899   -0.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4478   -0.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4478   -0.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  7  9  2  0  0  0  0
  2 10  1  0  0  0  0
  7 11  1  0  0  0  0
 12 16  1  0  0  0  0
  5 13  4  0  0  0  0
 11 14  1  0  0  0  0
  6 15  4  0  0  0  0
 14 16  1  0  0  0  0
 12 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  4  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 15 22  4  0  0  0  0
  5  6  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1  12   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI7026

>  <IDNUMBER>
BAS 00141376

>  <Activity>
0
$$$$
ASI17976
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
   -1.3409    0.2139    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6418    0.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0553   -1.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6265   -1.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  6 10  4  0  0  0  0
  6 11  4  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  4  0  0  0  0
 17 19  1  0  0  0  0
  4  5  4  0  0  0  0
 15 18  4  0  0  0  0
 16 19  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI17976

>  <IDNUMBER>
BAS 00311422

>  <Activity>
0
$$$$
ASI20371
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.5090   -1.0593    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4186   -0.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9663    1.0851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3071    0.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  8  9  4  0  0  0  0
  5  9  4  0  0  0  0
  3 10  1  0  0  0  0
  4 11  1  0  0  0  0
 10 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 12 15  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  1  0  0  0  0
 16 18  4  0  0  0  0
 15 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI20371

>  <IDNUMBER>
BAS 00321135

>  <Activity>
0
$$$$
ASI25860
  Marvin  04201015132D          

 20 23  0  0  0  0            999 V2000
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 11 16  1  0  0  0  0
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 13 15  4  0  0  0  0
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 18 19  4  0  0  0  0
 17 20  4  0  0  0  0
  3  8  4  0  0  0  0
 14 15  4  0  0  0  0
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 19 20  4  0  0  0  0
M  CHG  1   1   1
M  STY  1   1 DAT
M  SAL   1  1   1
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI25860

>  <IDNUMBER>
BAS 00364488

>  <Activity>
0
$$$$
ASI21329
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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 10 14  4  0  0  0  0
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 21 22  4  0  0  0  0
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 22 24  4  0  0  0  0
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 23 24  4  0  0  0  0
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M  CHG  1   6   1
M  END
>  <NAME>
ASI21329

>  <IDNUMBER>
BAS 00328664

>  <Activity>
0
$$$$
ASI9726
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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 13 14  4  0  0  0  0
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 12 15  2  0  0  0  0
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 11 20  1  0  0  0  0
 17 18  1  0  0  0  0
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M  CHG  1   3   1
M  END
>  <NAME>
ASI9726

>  <IDNUMBER>
BAS 00208190

>  <Activity>
0
$$$$
ASI15432
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
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 15 17  4  0  0  0  0
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 20 22  1  0  0  0  0
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M  CHG  1   7   1
M  END
>  <NAME>
ASI15432

>  <IDNUMBER>
BAS 00285733

>  <Activity>
0
$$$$
ASI28529
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
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 13 18  4  0  0  0  0
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 16 18  4  0  0  0  0
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  3  5  4  0  0  0  0
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 13 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI28529

>  <IDNUMBER>
BAS 00384600

>  <Activity>
0
$$$$
ASI17584
  Marvin  04201015132D          

 15 15  0  0  0  0            999 V2000
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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M  CHG  1   3   1
M  END
>  <NAME>
ASI17584

>  <IDNUMBER>
BAS 00297086

>  <Activity>
0
$$$$
ASI24196
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
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  4  5  4  0  0  0  0
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  7 17  1  0  0  0  0
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  1  9  2  0  0  0  0
  1 10  2  0  0  0  0
  2 11  1  0  0  0  0
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 15 16  4  0  0  0  0
 14 16  4  0  0  0  0
 12 17  1  0  0  0  0
 11 18  1  0  0  0  0
  6 19  4  0  0  0  0
  6 20  4  0  0  0  0
  5 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
 22 24  4  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
 13 27  1  0  0  0  0
 16 28  1  0  0  0  0
 24 29  1  0  0  0  0
  7 18  1  0  0  0  0
 23 24  4  0  0  0  0
  4 15  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24196

>  <IDNUMBER>
BAS 00344499

>  <Activity>
0
$$$$
ASI16378
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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  2  4  1  0  0  0  0
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  3  4  2  0  0  0  0
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  2  6  4  0  0  0  0
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  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  6 10  4  0  0  0  0
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 14 20  4  0  0  0  0
  9 15  1  0  0  0  0
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 17 21  4  0  0  0  0
  6 18  1  0  0  0  0
 13 19  4  0  0  0  0
 12 20  4  0  0  0  0
 11 21  4  0  0  0  0
  5 22  1  0  0  0  0
 17 23  1  0  0  0  0
 22 24  1  0  0  0  0
  5 15  1  0  0  0  0
 14 19  4  0  0  0  0
 10 17  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI16378

>  <IDNUMBER>
BAS 00290176

>  <Activity>
0
$$$$
ASI24141
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.2327   -0.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 16  1  0  0  0  0
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 15 21  4  0  0  0  0
 18 22  4  0  0  0  0
 21 23  4  0  0  0  0
 20 23  4  0  0  0  0
 16 17  1  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24141

>  <IDNUMBER>
BAS 00344297

>  <Activity>
0
$$$$
ASI17587
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    3.0774   -0.2259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
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  2  6  2  0  0  0  0
  6  7  1  0  0  0  0
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 10 12  4  0  0  0  0
  8 11  4  0  0  0  0
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 10 14  1  0  0  0  0
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 14 17  1  0  0  0  0
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 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 13 15  1  0  0  0  0
 10 11  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI17587

>  <IDNUMBER>
BAS 00297116

>  <Activity>
0
$$$$
ASI27143
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    0.5844    0.2549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  6  1  0  0  0  0
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 14 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 20  4  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 20 23  4  0  0  0  0
 18 24  1  0  0  0  0
 22 25  1  0  0  0  0
  3  7  4  0  0  0  0
 17 23  4  0  0  0  0
 21 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27143

>  <IDNUMBER>
BAS 00371675

>  <Activity>
0
$$$$
ASI7032
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.8453   -0.1276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  9 16  1  0  0  0  0
  7 10  2  0  0  0  0
  2 11  1  0  0  0  0
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 13 20  1  0  0  0  0
  5 14  4  0  0  0  0
 12 15  1  0  0  0  0
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 17 23  4  0  0  0  0
  5  6  4  0  0  0  0
 22 23  4  0  0  0  0
 13 21  1  0  0  0  0
M  CHG  1   9   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI7032

>  <IDNUMBER>
BAS 00141383

>  <Activity>
0
$$$$
ASI25329
  Marvin  04201015132D          

 23 23  0  0  0  0            999 V2000
   -1.3109   -0.3368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8740   -1.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  4  0  0  0  0
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  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  4  0  0  0  0
  3  8  4  0  0  0  0
  4  9  1  0  0  0  0
  1 10  1  0  0  0  0
  9 11  1  0  0  0  0
 12 22  1  0  0  0  0
 13 23  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
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  5 19  1  0  0  0  0
 11 20  1  0  0  0  0
 11 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  1  0  0  0  0
  4  8  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI25329

>  <IDNUMBER>
BAS 00355784

>  <Activity>
0
$$$$
ASI31719
  Marvin  04201015132D          

 30 32  0  0  0  0            999 V2000
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  3  5  1  0  0  0  0
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  1  7  1  0  0  0  0
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 13 25  1  0  0  0  0
  7 14  4  0  0  0  0
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 11 17  1  0  0  0  0
 10 18  1  0  0  0  0
 14 19  4  0  0  0  0
 15 20  4  0  0  0  0
 19 21  4  0  0  0  0
 22 26  4  0  0  0  0
 16 23  4  0  0  0  0
 16 24  4  0  0  0  0
 25 28  1  0  0  0  0
 23 26  4  0  0  0  0
 24 27  4  0  0  0  0
  6 28  1  0  0  0  0
 21 29  1  0  0  0  0
 22 30  1  0  0  0  0
  6 17  1  0  0  0  0
 20 21  4  0  0  0  0
 22 27  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI31719

>  <IDNUMBER>
BAS 00403003

>  <Activity>
0
$$$$
ASI27169
  Marvin  04201015132D          

 29 33  0  0  1  0            999 V2000
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  1  2  4  0  0  0  0
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  1  4  4  0  0  0  0
  1  5  1  0  0  0  0
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  3  8  1  0  0  0  0
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  2 10  1  0  0  0  0
 11 14  1  0  0  0  0
  5 12  1  0  0  0  0
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 13 16  1  0  0  0  0
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 11 18  1  0  0  0  0
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  7 20  4  0  0  0  0
 16 21  4  0  0  0  0
 16 22  4  0  0  0  0
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 18 24  1  0  0  0  0
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 21 28  4  0  0  0  0
 28 29  4  0  0  0  0
 10 12  1  0  0  0  0
  3  6  4  0  0  0  0
 23 26  4  0  0  0  0
 27 29  4  0  0  0  0
 24 25  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27169

>  <IDNUMBER>
BAS 00371744

>  <Activity>
0
$$$$
ASI25344
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.7991   -0.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
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  7  8  1  0  0  0  0
  3  8  1  0  0  0  0
  5  9  4  0  0  0  0
  4 10  4  0  0  0  0
  4 11  4  0  0  0  0
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 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 12 17  4  0  0  0  0
  9 18  4  0  0  0  0
 10 19  4  0  0  0  0
 11 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI25344

>  <IDNUMBER>
BAS 00355995

>  <Activity>
0
$$$$
ASI32071
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
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M  CHG  1   2   1
M  END
>  <NAME>
ASI32071

>  <IDNUMBER>
BAS 00405148

>  <Activity>
0
$$$$
ASI24403
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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  4  5  1  0  0  0  0
 15 18  4  0  0  0  0
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M  CHG  1   9   1
M  END
>  <NAME>
ASI24403

>  <IDNUMBER>
BAS 00345425

>  <Activity>
0
$$$$
1h22_E10
  Marvin  04201014582D          

 34 37  0  0  0  0            999 V2000
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M  CHG  2  12   1  23   1
M  STY  2   1 DAT   2 DAT
M  SAL   1  1   3
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  SAL   2  1  34
M  SDT   2 MRV_IMPLICIT_H                                        
M  SDD   2     0.0000    0.0000    DR    ALL  0       0  
M  SED   2 IMPL_H1
M  END
>  <Activity>
1

>  <PDB_ID>
1h22_E10

$$$$
ASI10854
  Marvin  04201015132D          

 30 32  0  0  0  0            999 V2000
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M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI10854

>  <IDNUMBER>
BAS 00226297

>  <Activity>
0
$$$$
ASI14464
  Marvin  04201015132D          

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M  CHG  1   6   1
M  END
>  <NAME>
ASI14464

>  <IDNUMBER>
BAS 00278529

>  <Activity>
0
$$$$
ASI14744
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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  3  9  1  0  0  0  0
  3 10  2  0  0  0  0
  2 11  4  0  0  0  0
  6 12  4  0  0  0  0
 13 19  1  0  0  0  0
 12 14  4  0  0  0  0
  6 15  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
  2 18  4  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 11 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
 11 14  4  0  0  0  0
 21 23  4  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI14744

>  <IDNUMBER>
BAS 00281505

>  <Activity>
0
$$$$
ASI11034
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    1.1600    0.3467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4083   -0.8975    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.8955    0.7452    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1470   -0.4925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4504    0.7744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0295   -1.7367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8955    1.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3175   -0.4730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4083   -1.7172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 16  1  0  0  0  0
  3  9  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
 10 13  1  0  0  0  0
  7 14  1  0  0  0  0
 15 17  1  0  0  0  0
 14 16  1  0  0  0  0
  6 17  1  0  0  0  0
  9 18  4  0  0  0  0
  9 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 21 22  4  0  0  0  0
  8 15  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI11034

>  <IDNUMBER>
BAS 00227508

>  <Activity>
0
$$$$
ASI14100
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.7606    0.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8879    1.1959    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5591    0.9855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3751   -0.1273    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6221    0.7696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1536    0.1605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8768   -0.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5315   -0.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0132    2.4305    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1814   -0.9411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8990    1.5834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0007    0.3045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7972   -1.5225    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.3108    1.0520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7627   -1.5557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  2  0  0  0  0
  6  7  1  0  0  0  0
  1  8  2  0  0  0  0
  7  9  4  0  0  0  0
  9 10  4  0  0  0  0
 11 13  4  0  0  0  0
  7 12  4  0  0  0  0
 12 13  4  0  0  0  0
  4 14  2  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
 13 18  1  0  0  0  0
 17 19  1  0  0  0  0
 15 20  4  0  0  0  0
 15 21  4  0  0  0  0
 19 22  1  0  0  0  0
 20 23  4  0  0  0  0
 21 24  4  0  0  0  0
 24 25  4  0  0  0  0
  3  4  1  0  0  0  0
 23 25  4  0  0  0  0
 10 11  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI14100

>  <IDNUMBER>
BAS 00273452

>  <Activity>
0
$$$$
ASI3229
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.9162   -0.7609    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5294    1.7310    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.2269   -0.3519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9162   -1.5978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2427    2.1589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6358   -2.0131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9592    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2029    2.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6486   -0.3392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2029   -0.3519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5294    0.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6358    0.4978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2427    0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9035    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5136   -0.7609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6358   -2.8342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3492   -1.5978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6725    2.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3492   -3.2432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3858    1.7912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0625   -2.8342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4207    0.9606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3 13  1  0  0  0  0
  4 16  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  9 15  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
 12 14  1  0  0  0  0
 10 13  1  0  0  0  0
  4 14  1  0  0  0  0
  3 15  1  0  0  0  0
 11 16  1  0  0  0  0
  7 17  4  0  0  0  0
  7 18  4  0  0  0  0
  8 19  4  0  0  0  0
  8 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 24 26  4  0  0  0  0
  2 12  1  0  0  0  0
 22 25  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI3229

>  <IDNUMBER>
BAS 00104354

>  <Activity>
0
$$$$
ASI31878
  Marvin  04201015132D          

 31 33  0  0  0  0            999 V2000
    2.1005   -1.6666    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0794    1.2328    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1005   -2.5078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3863   -2.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8200    1.6348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3863   -1.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3492    1.9365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5184    0.4920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6243    0.8200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9787    2.8517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2381    2.4443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6825   -2.5078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  4  0  0  0  0
  1  7  4  0  0  0  0
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 10 21  1  0  0  0  0
 11 12  1  0  0  0  0
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 16 17  4  0  0  0  0
 15 18  4  0  0  0  0
  6 19  4  0  0  0  0
  7 20  4  0  0  0  0
 20 21  1  0  0  0  0
 19 22  4  0  0  0  0
 11 23  1  0  0  0  0
 11 24  1  0  0  0  0
 11 25  1  0  0  0  0
  6 26  1  0  0  0  0
 14 27  4  0  0  0  0
 14 28  4  0  0  0  0
 27 29  4  0  0  0  0
 28 30  4  0  0  0  0
 30 31  4  0  0  0  0
 20 22  4  0  0  0  0
 29 31  4  0  0  0  0
 12 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI31878

>  <IDNUMBER>
BAS 00403822

>  <Activity>
0
$$$$
ASI14465
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.4331   -0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4331    1.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9564    1.3570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7540    1.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.0747    0.2779    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
 11 20  4  0  0  0  0
 12 19  4  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
  9 15  4  0  0  0  0
  9 16  4  0  0  0  0
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 18 19  4  0  0  0  0
 16 20  4  0  0  0  0
 15 21  4  0  0  0  0
 17 22  4  0  0  0  0
  3  5  1  0  0  0  0
 11 21  4  0  0  0  0
 12 22  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI14465

>  <IDNUMBER>
BAS 00278538

>  <Activity>
0
$$$$
ASI18909
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.6916   -0.5946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2074   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  6  4  0  0  0  0
  2  7  4  0  0  0  0
  8  9  4  0  0  0  0
  6  9  4  0  0  0  0
  7 10  4  0  0  0  0
  4 11  1  0  0  0  0
  5 12  2  0  0  0  0
 12 13  1  0  0  0  0
  8 14  4  0  0  0  0
 10 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  1  0  0  0  0
  9 19  1  0  0  0  0
 11 20  1  0  0  0  0
 11 21  1  0  0  0  0
 12 22  1  0  0  0  0
 18 23  1  0  0  0  0
 23 24  1  0  0  0  0
 11 13  1  0  0  0  0
  8 10  4  0  0  0  0
 16 17  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI18909

>  <IDNUMBER>
BAS 00315487

>  <Activity>
0
$$$$
ASI11493
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.7218   -0.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5362   -1.5753    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5362   -0.1387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3130   -0.8748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9486   -0.8748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3130    0.5761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5263    0.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9352    1.3121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5085   -0.8748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7487   -0.7041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5745    2.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9210   -1.5753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5085   -2.3113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 12  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
  8 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  1  0  0  0  0
 13 17  1  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
  2  5  4  0  0  0  0
 15 17  1  0  0  0  0
 16 22  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11493

>  <IDNUMBER>
BAS 00232227

>  <Activity>
0
$$$$
ASI25552
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
    0.0359   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7535   -0.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4712   -0.7295    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7116   -0.3349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0359   -1.5908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7535    0.5143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9066   -1.5670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7116    0.4964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4293   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1470    0.4964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4293    0.9031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1470   -0.3349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1889   -0.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8528    0.9210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9066   -0.7295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1889   -1.9676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0419    0.9269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4533    0.9269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5524    0.4964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5524   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0419    1.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4533    1.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7535    2.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  7 16  1  0  0  0  0
  4  8  4  0  0  0  0
  4  9  4  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
  9 12  4  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
 13 17  1  0  0  0  0
  6 18  4  0  0  0  0
  6 19  4  0  0  0  0
 15 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 24  4  0  0  0  0
 10 12  4  0  0  0  0
  7 17  1  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25552

>  <IDNUMBER>
BAS 00363532

>  <Activity>
0
$$$$
ASI14582
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -1.1096    0.9841    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8921   -0.1109    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8921    0.7301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6307    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1096   -0.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6076   -0.5139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6076    1.1359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161   -0.3912    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3230   -0.1109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3230    0.7301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1957    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4571   -0.3912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1098   -0.3912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9362   -0.3912    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.8629   -1.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8629    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7039   -1.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7039    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  2  6  4  0  0  0  0
  3  7  4  0  0  0  0
  8 11  1  0  0  0  0
  9 10  4  0  0  0  0
  7 10  4  0  0  0  0
  4 11  1  0  0  0  0
  8 12  1  0  0  0  0
 13 18  4  0  0  0  0
 13 14  1  0  0  0  0
 12 15  4  0  0  0  0
 12 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
  2  5  4  0  0  0  0
  6  9  4  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   1   1
M  STY  1   1 DAT
M  SAL   1  1   1
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI14582

>  <IDNUMBER>
BAS 00279462

>  <Activity>
0
$$$$
ASI11889
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.1131   -0.2502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6135    0.1405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0265   -0.2502    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.3333   -0.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0359    0.1405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8089    0.1405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4617    0.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0359    0.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7592   -0.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7592    1.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2587    0.1611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.1438    1.3367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.8396    0.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3 14  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  2  0  0  0  0
  6 19  1  0  0  0  0
  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
  9 12  4  0  0  0  0
  7 10  4  0  0  0  0
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 11 12  4  0  0  0  0
 10 13  4  0  0  0  0
 14 15  1  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 16 21  1  0  0  0  0
  9 13  4  0  0  0  0
  6 20  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI11889

>  <IDNUMBER>
BAS 00235955

>  <Activity>
0
$$$$
ASI13579
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.0638   -0.0466    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7937    0.3727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5119   -0.4349    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -3.9408   -1.2735    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2264    0.3727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2457   -1.6928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9408   -0.4659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  5 13  1  0  0  0  0
  1  6  1  0  0  0  0
  7 18  1  0  0  0  0
  2  8  4  0  0  0  0
  2  9  4  0  0  0  0
  9 10  4  0  0  0  0
  8 11  4  0  0  0  0
 11 12  4  0  0  0  0
 13 14  1  0  0  0  0
 14 17  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 12 20  1  0  0  0  0
 10 12  4  0  0  0  0
  7 19  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI13579

>  <IDNUMBER>
BAS 00265309

>  <Activity>
0
$$$$
ASI11036
  Marvin  04201015132D          

 28 29  0  0  0  0            999 V2000
    2.1332    1.4814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1332    0.6518    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4090    0.2370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8311    1.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4222    1.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6683   -1.0271    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8279    2.7159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4222    2.7060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4057   -0.6123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6979    0.6518    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1200    3.1406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5012   -0.6123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7605   -1.8567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8575   -2.3801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6683   -1.8567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7111    1.4814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5554    1.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7605   -1.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0494   -2.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2122   -1.8567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5012   -2.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0426   -1.4485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6772   -2.1925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1200    3.9537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6  9  1  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  3  9  1  0  0  0  0
  3 10  2  0  0  0  0
  8 11  4  0  0  0  0
 12 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
 15 23  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  5 18  1  0  0  0  0
  4 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 12 24  1  0  0  0  0
 13 25  1  0  0  0  0
 14 26  1  0  0  0  0
 15 27  1  0  0  0  0
 11 28  1  0  0  0  0
  7 11  4  0  0  0  0
 26 27  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11036

>  <IDNUMBER>
BAS 00227511

>  <Activity>
0
$$$$
ASI25033
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
   -0.2546   -0.1559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7428    0.4987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7428   -0.8260    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5014    0.2494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5714   -0.1559    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.5014   -0.5766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4935    1.2936    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9559   -0.8728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3220    1.4962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2390    0.6702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2390   -0.9819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8675    0.8728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5714    2.2598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5714   -1.5741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7819   -0.8728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9196    0.2494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9196   -0.5766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6573    1.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3662    2.4313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9559   -2.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2027   -1.6053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9066    1.8079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7819   -2.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  2  0  0  0  0
  3  6  1  0  0  0  0
  2  7  2  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  4 10  4  0  0  0  0
  6 11  4  0  0  0  0
  9 12  4  0  0  0  0
  9 13  4  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
 10 16  4  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  4  6  4  0  0  0  0
 16 17  4  0  0  0  0
 20 23  4  0  0  0  0
 18 22  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI25033

>  <IDNUMBER>
BAS 00350310

>  <Activity>
0
$$$$
ASI30112
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.8494   -0.6201    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2853   -1.2153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4341    0.1054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4341   -0.8619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3783   -0.0868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6492   -0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9982    0.4527    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4341   -2.0524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7317    0.8680    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0710   -1.3330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0710    0.1054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981    0.1798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3172   -0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8955   -1.3330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8955    0.1054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1543   -0.6201    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.4244    0.7192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2445    1.5190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2056    0.4527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9080    2.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8009    0.9982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6521    1.7920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
  6 10  4  0  0  0  0
  6 11  4  0  0  0  0
  7 12  1  0  0  0  0
 13 14  4  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
 13 16  1  0  0  0  0
 12 17  1  0  0  0  0
 17 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  5  1  0  0  0  0
 13 15  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI30112

>  <IDNUMBER>
BAS 00393555

>  <Activity>
0
$$$$
ASI11396
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
    1.4604    0.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4604   -0.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7431    0.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0258   -0.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7431   -1.1353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0258    0.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6967   -1.1353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1776    0.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4140   -0.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6967    0.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1776   -1.1353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1776    1.3159    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1312   -1.1353    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4140    0.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4707    1.7287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7431    1.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1312   -1.9661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8331   -0.7173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0630    1.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8835    2.4305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7689    2.1467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8640   -2.3841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8228    0.1291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  4  5  4  0  0  0  0
  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
  4  7  4  0  0  0  0
  1  8  1  0  0  0  0
  7  9  4  0  0  0  0
  6 10  4  0  0  0  0
  2 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  4  0  0  0  0
 12 15  1  0  0  0  0
  3 16  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  1  0  0  0  0
 15 21  1  0  0  0  0
 17 22  1  0  0  0  0
 18 23  1  0  0  0  0
  4  6  4  0  0  0  0
  9 14  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI11396

>  <IDNUMBER>
BAS 00231791

>  <Activity>
0
$$$$
ASI30182
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
    1.9192   -0.3465    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6548    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6548    0.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3279   -0.3465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0862    0.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0435    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0862    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3660   -0.3510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4833   -0.3465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6258    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9436   -0.3465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2325    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2035    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9436    1.3038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2325    0.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7502   -0.3465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4833   -1.1625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0435    0.8889    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9192   -1.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3279   -1.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8019    1.3038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8019   -0.3465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6258   -1.5727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5085    0.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5085    0.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 11  4  0  0  0  0
  3 14  4  0  0  0  0
  4 10  4  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  7  8  1  0  0  0  0
  2  8  1  0  0  0  0
  9 13  1  0  0  0  0
  1 10  4  0  0  0  0
 11 12  4  0  0  0  0
  9 12  1  0  0  0  0
  1 13  1  0  0  0  0
 14 15  4  0  0  0  0
 12 15  4  0  0  0  0
  6 16  2  0  0  0  0
  9 17  2  0  0  0  0
  6 18  1  0  0  0  0
  1 19  4  0  0  0  0
 20 23  4  0  0  0  0
  5 21  4  0  0  0  0
  7 22  4  0  0  0  0
 19 23  4  0  0  0  0
 21 24  4  0  0  0  0
 22 25  4  0  0  0  0
  4 20  4  0  0  0  0
  2  3  4  0  0  0  0
  5  7  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30182

>  <IDNUMBER>
BAS 00393772

>  <Activity>
0
$$$$
1ut6_A8N
  Marvin  04201014582D          

 24 26  0  0  0  0            999 V2000
    6.2315   36.9423    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.9460   36.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6605   36.9423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3749   36.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0894   36.9423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8039   36.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5183   36.9423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2328   36.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9473   36.9423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6618   36.5298    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3762   36.9423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3762   37.7673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0907   38.1798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8052   37.7673    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Activity>
1

>  <PDB_ID>
1ut6_A8N

$$$$
ASI18192
  Marvin  04201015132D          

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M  END
>  <NAME>
ASI18192

>  <IDNUMBER>
BAS 00312378

>  <Activity>
0
$$$$
ASI11065
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
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M  END
>  <NAME>
ASI11065

>  <IDNUMBER>
BAS 00227786

>  <Activity>
0
$$$$
ASI27577
  Marvin  04201015132D          

 37 41  0  0  1  0            999 V2000
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 31 35  4  0  0  0  0
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M  CHG  1   9   1
M  END
>  <NAME>
ASI27577

>  <IDNUMBER>
BAS 00380485

>  <Activity>
0
$$$$
ASI10834
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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M  CHG  1   3   1
M  END
>  <NAME>
ASI10834

>  <IDNUMBER>
BAS 00226232

>  <Activity>
0
$$$$
ASI22911
  Marvin  04201015132D          

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    0.2607   -2.6130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  8 11  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  4 11  1  0  0  0  0
  3 12  4  0  0  0  0
  2 13  2  0  0  0  0
 12 14  1  0  0  0  0
  3 15  4  0  0  0  0
  5 16  1  0  0  0  0
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  8 18  1  0  0  0  0
 12 19  4  0  0  0  0
 15 20  4  0  0  0  0
 20 21  4  0  0  0  0
  5  9  1  0  0  0  0
  8 10  1  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22911

>  <IDNUMBER>
BAS 00337646

>  <Activity>
0
$$$$
ASI26542
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
    0.4042    0.1645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0235    0.8837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4231   -1.2692    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.5547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8367    0.8837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2410    1.6076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2644    0.1645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4819    0.8837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4819   -0.5547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8627    0.1645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  5  8  4  0  0  0  0
  2  9  1  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
  7 12  4  0  0  0  0
 10 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  6 16  4  0  0  0  0
  6 17  4  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
 14 20  1  0  0  0  0
 16 21  4  0  0  0  0
 17 22  4  0  0  0  0
 21 23  4  0  0  0  0
 19 20  1  0  0  0  0
 10 12  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26542

>  <IDNUMBER>
BAS 00367492

>  <Activity>
0
$$$$
ASI15364
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.7087    0.9731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0245    1.3166    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1963   -0.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6051    0.7114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6133    0.1336    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4392    1.3684    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7009   -1.6191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8318   -0.2017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1589    0.9404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2021   -2.2951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9030    1.3439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1589    0.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6226    0.9404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9030   -0.3325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6226    0.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  2  0  0  0  0
  6  7  1  0  0  0  0
  1  8  2  0  0  0  0
  7  9  4  0  0  0  0
  4 10  2  0  0  0  0
  7 11  4  0  0  0  0
  9 12  4  0  0  0  0
 11 13  4  0  0  0  0
  8 14  1  0  0  0  0
 13 15  4  0  0  0  0
 13 16  1  0  0  0  0
  9 17  1  0  0  0  0
 14 18  4  0  0  0  0
 14 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  4  1  0  0  0  0
 20 22  4  0  0  0  0
 12 15  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15364

>  <IDNUMBER>
BAS 00285501

>  <Activity>
0
$$$$
ASI24401
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -0.8030   -0.2414    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8030    0.6035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0232   -0.4874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0232    0.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4456    0.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5179   -0.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2904    0.1810    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4948    1.1094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2646   -1.2904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5392    0.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9384    0.1810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2282   -0.2414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5179   -1.4901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7129    0.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9431   -1.4901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9431   -0.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2282   -1.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9616    1.6062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6765   -1.9125    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.7879    1.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2103    2.3210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
 10 14  1  0  0  0  0
 10 11  2  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
  7 14  1  0  0  0  0
 15 16  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  4  0  0  0  0
 10 18  1  0  0  0  0
 15 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  4  5  1  0  0  0  0
 15 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24401

>  <IDNUMBER>
BAS 00345412

>  <Activity>
0
$$$$
ASI26657
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
   -1.3009    0.5278    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3009    1.8431    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    1.1941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3556   -0.7874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0441   -0.2596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2394   -0.4500    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1604   -0.9403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0710    1.5893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7806    0.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5074    1.5893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  4 11  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  4  0  0  0  0
  5  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  4  0  0  0  0
  8 10  4  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  6 15  4  0  0  0  0
  8 16  4  0  0  0  0
 10 17  4  0  0  0  0
  9 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
  2  9  4  0  0  0  0
  4 12  1  0  0  0  0
 18 22  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI26657

>  <IDNUMBER>
BAS 00367965

>  <Activity>
0
$$$$
ASI13066
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.3454   -0.4779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0835    0.3044    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1307   -0.7336    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  4 10  2  0  0  0  0
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 11 14  1  0  0  0  0
  8 15  4  0  0  0  0
 15 16  4  0  0  0  0
 16 17  4  0  0  0  0
 12 18  4  0  0  0  0
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 13 20  1  0  0  0  0
 14 21  1  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 11 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI13066

>  <IDNUMBER>
BAS 00257780

>  <Activity>
0
$$$$
ASI2775
  Marvin  04201015132D          

 18 20  0  0  1  0            999 V2000
   -0.0186    0.3577    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7005    0.8534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9688    1.6434    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0421    0.8534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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  1  4  1  0  0  0  0
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  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
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  7 12  1  0  0  0  0
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 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
 17 18  4  0  0  0  0
  3  5  1  0  0  0  0
 11 12  1  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  2   1   1  13  -1
M  END
>  <NAME>
ASI2775

>  <IDNUMBER>
BAS 00099420

>  <Activity>
0
$$$$
ASI10836
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  1  8  1  0  0  0  0
  2  9  2  0  0  0  0
  6 10  4  0  0  0  0
  5 11  1  0  0  0  0
  8 12  1  0  0  0  0
  7 13  1  0  0  0  0
 14 16  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 15 19  1  0  0  0  0
  6 20  4  0  0  0  0
 10 21  4  0  0  0  0
 17 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  1  0  0  0  0
 25 26  4  0  0  0  0
 20 26  4  0  0  0  0
 22 27  4  0  0  0  0
 23 28  4  0  0  0  0
 28 29  4  0  0  0  0
  5 12  1  0  0  0  0
 21 25  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI10836

>  <IDNUMBER>
BAS 00226236

>  <Activity>
0
$$$$
ASI21202
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
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   -1.4164    0.0286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  1  0  0  0  0
  4  6  4  0  0  0  0
  1  7  4  0  0  0  0
  4  8  4  0  0  0  0
  9 13  4  0  0  0  0
 10 12  4  0  0  0  0
  2 11  1  0  0  0  0
  5 12  1  0  0  0  0
 13 19  4  0  0  0  0
 14 17  4  0  0  0  0
 11 15  1  0  0  0  0
  3 16  4  0  0  0  0
  7 17  4  0  0  0  0
  8 18  4  0  0  0  0
 12 19  4  0  0  0  0
 14 20  1  0  0  0  0
  9 21  1  0  0  0  0
 15 22  1  0  0  0  0
 15 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  6 14  4  0  0  0  0
 16 18  4  0  0  0  0
  2  9  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI21202

>  <IDNUMBER>
BAS 00327385

>  <Activity>
0
$$$$
ASI16439
  Marvin  04201015132D          

 32 36  0  0  0  0            999 V2000
    3.0112    0.3438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 15 20  4  0  0  0  0
 16 21  4  0  0  0  0
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 10 18  1  0  0  0  0
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 17 20  4  0  0  0  0
 17 21  4  0  0  0  0
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 14 23  1  0  0  0  0
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 11 25  4  0  0  0  0
 23 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 28 29  4  0  0  0  0
 26 30  4  0  0  0  0
 27 31  4  0  0  0  0
 31 32  4  0  0  0  0
 11 13  4  0  0  0  0
 25 29  4  0  0  0  0
  7 15  4  0  0  0  0
  6 18  1  0  0  0  0
 30 32  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI16439

>  <IDNUMBER>
BAS 00290611

>  <Activity>
0
$$$$
ASI17601
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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  2  5  4  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  4  0  0  0  0
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  4  7  2  0  0  0  0
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  8 10  1  0  0  0  0
 11 15  4  0  0  0  0
 10 12  4  0  0  0  0
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 13 14  4  0  0  0  0
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 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  2  3  4  0  0  0  0
 11 14  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI17601

>  <IDNUMBER>
BAS 00297167

>  <Activity>
0
$$$$
ASI15981
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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  7  8  4  0  0  0  0
  2  9  4  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  2  0  0  0  0
 14 20  1  0  0  0  0
  6 15  1  0  0  0  0
 11 16  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 16 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 14 19  1  0  0  0  0
M  CHG  1  14   1
M  STY  1   1 DAT
M  SAL   1  1   8
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI15981

>  <IDNUMBER>
BAS 00288314

>  <Activity>
0
$$$$
ASI18194
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
    0.4502   -0.3039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9004    0.3827    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3977    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3601   -0.0675    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3977    0.7428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6303    1.8420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0429    1.2830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  4  0  0  0  0
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 10 13  4  0  0  0  0
 10 14  4  0  0  0  0
 11 15  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
 16 19  4  0  0  0  0
 18 20  4  0  0  0  0
  3  5  1  0  0  0  0
 15 19  4  0  0  0  0
 17 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18194

>  <IDNUMBER>
BAS 00312384

>  <Activity>
0
$$$$
ASI15377
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.5189   -0.2979    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2275    0.1946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1730    0.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1057    1.0305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5189   -1.1531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4036    1.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2467   -1.5927    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0467   -0.0649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0017   -0.0385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    1.5470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7385   -2.4863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6321    1.1578    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9987   -2.9067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  2  0  0  0  0
  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  7 11  1  0  0  0  0
 12 22  1  0  0  0  0
 13 17  4  0  0  0  0
 13 14  1  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
  4  5  1  0  0  0  0
 12 21  1  0  0  0  0
 13 18  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15377

>  <IDNUMBER>
BAS 00285532

>  <Activity>
0
$$$$
ASI27160
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
    0.8553   -0.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8553   -2.2831    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693   -1.0506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1279   -1.0506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693   -1.8790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1279   -1.8790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8553    0.1919    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1279    0.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5825    1.8386    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1279    1.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5825    0.1919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3606   -0.7947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5825   -0.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3606   -2.1215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5825   -2.2831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4512    2.6468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2931    1.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8287   -1.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2931   -1.0506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0542    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2931   -1.8790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8117    3.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2966    2.5189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  2  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  2  5  4  0  0  0  0
 14 18  1  0  0  0  0
 15 22  1  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27160

>  <IDNUMBER>
BAS 00371703

>  <Activity>
0
$$$$
ASI15360
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
   -0.8172   -0.4976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5209   -0.0026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1263    0.0129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4047    0.8275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2632    0.8275    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8172   -1.3482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1057    1.4591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5339   -1.7916    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2402    1.8535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330   -0.2629    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5108    1.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7064   -0.2449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8898    2.3639    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3538    1.1033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5833    1.8921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  2  0  0  0  0
  6  8  1  0  0  0  0
  9 17  4  0  0  0  0
  2 10  2  0  0  0  0
 11 18  4  0  0  0  0
  3 12  2  0  0  0  0
  9 13  1  0  0  0  0
  7 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  4  0  0  0  0
 18 19  4  0  0  0  0
 14 19  4  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
  4  5  1  0  0  0  0
 22 24  1  0  0  0  0
  9 11  4  0  0  0  0
 15 16  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15360

>  <IDNUMBER>
BAS 00285497

>  <Activity>
0
$$$$
ASI26665
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
    2.0995   -0.3529    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6150   -0.9809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0147   -0.1794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  7 11  4  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
 10 13  4  0  0  0  0
 11 14  4  0  0  0  0
  5 12  1  0  0  0  0
 13 15  4  0  0  0  0
 14 21  1  0  0  0  0
 14 15  4  0  0  0  0
  7 16  1  0  0  0  0
 10 17  1  0  0  0  0
 12 18  1  0  0  0  0
  6 19  4  0  0  0  0
  6 20  4  0  0  0  0
 18 21  1  0  0  0  0
 16 22  1  0  0  0  0
 17 23  1  0  0  0  0
 20 24  4  0  0  0  0
 19 25  4  0  0  0  0
 24 26  4  0  0  0  0
  4  5  1  0  0  0  0
 25 26  4  0  0  0  0
  7 10  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI26665

>  <IDNUMBER>
BAS 00368135

>  <Activity>
0
$$$$
ASI18164
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
   -0.6220    0.5465    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0963    0.9682    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2356   -0.2733    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.3664    0.1249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0540    1.2649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  6  1  0  0  0  0
  1  4  1  0  0  0  0
  5 11  1  0  0  0  0
  6 10  1  0  0  0  0
  2  7  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  4 12  4  0  0  0  0
  4 13  4  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 15 16  4  0  0  0  0
  5 17  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  5 20  1  0  0  0  0
 16 21  1  0  0  0  0
 14 16  4  0  0  0  0
  3  5  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI18164

>  <IDNUMBER>
BAS 00312230

>  <Activity>
0
$$$$
ASI969
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
    0.1877    0.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1877   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9131   -0.8152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  1  7  1  0  0  0  0
  4  8  4  0  0  0  0
  9 10  4  0  0  0  0
  8 10  4  0  0  0  0
 11 21  1  0  0  0  0
  7 12  2  0  0  0  0
  2 13  1  0  0  0  0
 11 14  2  0  0  0  0
 13 15  1  0  0  0  0
  3 16  1  0  0  0  0
  9 17  1  0  0  0  0
  7 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
 15 21  1  0  0  0  0
 18 22  1  0  0  0  0
 20 23  1  0  0  0  0
 19 24  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
  3  5  4  0  0  0  0
  6  9  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI969

>  <IDNUMBER>
BAS 00053883

>  <Activity>
0
$$$$
ASI22509
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
   -1.9479    0.6040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2267    0.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6506    0.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6506   -0.6410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2267   -0.6780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8999    0.6040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6150    0.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3238    0.6040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0389   -0.6410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5425    1.4546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  6 12  1  0  0  0  0
  5  7  4  0  0  0  0
  4  8  2  0  0  0  0
  2  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5 16  4  0  0  0  0
  7 17  4  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
 19 22  1  0  0  0  0
  3  7  1  0  0  0  0
 17 21  4  0  0  0  0
 18 22  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI22509

>  <IDNUMBER>
BAS 00335415

>  <Activity>
0
$$$$
ASI7042
  Marvin  04201015132D          

 27 28  0  0  0  0            999 V2000
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   -2.1689    0.1521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0195   -1.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8241    0.5657    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0195    1.3965    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4550    1.3848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6865    0.1521    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
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  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 17  1  0  0  0  0
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  3 11  1  0  0  0  0
  7 12  1  0  0  0  0
  4 13  1  0  0  0  0
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  6 15  4  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  4  0  0  0  0
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
 20 25  1  0  0  0  0
 15 26  4  0  0  0  0
 21 27  1  0  0  0  0
  5  6  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7042

>  <IDNUMBER>
BAS 00141395

>  <Activity>
0
$$$$
ASI27154
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
    0.4966   -0.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5 14  1  0  0  0  0
  9 15  1  0  0  0  0
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 12 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 13 21  4  0  0  0  0
 15 22  1  0  0  0  0
 16 23  1  0  0  0  0
 21 24  4  0  0  0  0
 18 25  1  0  0  0  0
 20 26  1  0  0  0  0
 22 27  1  0  0  0  0
 23 28  1  0  0  0  0
  3  7  4  0  0  0  0
 17 24  4  0  0  0  0
 27 28  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27154

>  <IDNUMBER>
BAS 00371692

>  <Activity>
0
$$$$
ASI22945
  Marvin  04201015132D          

 17 17  0  0  0  0            999 V2000
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 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
  7 11  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI22945

>  <IDNUMBER>
BAS 00337847

>  <Activity>
0
$$$$
ASI6548
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
    0.6163   -0.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0825   -0.9463    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6163    0.2912    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8056    0.2912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5237   -0.9705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  1  7  2  0  0  0  0
  6  8  2  0  0  0  0
  5  9  2  0  0  0  0
  7 10  1  0  0  0  0
  4 11  1  0  0  0  0
  4 12  1  0  0  0  0
 13 16  4  0  0  0  0
 10 14  4  0  0  0  0
 10 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
 13 18  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
 21 24  1  0  0  0  0
  4  6  1  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI6548

>  <IDNUMBER>
BAS 00138225

>  <Activity>
0
$$$$
ASI613
  Marvin  04201015132D          

 28 32  0  0  1  0            999 V2000
   -1.7686    0.4829    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599    0.9344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4020    1.0035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2509    0.7274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2236    0.8780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7463   -0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6465    2.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7025    2.3142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1009   -2.0571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7566    1.5365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.0012    2.9163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5218   -2.6216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  4  5  4  0  0  0  0
  1  5  4  0  0  0  0
  6 10  1  0  0  0  0
  2  7  1  0  0  0  0
  1  8  1  0  0  0  0
  5  9  4  0  0  0  0
  8 10  1  0  0  0  0
  6 11  1  0  0  0  0
  4 12  4  0  0  0  0
 11 13  1  0  0  0  0
  3 14  1  0  0  0  0
 15 18  1  0  0  0  0
  9 16  4  0  0  0  0
 12 17  4  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
  7 20  1  0  0  0  0
 13 21  1  0  0  0  0
 20 22  1  0  0  0  0
 17 23  1  0  0  0  0
 19 24  4  0  0  0  0
 19 25  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
 27 28  4  0  0  0  0
  3  4  4  0  0  0  0
  6  7  1  0  0  0  0
 16 17  4  0  0  0  0
 14 22  1  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI613

>  <IDNUMBER>
BAS 00024157

>  <Activity>
0
$$$$
1maa_DME
  Marvin  04201014582D          

 18 17  0  0  0  0            999 V2000
   26.2447   54.7926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9592   55.2051    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   27.3717   54.4906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.5467   55.9196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.6736   55.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.3881   55.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.1026   55.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.8170   55.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.5315   55.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.2460   55.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.9605   55.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.6749   55.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3894   55.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.1039   55.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.8183   55.6176    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   35.5328   56.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.2308   54.9031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.4058   56.3321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  2   2   1  15   1
M  END
>  <Activity>
1

>  <PDB_ID>
1maa_DME

$$$$
ASI29140
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -0.6130    0.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7164   -0.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220    0.4912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4358   -0.7496    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0960    0.4726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3619   -0.8382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0532    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5361    0.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0642   -0.7681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2999    1.3256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7547    0.4912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0960    1.3109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6130    1.7134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8655   -0.4136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7547    1.3109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3751   -1.0487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9675   -1.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  4  6  4  0  0  0  0
  3  7  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
  3 11  4  0  0  0  0
  7 12  1  0  0  0  0
  5 13  4  0  0  0  0
 11 14  4  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 12 17  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
  2  6  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1  10   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI29140

>  <IDNUMBER>
BAS 00388278

>  <Activity>
0
$$$$
ASI3906
  Marvin  04201015132D          

 28 32  0  0  1  0            999 V2000
   -0.3408   -0.9028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  6  8  4  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
  6 15  4  0  0  0  0
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 13 17  4  0  0  0  0
 13 18  4  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 21 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 20 26  4  0  0  0  0
 24 27  4  0  0  0  0
 26 28  4  0  0  0  0
  7  8  4  0  0  0  0
 11 12  1  0  0  0  0
 16 22  4  0  0  0  0
 25 28  4  0  0  0  0
 23 27  4  0  0  0  0
M  CHG  1   4   1
M  STY  1   1 DAT
M  SAL   1  1   7
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI3906

>  <IDNUMBER>
BAS 00112464

>  <Activity>
0
$$$$
ASI25555
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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 10 12  4  0  0  0  0
  7 17  1  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25555

>  <IDNUMBER>
BAS 00363541

>  <Activity>
0
$$$$
ASI30165
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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 13 14  4  0  0  0  0
 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
 13 16  1  0  0  0  0
  6 17  4  0  0  0  0
  9 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
  6  9  4  0  0  0  0
 19 20  4  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30165

>  <IDNUMBER>
BAS 00393742

>  <Activity>
0
$$$$
ASI24197
  Marvin  04201015132D          

 33 36  0  0  0  0            999 V2000
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  3  8  4  0  0  0  0
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 15 17  4  0  0  0  0
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 14 17  4  0  0  0  0
 11 18  1  0  0  0  0
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  6 20  4  0  0  0  0
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 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
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 16 28  4  0  0  0  0
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 29 31  4  0  0  0  0
 28 32  4  0  0  0  0
 31 33  4  0  0  0  0
  7 19  1  0  0  0  0
 22 24  4  0  0  0  0
  4 15  4  0  0  0  0
 32 33  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24197

>  <IDNUMBER>
BAS 00344501

>  <Activity>
0
$$$$
ASI17607
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
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 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
  2  7  1  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI17607

>  <IDNUMBER>
BAS 00297185

>  <Activity>
0
$$$$
ASI16327
  Marvin  04201015132D          

 37 41  0  0  0  0            999 V2000
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 30 32  4  0  0  0  0
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 34 35  4  0  0  0  0
 33 36  4  0  0  0  0
 35 37  4  0  0  0  0
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 21 27  4  0  0  0  0
 36 37  4  0  0  0  0
 25 32  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16327

>  <IDNUMBER>
BAS 00289820

>  <Activity>
0
$$$$
ASI28797
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
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    2.9171    0.9988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  2  8  1  0  0  0  0
  8  9  4  0  0  0  0
  6 10  1  0  0  0  0
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 13 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 15 22  1  0  0  0  0
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 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 16 26  4  0  0  0  0
 17 27  4  0  0  0  0
 24 28  1  0  0  0  0
 25 29  1  0  0  0  0
  9 10  1  0  0  0  0
  4  7  4  0  0  0  0
 22 23  1  0  0  0  0
 26 27  4  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI28797

>  <IDNUMBER>
BAS 00386201

>  <Activity>
0
$$$$
ASI17644
  Marvin  04201015132D          

 21 24  0  0  1  0            999 V2000
   -0.5796    0.0504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2293   -0.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6048    1.2121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5422    0.0504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4238   -0.7661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1831   -1.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  1  0  0  0  0
  3  6  4  0  0  0  0
  4  7  4  0  0  0  0
  3  8  1  0  0  0  0
  2  9  1  0  0  0  0
  8 10  1  0  0  0  0
  5 11  1  0  0  0  0
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  2 13  1  0  0  0  0
  6 14  4  0  0  0  0
  7 15  4  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 14 19  4  0  0  0  0
 15 20  4  0  0  0  0
 18 21  1  0  0  0  0
  6  7  4  0  0  0  0
  5 10  1  0  0  0  0
 11 12  1  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  1   5   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI17644

>  <IDNUMBER>
BAS 00297571

>  <Activity>
0
$$$$
ASI14635
  Marvin  04201015132D          

 29 33  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  2  5  4  0  0  0  0
  3  6  4  0  0  0  0
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  3  8  1  0  0  0  0
  1  9  4  0  0  0  0
  9 10  4  0  0  0  0
  4 11  1  0  0  0  0
 11 12  3  0  0  0  0
 13 18  1  0  0  0  0
  8 14  1  0  0  0  0
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 13 16  1  0  0  0  0
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 15 18  1  0  0  0  0
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 16 20  1  0  0  0  0
  9 21  4  0  0  0  0
 10 22  4  0  0  0  0
 20 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
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 28 29  4  0  0  0  0
  5 10  4  0  0  0  0
  4  7  4  0  0  0  0
 22 26  4  0  0  0  0
 13 17  1  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI14635

>  <IDNUMBER>
BAS 00280565

>  <Activity>
0
$$$$
ASI6545
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.4572   -0.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2792    0.6016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  2  0  0  0  0
  7  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  6 11  1  0  0  0  0
  8 12  4  0  0  0  0
  6 13  1  0  0  0  0
  8 14  4  0  0  0  0
 12 15  1  0  0  0  0
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 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
 13 19  1  0  0  0  0
 17 20  1  0  0  0  0
 14 21  4  0  0  0  0
 20 22  1  0  0  0  0
 21 23  4  0  0  0  0
  3  6  1  0  0  0  0
 16 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI6545

>  <IDNUMBER>
BAS 00138213

>  <Activity>
0
$$$$
ASI16598
  Marvin  04201015132D          

 34 38  0  0  0  0            999 V2000
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 22 29  1  0  0  0  0
 23 30  1  0  0  0  0
 24 31  1  0  0  0  0
 25 32  1  0  0  0  0
 20 33  1  0  0  0  0
 21 34  1  0  0  0  0
 20 31  1  0  0  0  0
  3  9  4  0  0  0  0
  4  8  4  0  0  0  0
 11 27  4  0  0  0  0
 21 29  1  0  0  0  0
M  CHG  2  20   1  21   1
M  END
>  <NAME>
ASI16598

>  <IDNUMBER>
BAS 00291876

>  <Activity>
0
$$$$
ASI25617
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.9271   -0.8086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9271    0.0593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6392   -2.0547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0027    2.2550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  2  9  4  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 13 19  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 13 18  1  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   8
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI25617

>  <IDNUMBER>
BAS 00363907

>  <Activity>
0
$$$$
ASI19869
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
   -0.7057   -0.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0208   -0.8561    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4217   -0.8561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1170   -0.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5387   -2.0911    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  5  6  4  0  0  0  0
  2  6  4  0  0  0  0
  1  7  1  0  0  0  0
  4  8  4  0  0  0  0
  3  9  4  0  0  0  0
 10 11  4  0  0  0  0
  9 11  4  0  0  0  0
 12 17  1  0  0  0  0
 10 13  1  0  0  0  0
  7 14  1  0  0  0  0
  6 15  1  0  0  0  0
 16 20  1  0  0  0  0
 16 17  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
  4  5  4  0  0  0  0
  8 10  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI19869

>  <IDNUMBER>
BAS 00318982

>  <Activity>
0
$$$$
ASI6084
  Marvin  04201015132D          

 20 21  0  0  1  0            999 V2000
    1.2462    0.6175    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1823    0.6175    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8965    0.1935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1674   -1.0788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6108    0.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5 15  1  0  0  0  0
  3  6  4  0  0  0  0
  7 12  1  0  0  0  0
  7  8  2  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
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  6 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  3 17  4  0  0  0  0
  6 18  4  0  0  0  0
 19 20  4  0  0  0  0
 17 20  4  0  0  0  0
  5 16  1  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI6084

>  <IDNUMBER>
BAS 00134198

>  <Activity>
0
$$$$
ASI4893
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.3023    0.4043    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1687    1.0758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
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  5  8  4  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  4 11  4  0  0  0  0
 12 18  1  0  0  0  0
 11 13  4  0  0  0  0
  8 14  4  0  0  0  0
 13 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
  4  5  4  0  0  0  0
 13 14  4  0  0  0  0
 12 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI4893

>  <IDNUMBER>
BAS 00125392

>  <Activity>
0
$$$$
ASI22486
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    0.4635    0.6071    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.9593    0.6071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  9 13  4  0  0  0  0
  3 10  1  0  0  0  0
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 13 15  4  0  0  0  0
 11 14  1  0  0  0  0
 10 15  1  0  0  0  0
 16 18  4  0  0  0  0
  1 17  1  0  0  0  0
 15 18  4  0  0  0  0
  1 19  1  0  0  0  0
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 12 23  1  0  0  0  0
 21 24  1  0  0  0  0
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 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 17 28  1  0  0  0  0
  2  4  4  0  0  0  0
  6  8  4  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22486

>  <IDNUMBER>
BAS 00334917

>  <Activity>
0
$$$$
ASI18465
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
    0.6300   -0.1855    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
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  1  6  1  0  0  0  0
  2  7  4  0  0  0  0
  8 12  1  0  0  0  0
  3  9  4  0  0  0  0
  6 10  1  0  0  0  0
 11 21  1  0  0  0  0
 10 12  1  0  0  0  0
 13 14  4  0  0  0  0
  7 14  4  0  0  0  0
 13 15  1  0  0  0  0
 10 16  1  0  0  0  0
  4 17  4  0  0  0  0
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 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 18 23  4  0  0  0  0
 17 24  4  0  0  0  0
  3  5  4  0  0  0  0
 23 24  4  0  0  0  0
  9 13  4  0  0  0  0
 11 22  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI18465

>  <IDNUMBER>
BAS 00313393

>  <Activity>
0
$$$$
ASI11488
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    0.7156   -0.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5441   -0.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
  2 12  1  0  0  0  0
  4 13  4  0  0  0  0
  5 14  1  0  0  0  0
  7 15  4  0  0  0  0
 11 16  1  0  0  0  0
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 14 18  1  0  0  0  0
 13 19  4  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  4  0  0  0  0
  3  7  4  0  0  0  0
 15 22  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI11488

>  <IDNUMBER>
BAS 00232186

>  <Activity>
0
$$$$
ASI5498
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
    1.0441    0.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1213    1.9743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2023   -0.2023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  2  0  0  0  0
 11 15  1  0  0  0  0
  7 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
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 16 17  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 16 19  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
 23 24  4  0  0  0  0
  4  5  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI5498

>  <IDNUMBER>
BAS 00128149

>  <Activity>
0
$$$$
ASI6093
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
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  1  4  1  0  0  0  0
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 13 17  1  0  0  0  0
  2 14  4  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  4  0  0  0  0
 16 19  1  0  0  0  0
 15 20  4  0  0  0  0
 14 21  4  0  0  0  0
 17 22  1  0  0  0  0
  6 23  1  0  0  0  0
  6 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
  7 11  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 18 21  4  0  0  0  0
 25 27  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI6093

>  <IDNUMBER>
BAS 00134217

>  <Activity>
0
$$$$
ASI3318
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
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 14 19  4  0  0  0  0
 14 15  1  0  0  0  0
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 18 25  4  0  0  0  0
 19 26  4  0  0  0  0
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 22 24  4  0  0  0  0
 17 23  4  0  0  0  0
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 21 25  4  0  0  0  0
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 22 27  1  0  0  0  0
 15 28  1  0  0  0  0
 15 29  1  0  0  0  0
  4  5  1  0  0  0  0
 22 23  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3318

>  <IDNUMBER>
BAS 00105077

>  <Activity>
0
$$$$
ASI21239
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
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  7 12  1  0  0  0  0
 12 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  8 16  4  0  0  0  0
  9 17  4  0  0  0  0
 13 18  1  0  0  0  0
 13 19  1  0  0  0  0
 15 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 20 24  1  0  0  0  0
  9 10  1  0  0  0  0
  4  7  4  0  0  0  0
 21 24  1  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1  13   1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI21239

>  <IDNUMBER>
BAS 00327492

>  <Activity>
0
$$$$
ASI1190
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
   -1.9880    2.0592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7148    0.8159    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.7148    1.6317    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2612    0.8159    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2612    1.6317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5522    2.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1318    1.6282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8159    0.4453    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880    2.9143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1318    0.8408    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8444    2.0378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880   -0.4204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8159   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5106   -0.7624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9286   -1.5641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6482   -1.9595    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2683   -0.8301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9215   -0.7518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2124   -1.9809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2018   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5106   -1.5712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5522   -0.4204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2683   -1.6638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1924   -0.8194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5415   -2.1020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1924   -1.6567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 11  1  0  0  0  0
  1 10  2  0  0  0  0
  8 11  1  0  0  0  0
  8 12  2  0  0  0  0
  6 13  1  0  0  0  0
  9 14  2  0  0  0  0
 14 15  1  0  0  0  0
 16 20  4  0  0  0  0
 16 17  1  0  0  0  0
 13 18  1  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 15 21  4  0  0  0  0
 15 22  4  0  0  0  0
 18 23  4  0  0  0  0
 18 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
  4  6  1  0  0  0  0
 26 27  4  0  0  0  0
 16 19  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI1190

>  <IDNUMBER>
BAS 00067837

>  <Activity>
0
$$$$
ASI29701
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.4341   -0.3706    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1152    0.1102    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2237    0.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0417   -0.1068    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6260    0.4808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8865   -0.1803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4274    0.2604    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0334    0.8948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8581    0.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5041    0.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2854    0.0534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6444   -0.5409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0116    0.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0233   -0.9983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7980   -1.2821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4290   -0.7613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9299    0.5910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4523   -0.7613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8029    0.6210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0300   -0.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  2  6  1  0  0  0  0
  5  7  1  0  0  0  0
  3  8  1  0  0  0  0
  2  9  1  0  0  0  0
  6 10  4  0  0  0  0
 10 11  4  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  6 14  4  0  0  0  0
 14 15  4  0  0  0  0
 15 16  4  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  0  0  0  0
  8  9  1  0  0  0  0
 11 16  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  2   1   1   4   1
M  END
>  <NAME>
ASI29701

>  <IDNUMBER>
BAS 00392159

>  <Activity>
0
$$$$
ASI729
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.2111    0.2922    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5058    0.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6548   -0.5426    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.9306    0.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5058    1.5296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2202    0.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6548    0.2897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2111    1.9470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9379    1.5296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2276    1.9495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3743   -0.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9403   -0.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2202   -0.5328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9347    0.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3816   -1.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9403   -1.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542    0.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9347   -0.9453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6566   -0.5328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6548   -2.1925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  7  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  2  6  1  0  0  0  0
  4  7  1  0  0  0  0
  8  9  4  0  0  0  0
  4  9  4  0  0  0  0
  5 10  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  6 13  4  0  0  0  0
  6 14  4  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 14 17  4  0  0  0  0
 13 18  4  0  0  0  0
 17 19  4  0  0  0  0
 16 20  1  0  0  0  0
  5  8  4  0  0  0  0
 18 19  4  0  0  0  0
 15 20  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI729

>  <IDNUMBER>
BAS 00030012

>  <Activity>
0
$$$$
ASI26548
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    0.8928    0.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4604    1.1511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9021   -1.0055    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4886   -0.2913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3477    1.1511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7290    0.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7518    1.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7800    0.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8692    1.8747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9922    1.1511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5881    0.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5881    1.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8097    1.1511    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2185    0.4511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7290   -1.0055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5122   -1.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1332   -0.2913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1332    1.1511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8097   -0.2631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2185   -0.9679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1425   -1.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9115   -2.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8097   -1.6680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0220   -0.9820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9412    1.1511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9694   -0.2913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3500    0.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7337   -2.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  5  8  4  0  0  0  0
  2  9  1  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
  7 12  4  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  6 17  4  0  0  0  0
  6 18  4  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
 18 25  4  0  0  0  0
 17 26  4  0  0  0  0
 25 27  4  0  0  0  0
 21 28  1  0  0  0  0
 10 12  4  0  0  0  0
 26 27  4  0  0  0  0
 22 28  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26548

>  <IDNUMBER>
BAS 00367507

>  <Activity>
0
$$$$
ASI28780
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.0140    0.4564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7804    0.2299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6131   -0.0801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1951    1.2716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9476   -0.5853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4421   -0.5400    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7870   -0.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4074    0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3484   -1.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7419   -0.8187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1670    0.5191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2992   -1.3587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9091   -1.6269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3134   -2.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
  7  9  1  0  0  0  0
  3 10  1  0  0  0  0
  5 11  4  0  0  0  0
  5 12  4  0  0  0  0
  6 13  4  0  0  0  0
  6 14  4  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
 10 17  1  0  0  0  0
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 11 21  4  0  0  0  0
 20 22  4  0  0  0  0
 18 23  4  0  0  0  0
 21 23  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI28780

>  <IDNUMBER>
BAS 00386092

>  <Activity>
0
$$$$
ASI2806
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
    0.9460   -0.4580    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3990    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1593   -0.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9460    0.8762    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9916   -0.6074    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1593    0.6174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5577   -0.6074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2746   -0.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5577    1.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7085   -1.0107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5883   -1.3493    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3997    0.1096    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2746    0.6174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2048   -1.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2048    1.6630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2354    0.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0214   -1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0214    1.8422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  5  8  1  0  0  0  0
  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
  7  8  4  0  0  0  0
  6  9  4  0  0  0  0
  5 10  2  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  8 13  4  0  0  0  0
  1 14  1  0  0  0  0
  4 15  1  0  0  0  0
  2 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
  4  6  4  0  0  0  0
  9 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2806

>  <IDNUMBER>
BAS 00100035

>  <Activity>
0
$$$$
ASI15057
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.8859    0.2261    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4175    0.2261    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8335   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5498    0.2261    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6533   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0742    0.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3100    0.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0773    0.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6421   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1858    0.9409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1858   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.3777    0.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7856   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8971   -1.2277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3171   -0.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 12  1  0  0  0  0
  2  3  2  0  0  0  0
  4 14  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  5  9  4  0  0  0  0
  6 10  4  0  0  0  0
  6 11  4  0  0  0  0
 12 16  4  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  4  0  0  0  0
 10 16  4  0  0  0  0
  9 17  1  0  0  0  0
  4 18  1  0  0  0  0
  5 19  4  0  0  0  0
  9 20  4  0  0  0  0
 18 21  1  0  0  0  0
 19 22  4  0  0  0  0
 22 23  4  0  0  0  0
  4 13  1  0  0  0  0
 12 15  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI15057

>  <IDNUMBER>
BAS 00283391

>  <Activity>
0
$$$$
ASI17589
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
    2.0206   -0.1433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5921   -0.1433    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0206    0.6461    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2946   -0.5169    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8271   -0.1433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6996   -0.5169    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2696   -0.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5436   -0.5522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0870   -0.5169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2696    0.6461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8271    0.6790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5436    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9910   -0.5733    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.0097    1.0620    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4021    0.6461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4021   -0.1433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0870   -1.3416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  5  9  1  0  0  0  0
  1  6  1  0  0  0  0
  7  8  4  0  0  0  0
  5  8  4  0  0  0  0
  2  9  2  0  0  0  0
 10 12  4  0  0  0  0
  5 11  4  0  0  0  0
 11 12  4  0  0  0  0
  7 13  1  0  0  0  0
 10 14  1  0  0  0  0
  3 15  1  0  0  0  0
  6 16  1  0  0  0  0
  9 17  1  0  0  0  0
 15 16  1  0  0  0  0
  7 10  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI17589

>  <IDNUMBER>
BAS 00297131

>  <Activity>
0
$$$$
ASI21232
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
   -0.3222    0.1547    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0440    0.5886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0440    1.4135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4253    1.9677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7529    1.8259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7733    2.7196    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5810    2.6294    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3781   -0.2578    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5435    1.8045    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7529    0.1761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7561   -0.5671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0902    0.8765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8217    1.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0999   -2.3329    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3781   -1.0956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4876    0.5886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4747    1.4135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0999   -1.5080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8249   -3.6390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6369   -3.5574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  4  0  0  0  0
  3  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  5  7  4  0  0  0  0
  1  8  1  0  0  0  0
  9 13  3  0  0  0  0
  2 10  4  0  0  0  0
  1 11  2  0  0  0  0
  1 12  2  0  0  0  0
 13 19  1  0  0  0  0
 14 18  1  0  0  0  0
  8 15  1  0  0  0  0
 10 16  4  0  0  0  0
 16 17  4  0  0  0  0
 15 18  1  0  0  0  0
 19 20  1  0  0  0  0
  8 20  1  0  0  0  0
 14 21  1  0  0  0  0
 14 22  1  0  0  0  0
 22 23  1  0  0  0  0
 21 24  1  0  0  0  0
  5 17  4  0  0  0  0
  6  7  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI21232

>  <IDNUMBER>
BAS 00327477

>  <Activity>
0
$$$$
ASI24217
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
   -1.7626    1.0081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8099   -0.2830    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8511    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5173    1.3441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1025    0.1415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0833    0.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6706    0.0294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0494    1.4149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3124    0.9491    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5468   -0.6897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2344    0.4421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4149   -0.9904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3950   -0.2830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1025    0.9491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6529    2.1871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2380   -0.3243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5 13  1  0  0  0  0
  4  6  1  0  0  0  0
  3  7  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  2  0  0  0  0
  2 12  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
  4 15  2  0  0  0  0
  3 16  2  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 10 19  4  0  0  0  0
 10 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 22 23  4  0  0  0  0
  6 24  4  0  0  0  0
  7 25  4  0  0  0  0
 23 26  1  0  0  0  0
 24 27  4  0  0  0  0
 25 28  4  0  0  0  0
  6  7  4  0  0  0  0
  5 14  1  0  0  0  0
 27 28  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24217

>  <IDNUMBER>
BAS 00344556

>  <Activity>
0
$$$$
ASI42
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.2992   -1.1615    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.7860   -0.4811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2992    0.1701    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4811   -0.9034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4811   -0.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1967   -1.3199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1967    0.3284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5631    0.9503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5691   -1.9651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9006   -0.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6190   -0.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9006   -0.0939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6690   -1.2906    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    1.3726    1.1204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3843   -2.1353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6014    1.9182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2464    2.3405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0559    2.5106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  4  6  4  0  0  0  0
  5  7  4  0  0  0  0
  3  8  1  0  0  0  0
  1  9  1  0  0  0  0
  6 10  4  0  0  0  0
  2 11  1  0  0  0  0
 10 12  4  0  0  0  0
 10 13  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
  9 16  1  0  0  0  0
 15 17  4  0  0  0  0
 14 18  4  0  0  0  0
 18 19  4  0  0  0  0
  3  5  4  0  0  0  0
  7 12  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI42

>  <IDNUMBER>
BAS 00004233

>  <Activity>
0
$$$$
ASI24397
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
   -0.8080   -0.0758    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8080    0.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0189   -0.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0189    1.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4552    0.3453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5137   -0.4742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2860    0.3642    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4757    1.2557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2542   -1.1267    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5137   -1.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
 10 18  4  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
 15 16  4  0  0  0  0
 12 16  4  0  0  0  0
 11 17  4  0  0  0  0
 13 18  4  0  0  0  0
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 10 20  4  0  0  0  0
 13 21  4  0  0  0  0
 19 22  1  0  0  0  0
 21 23  4  0  0  0  0
  4  5  1  0  0  0  0
 15 17  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24397

>  <IDNUMBER>
BAS 00345405

>  <Activity>
0
$$$$
ASI25550
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.5978   -0.3360    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.5483    0.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3959    0.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3959    0.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  6 16  1  0  0  0  0
  4  7  4  0  0  0  0
  4  8  4  0  0  0  0
  9 10  4  0  0  0  0
  8 10  4  0  0  0  0
  7 11  4  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  9 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
  6 17  1  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI25550

>  <IDNUMBER>
BAS 00363522

>  <Activity>
0
$$$$
ligand_xray
  Marvin  04201014582D          

 26 27  0  0  0  0            999 V2000
    2.9975   29.4769    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7120   29.8894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4264   29.4769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1409   29.8894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8554   29.4769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2843   29.4769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9988   29.8894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7133   29.4769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4277   29.8894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1422   29.4769    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   10.8239   29.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6122   29.6985    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6739   30.5212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9922   30.9859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0539   31.8086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3722   32.2734    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7972   32.1666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4788   31.7018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4172   30.8791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4280   29.8215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9424   29.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9136   28.9305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5011   28.2161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6853   28.0931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 26  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  6  0  0  0
 13 21  1  1  0  0  0
 13 23  1  0  0  0  0
 14 15  4  0  0  0  0
 14 20  4  0  0  0  0
 15 16  4  0  0  0  0
 16 17  1  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
 19 20  4  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <Activity>
1

>  <PDB_ID>
ligand_xray

$$$$
ASI11229
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -0.3294    1.0957    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9079   -1.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4981   -0.3409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7163   -1.0535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4981   -1.7546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4981    1.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9079    0.3754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7317    3.2104    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3294    3.9306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3 10  4  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
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  1  7  4  0  0  0  0
  1  8  1  0  0  0  0
  7  9  4  0  0  0  0
  6 10  4  0  0  0  0
 11 12  1  0  0  0  0
  8 12  1  0  0  0  0
  5 13  4  0  0  0  0
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 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 14 17  4  0  0  0  0
 13 18  4  0  0  0  0
 17 19  4  0  0  0  0
  3  9  4  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI11229

>  <IDNUMBER>
BAS 00229869

>  <Activity>
0
$$$$
ASI10203
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.8334    0.6282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3686    1.2899    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.0679   -0.2387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.1042    1.0679    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.9191   -1.5328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10 16  4  0  0  0  0
 10 11  1  0  0  0  0
 12 19  4  0  0  0  0
  7 13  4  0  0  0  0
  7 14  4  0  0  0  0
 15 18  4  0  0  0  0
 16 17  4  0  0  0  0
  9 17  4  0  0  0  0
  9 18  4  0  0  0  0
 14 19  4  0  0  0  0
 13 20  4  0  0  0  0
 12 21  1  0  0  0  0
  5  6  1  0  0  0  0
 12 20  4  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10203

>  <IDNUMBER>
BAS 00218476

>  <Activity>
0
$$$$
ASI18154
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
   -0.9296   -0.1658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1335    0.3996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7125    1.0411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4896    1.1498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  4  7  1  0  0  0  0
  3  8  4  0  0  0  0
  6  9  4  0  0  0  0
  2 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 13  4  0  0  0  0
 11 14  4  0  0  0  0
  5 15  1  0  0  0  0
 16 17  4  0  0  0  0
 14 17  4  0  0  0  0
 13 18  4  0  0  0  0
 16 19  1  0  0  0  0
  8 20  1  0  0  0  0
 10 21  4  0  0  0  0
 10 22  4  0  0  0  0
 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
 24 25  4  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 23 25  4  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI18154

>  <IDNUMBER>
BAS 00312141

>  <Activity>
0
$$$$
ASI30412
  Marvin  04201015132D          

 28 31  0  0  1  0            999 V2000
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   -1.8408   -0.6438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9010    1.0015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1714    2.2414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9010    1.8265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  7  1  0  0  0  0
  2  4  4  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  2  8  4  0  0  0  0
  6  9  1  0  0  0  0
  6 10  2  0  0  0  0
  4 11  4  0  0  0  0
  9 12  1  0  0  0  0
  8 13  4  0  0  0  0
 13 14  4  0  0  0  0
 15 19  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
  5 18  4  0  0  0  0
 12 19  1  0  0  0  0
  7 20  4  0  0  0  0
 17 21  4  0  0  0  0
 17 22  4  0  0  0  0
 19 23  1  0  0  0  0
 18 24  4  0  0  0  0
 24 25  4  0  0  0  0
 21 26  4  0  0  0  0
 22 27  4  0  0  0  0
 27 28  4  0  0  0  0
  3  4  1  0  0  0  0
 20 25  4  0  0  0  0
 11 14  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI30412

>  <IDNUMBER>
BAS 00394618

>  <Activity>
0
$$$$
ASI19877
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    2.8422   -0.0965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3549   -0.7765    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7356    0.3197    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.5989    0.7309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.0857    0.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1516    0.3197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4462   -0.9237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1516   -0.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  8 13  1  0  0  0  0
  5  9  4  0  0  0  0
  7 10  4  0  0  0  0
  9 11  4  0  0  0  0
 10 12  1  0  0  0  0
 13 14  1  0  0  0  0
 12 14  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
  4  5  4  0  0  0  0
 10 11  4  0  0  0  0
 19 21  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI19877

>  <IDNUMBER>
BAS 00318994

>  <Activity>
0
$$$$
ASI2807
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.1017   -0.4679    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5847    0.2113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3320   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8161   -0.6137    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.3320    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3673   -0.6137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3673    1.0263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4086   -1.3583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5406   -1.0263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2336    0.1107    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0917    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3683   -1.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3683    1.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4097    0.2113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0486    0.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1682   -1.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1682    1.8262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  5  8  1  0  0  0  0
  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
  7  8  4  0  0  0  0
  6  9  4  0  0  0  0
  5 10  2  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  8 13  4  0  0  0  0
  1 14  1  0  0  0  0
  4 15  1  0  0  0  0
  2 16  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  4  6  4  0  0  0  0
  9 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2807

>  <IDNUMBER>
BAS 00100037

>  <Activity>
0
$$$$
ASI21819
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.6956    1.8392    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9482    1.0578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2811    0.5527    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1334    1.8392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4050    1.0387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7248    0.8291    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1816    0.7814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6052    2.5253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2775   -1.1006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1203   -0.2907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6968   -0.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5  7  2  0  0  0  0
  4  8  2  0  0  0  0
  9 13  4  0  0  0  0
  9 10  1  0  0  0  0
  7 11  1  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
  3  5  1  0  0  0  0
 21 22  1  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI21819

>  <IDNUMBER>
BAS 00331501

>  <Activity>
0
$$$$
ASI27392
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    1.5327   -0.8057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0557   -0.1396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2618   -1.2128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4479    0.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3558   -0.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1605   -0.3868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4479   -1.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8759    0.8521    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8759    0.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7630   -1.5356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7630    1.3262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  3  6  4  0  0  0  0
  1  7  1  0  0  0  0
  6  8  4  0  0  0  0
  5  9  4  0  0  0  0
 10 11  1  0  0  0  0
  8 11  1  0  0  0  0
  7 12  2  0  0  0  0
  9 13  4  0  0  0  0
 10 14  1  0  0  0  0
  6 15  1  0  0  0  0
  2 16  1  0  0  0  0
  7 17  1  0  0  0  0
 14 18  1  0  0  0  0
 14 19  1  0  0  0  0
 14 20  1  0  0  0  0
 17 21  1  0  0  0  0
 21 22  1  0  0  0  0
  3  5  4  0  0  0  0
  8 13  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI27392

>  <IDNUMBER>
BAS 00379885

>  <Activity>
0
$$$$
ASI5706
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.6694   -0.1700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7544    0.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4238   -0.5100    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5513    0.8181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9621    0.1027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1239    1.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0779   -1.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7863   -1.8169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2939    2.0081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6339   -1.8311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6411    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9763    1.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7944    0.1027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2100   -1.8169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7944    1.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0223    1.1758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  9 10  1  0  0  0  0
  8 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  2  0  0  0  0
 13 19  1  0  0  0  0
  7 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 14 21  1  0  0  0  0
 15 22  1  0  0  0  0
 16 23  1  0  0  0  0
 21 24  1  0  0  0  0
  4  5  4  0  0  0  0
 22 23  1  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI5706

>  <IDNUMBER>
BAS 00131669

>  <Activity>
0
$$$$
ASI33405
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.5832   -0.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1329    1.1369    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5832    0.7161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1329   -0.5205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8489    0.7309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8489   -0.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067   -1.3769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067   -0.5353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1329   -1.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5832   -1.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0006   -1.8050    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6946   -2.2479    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    1.3067    1.1590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5577    1.1812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6017   -2.5912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1329    1.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5762   -0.5205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8489   -1.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5577    3.6137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  7  8  4  0  0  0  0
  1  8  4  0  0  0  0
  4  9  4  0  0  0  0
  7 10  4  0  0  0  0
  7 11  2  0  0  0  0
 11 12  2  0  0  0  0
  3 13  1  0  0  0  0
  5 14  2  0  0  0  0
 10 15  1  0  0  0  0
  2 16  1  0  0  0  0
  6 17  4  0  0  0  0
  9 18  4  0  0  0  0
 18 19  4  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  5  6  4  0  0  0  0
  9 10  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  2  11   1  12  -1
M  END
>  <NAME>
ASI33405

>  <IDNUMBER>
BAS 00411577

>  <Activity>
0
$$$$
ASI646
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
    0.2574    0.9532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4986    0.1972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8108    1.5613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2875    0.0055    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5997    1.4025    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1863   -0.2794    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8437    0.2192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5533    0.9532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8627    0.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6655    0.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0792    1.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5697    2.3502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1585    0.7231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8956    1.4518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9777   -0.6738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0763    2.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0021    0.6410    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2928   -2.7556    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6241    0.2685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4736   -1.3312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7969   -2.0982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6051   -3.5171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4821   -2.6460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8871    2.1366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3308    0.6903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1067   -4.1745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1370   -1.8845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4405    1.5120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  2  6  4  0  0  0  0
  7  8  4  0  0  0  0
  1  8  4  0  0  0  0
  5  9  4  0  0  0  0
  7 10  4  0  0  0  0
  8 11  4  0  0  0  0
  3 12  1  0  0  0  0
 13 14  4  0  0  0  0
 11 14  4  0  0  0  0
 10 15  1  0  0  0  0
  5 16  1  0  0  0  0
 13 17  1  0  0  0  0
 18 21  1  0  0  0  0
  9 19  1  0  0  0  0
 15 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 22  1  0  0  0  0
 18 23  1  0  0  0  0
 16 24  1  0  0  0  0
 19 25  1  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 24 28  1  0  0  0  0
  6  7  4  0  0  0  0
  4  9  4  0  0  0  0
 10 13  4  0  0  0  0
 25 28  1  0  0  0  0
M  CHG  1  18   1
M  END
>  <NAME>
ASI646

>  <IDNUMBER>
BAS 00024577

>  <Activity>
0
$$$$
ASI1713
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
    0.0130    0.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7146   -0.2144    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7146   -1.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7178   -0.2144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0130    1.0329    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.4454    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7178   -1.0232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4324   -1.4454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4389    0.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0130    2.6862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7308    1.4389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7016    1.4389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7016    2.2672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7438    2.2672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1340   -1.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4324   -2.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4389    1.0491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1535   -0.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8713    0.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1535    1.4584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8486   -1.4454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1340   -2.6927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8713    1.0329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8486   -2.2835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
 10 13  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
 11 14  1  0  0  0  0
  8 15  4  0  0  0  0
  8 16  4  0  0  0  0
  9 17  4  0  0  0  0
  9 18  4  0  0  0  0
 18 19  4  0  0  0  0
 17 20  4  0  0  0  0
 15 21  4  0  0  0  0
 16 22  4  0  0  0  0
 20 23  4  0  0  0  0
 22 24  4  0  0  0  0
 10 14  1  0  0  0  0
 19 23  4  0  0  0  0
 21 24  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI1713

>  <IDNUMBER>
BAS 00084288

>  <Activity>
0
$$$$
ASI22255
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
    0.4210   -1.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5979   -1.8538    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0225    0.6298    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4080   -1.9246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2901   -0.6332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7336    1.8928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7123    2.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0225    1.4717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2901    0.2052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1392   -0.6332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7476   -1.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8185   -2.6640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0083   -1.0437    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4269    3.1345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9870    3.1097    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7336    0.2158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4659    1.4717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4281   -0.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4659    0.6298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5578   -1.0331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0921   -1.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9022   -1.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  6  8  4  0  0  0  0
  6  7  1  0  0  0  0
  3  8  4  0  0  0  0
  5  9  1  0  0  0  0
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 12  2  0  0  0  0
  5 13  2  0  0  0  0
  7 14  2  0  0  0  0
  7 15  1  0  0  0  0
  3 16  4  0  0  0  0
 17 19  4  0  0  0  0
  1 18  1  0  0  0  0
 16 19  4  0  0  0  0
 11 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  4 11  1  0  0  0  0
  6 17  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI22255

>  <IDNUMBER>
BAS 00333766

>  <Activity>
0
$$$$
ASI30183
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
    0.9026   -0.7294    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.6668   -0.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6668    0.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0315    0.5060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0937    0.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3734   -0.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5288   -0.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9511   -0.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2445   -0.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9511    0.9254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6184   -0.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3158    0.9117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2445    0.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3158   -0.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7381    0.9117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5288   -1.5500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.8140    0.9254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8140   -0.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6184   -1.9603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3158   -1.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4538    0.5060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7381    1.7323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5342    0.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5342   -0.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1605    0.9117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4538    2.1471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1605    1.7323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 10  4  0  0  0  0
  3 13  4  0  0  0  0
  4  7  1  0  0  0  0
  3  5  1  0  0  0  0
  6  8  1  0  0  0  0
  7 17  1  0  0  0  0
  2  8  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  4  0  0  0  0
  9 11  1  0  0  0  0
  1 12  1  0  0  0  0
 13 16  4  0  0  0  0
  1 14  4  0  0  0  0
  4 15  2  0  0  0  0
 11 16  4  0  0  0  0
 14 17  4  0  0  0  0
  4 18  1  0  0  0  0
  9 19  2  0  0  0  0
  1 20  4  0  0  0  0
  5 21  4  0  0  0  0
  6 22  4  0  0  0  0
 20 23  4  0  0  0  0
 23 24  4  0  0  0  0
 18 25  4  0  0  0  0
 18 26  4  0  0  0  0
 21 27  4  0  0  0  0
 22 28  4  0  0  0  0
 25 29  4  0  0  0  0
 26 30  4  0  0  0  0
 30 31  4  0  0  0  0
 17 24  4  0  0  0  0
  2  3  4  0  0  0  0
  5  6  4  0  0  0  0
 29 31  4  0  0  0  0
 27 28  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30183

>  <IDNUMBER>
BAS 00393773

>  <Activity>
0
$$$$
ASI30172
  Marvin  04201015132D          

 33 36  0  0  0  0            999 V2000
    1.2788   -1.0084    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.4238    0.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7263    0.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0204    0.6416    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4 12  1  0  0  0  0
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  6  7  1  0  0  0  0
  1  7  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  4  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
  9 12  4  0  0  0  0
  3 13  1  0  0  0  0
  2 14  1  0  0  0  0
  6 15  2  0  0  0  0
 16 20  4  0  0  0  0
  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
  1 19  4  0  0  0  0
 17 20  4  0  0  0  0
 18 21  4  0  0  0  0
 19 22  4  0  0  0  0
 22 23  4  0  0  0  0
 14 24  4  0  0  0  0
 14 25  4  0  0  0  0
 13 26  4  0  0  0  0
 13 27  4  0  0  0  0
 25 28  4  0  0  0  0
 24 29  4  0  0  0  0
 26 30  4  0  0  0  0
 27 31  4  0  0  0  0
 29 32  4  0  0  0  0
 31 33  4  0  0  0  0
 12 23  4  0  0  0  0
 16 21  4  0  0  0  0
 28 32  4  0  0  0  0
 30 33  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30172

>  <IDNUMBER>
BAS 00393755

>  <Activity>
0
$$$$
ASI15365
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.9992    1.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2668    1.4048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3158    0.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9038    0.2233    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.2341   -0.6779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7287    1.4565    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2188   -1.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1325    0.9093    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4075   -1.5273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  3  6  2  0  0  0  0
  1  7  2  0  0  0  0
  8 11  4  0  0  0  0
  6  9  1  0  0  0  0
  4 10  2  0  0  0  0
  9 11  4  0  0  0  0
 12 13  4  0  0  0  0
 13 15  4  0  0  0  0
  7 14  1  0  0  0  0
  9 15  4  0  0  0  0
  8 16  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  4  0  0  0  0
 14 19  4  0  0  0  0
 17 20  1  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
  3  4  1  0  0  0  0
 21 23  4  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI15365

>  <IDNUMBER>
BAS 00285503

>  <Activity>
0
$$$$
ASI24216
  Marvin  04201015132D          

 27 29  0  0  0  0            999 V2000
    1.6031   -0.1615    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9033    0.2512    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9979    1.1126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2909   -0.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5323    1.0827    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.9979    0.2871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0338    0.5383    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1724   -0.8553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1855   -0.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9033    1.0827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2501    1.5432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7157   -0.1196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4335    0.2871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4335    1.1126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5323    0.2512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7157    2.3687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4214   -1.3398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0158   -1.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4025   -1.9021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3 11  1  0  0  0  0
  1  4  1  0  0  0  0
  5 17  1  0  0  0  0
  3  6  4  0  0  0  0
  1  7  2  0  0  0  0
  1  8  2  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  4  0  0  0  0
  3 13  4  0  0  0  0
 14 15  4  0  0  0  0
 13 15  4  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
  4 18  4  0  0  0  0
  4 19  4  0  0  0  0
 12 20  1  0  0  0  0
 18 21  4  0  0  0  0
 19 22  4  0  0  0  0
 22 23  4  0  0  0  0
 13 24  1  0  0  0  0
 20 25  1  0  0  0  0
 20 26  1  0  0  0  0
 23 27  1  0  0  0  0
  5 16  1  0  0  0  0
 21 23  4  0  0  0  0
 12 14  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24216

>  <IDNUMBER>
BAS 00344553

>  <Activity>
0
$$$$
ASI24393
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
   -0.7780   -0.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7780    0.7069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.3843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.9584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4745    0.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5039   -0.5456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2952    0.2989    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5477    1.0248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4612    1.2288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2704   -1.1623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9605    0.2989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1170    1.6416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7765    0.4791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8714    1.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5039   -1.3664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2156   -0.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7270    1.0248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9415   -1.3664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6958   -1.7507    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  8 17  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  8 11  4  0  0  0  0
  8 12  4  0  0  0  0
 11 13  4  0  0  0  0
 12 14  4  0  0  0  0
  6 15  4  0  0  0  0
  6 16  4  0  0  0  0
  7 17  1  0  0  0  0
 18 20  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  1  0  0  0  0
  4  5  1  0  0  0  0
 18 19  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24393

>  <IDNUMBER>
BAS 00345399

>  <Activity>
0
$$$$
ASI11177
  Marvin  04201015132D          

 22 22  0  0  0  0            999 V2000
   -1.2034   -0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4538    0.0522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8712   -1.2103    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4104   -1.0121    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2711    0.0626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5215   -0.7269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2156   -0.4591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0016   -0.7199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2869    1.4851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0487    0.3478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3858   -0.4174    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6068   -0.1669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1356    0.6365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5371   -0.4695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.9336   -0.4278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1686    1.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  2  6  1  0  0  0  0
  3  7  4  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  6 10  2  0  0  0  0
  8 11  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  9 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 16  1  0  0  0  0
 12 17  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI11177

>  <IDNUMBER>
BAS 00229065

>  <Activity>
0
$$$$
ASI3315
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
    1.3295    1.5062    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6364    1.9199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1597    0.7319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3536    0.6470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0424    1.3931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3500   -0.7601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0530   -0.0495    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8768   -1.4638    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0790    1.8350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5516    2.7084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1703   -0.7601    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 14 15  1  0  0  0  0
 16 19  4  0  0  0  0
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 18 20  4  0  0  0  0
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 15 20  4  0  0  0  0
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 22 24  4  0  0  0  0
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 24 26  4  0  0  0  0
  4  5  1  0  0  0  0
 25 26  4  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3315

>  <IDNUMBER>
BAS 00105065

>  <Activity>
0
$$$$
ASI15070
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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 14 20  4  0  0  0  0
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 10 16  1  0  0  0  0
 17 19  4  0  0  0  0
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 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 13 21  4  0  0  0  0
 17 22  1  0  0  0  0
  6 23  1  0  0  0  0
 23 24  1  0  0  0  0
  6 15  1  0  0  0  0
 14 21  4  0  0  0  0
  7 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI15070

>  <IDNUMBER>
BAS 00283460

>  <Activity>
0
$$$$
ASI13187
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
    1.9446   -1.4202    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 11 17  1  0  0  0  0
 17 18  1  0  0  0  0
  2 15  1  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI13187

>  <IDNUMBER>
BAS 00260375

>  <Activity>
0
$$$$
ASI18297
  Marvin  04201015132D          

 30 35  0  0  0  0            999 V2000
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 10 22  4  0  0  0  0
 19 23  1  0  0  0  0
 18 24  1  0  0  0  0
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 24 28  1  0  0  0  0
 25 29  1  0  0  0  0
 29 30  1  0  0  0  0
  6 10  4  0  0  0  0
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 22 27  4  0  0  0  0
 12 16  1  0  0  0  0
 20 23  1  0  0  0  0
 28 30  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI18297

>  <IDNUMBER>
BAS 00312793

>  <Activity>
0
$$$$
ASI27137
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 13 17  1  0  0  0  0
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 19 20  4  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
  2  5  4  0  0  0  0
 15 20  4  0  0  0  0
 21 22  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI27137

>  <IDNUMBER>
BAS 00371664

>  <Activity>
0
$$$$
ASI18414
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
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  4 10  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
  6 15  1  0  0  0  0
 10 16  1  0  0  0  0
  2 17  4  0  0  0  0
  7 18  4  0  0  0  0
 16 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 24 25  4  0  0  0  0
  7  9  4  0  0  0  0
  4 13  1  0  0  0  0
 18 22  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI18414

>  <IDNUMBER>
BAS 00313307

>  <Activity>
0
$$$$
ASI23011
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.1775   -0.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5325   -0.4402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  5  6  4  0  0  0  0
  2  7  1  0  0  0  0
  1  8  1  0  0  0  0
  4  9  1  0  0  0  0
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  8 12  1  0  0  0  0
  6 13  2  0  0  0  0
 12 14  1  0  0  0  0
 15 18  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 21  1  0  0  0  0
 11 14  1  0  0  0  0
  4  6  4  0  0  0  0
 15 19  1  0  0  0  0
M  CHG  1  15   1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI23011

>  <IDNUMBER>
BAS 00338323

>  <Activity>
0
$$$$
ASI21621
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.6305    0.8301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8004    0.7528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8090    1.6305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
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  6 13  1  0  0  0  0
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 11 14  1  0  0  0  0
  5 12  1  0  0  0  0
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 15 18  4  0  0  0  0
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 17 18  4  0  0  0  0
 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
 11 21  1  0  0  0  0
 15 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  5  8  4  0  0  0  0
 10 15  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI21621

>  <IDNUMBER>
BAS 00330052

>  <Activity>
0
$$$$
ASI2809
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.3080   -0.5886    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6048   -0.7344    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  9  1  0  0  0  0
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  1 14  1  0  0  0  0
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  3 16  1  0  0  0  0
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 15 19  1  0  0  0  0
  5  6  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2809

>  <IDNUMBER>
BAS 00100041

>  <Activity>
0
$$$$
ASI2808
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.1923   -0.5081    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.7256   -0.6540    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
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  1 14  1  0  0  0  0
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 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
  5  6  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2808

>  <IDNUMBER>
BAS 00100040

>  <Activity>
0
$$$$
ASI136
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -1.0135   -0.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 11 12  1  0  0  0  0
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 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 10 17  4  0  0  0  0
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 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  4  1  0  0  0  0
 19 21  4  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI136

>  <IDNUMBER>
BAS 00006053

>  <Activity>
0
$$$$
ASI1064
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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 18 24  4  0  0  0  0
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 14 20  4  0  0  0  0
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 23 25  4  0  0  0  0
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 28 29  1  0  0  0  0
  4  5  1  0  0  0  0
 19 21  4  0  0  0  0
 18 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI1064

>  <IDNUMBER>
BAS 00063128

>  <Activity>
0
$$$$
ASI10792
  Marvin  04201015132D          

 36 39  0  0  1  0            999 V2000
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 13 18  2  0  0  0  0
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  5 22  1  0  0  0  0
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 20 28  1  0  0  0  0
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 31 35  1  0  0  0  0
 34 36  1  0  0  0  0
 16 19  4  0  0  0  0
  3  5  1  0  0  0  0
 32 35  1  0  0  0  0
 33 36  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI10792

>  <IDNUMBER>
BAS 00225294

>  <Activity>
0
$$$$
ASI27132
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
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  4  7  4  0  0  0  0
  3  8  1  0  0  0  0
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  1 10  1  0  0  0  0
 11 13  1  0  0  0  0
 10 12  1  0  0  0  0
  9 13  1  0  0  0  0
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 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
  7 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  4  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  4  0  0  0  0
 20 23  4  0  0  0  0
 24 25  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27132

>  <IDNUMBER>
BAS 00371648

>  <Activity>
0
$$$$
ASI18267
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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 11 16  1  0  0  0  0
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 18 22  1  0  0  0  0
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 27 28  1  0  0  0  0
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 21 25  4  0  0  0  0
 11 17  1  0  0  0  0
 26 28  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI18267

>  <IDNUMBER>
BAS 00312717

>  <Activity>
0
$$$$
ASI18188
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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 11 18  4  0  0  0  0
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 13 21  4  0  0  0  0
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 10 16  4  0  0  0  0
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 14 18  4  0  0  0  0
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 17 20  4  0  0  0  0
 16 21  4  0  0  0  0
 13 22  1  0  0  0  0
  3  5  1  0  0  0  0
 11 19  4  0  0  0  0
 13 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18188

>  <IDNUMBER>
BAS 00312372

>  <Activity>
0
$$$$
ASI22523
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
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   -3.4485   -0.6379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.1920   -0.2207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 10  1  0  0  0  0
  3 12  1  0  0  0  0
  4 11  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  4  0  0  0  0
  4  8  1  0  0  0  0
  1  9  1  0  0  0  0
 10 15  1  0  0  0  0
 10 11  1  0  0  0  0
  9 12  1  0  0  0  0
 13 14  1  0  0  0  0
  9 14  1  0  0  0  0
 13 15  1  0  0  0  0
  6 16  4  0  0  0  0
  5 17  4  0  0  0  0
  7 18  4  0  0  0  0
  8 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
 19 23  4  0  0  0  0
  3  7  1  0  0  0  0
 18 22  4  0  0  0  0
  5  8  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI22523

>  <IDNUMBER>
BAS 00335599

>  <Activity>
0
$$$$
ASI19880
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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   -0.6494    0.3267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5166    0.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1633    1.6022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3950   -0.5911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  4  0  0  0  0
  1  4  1  0  0  0  0
  3  5  4  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  2  8  4  0  0  0  0
  5  9  4  0  0  0  0
 10 11  4  0  0  0  0
  8 11  4  0  0  0  0
  1 12  2  0  0  0  0
  1 13  2  0  0  0  0
 14 17  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  8 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 18  1  0  0  0  0
  5 10  4  0  0  0  0
  7  9  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI19880

>  <IDNUMBER>
BAS 00319001

>  <Activity>
0
$$$$
ASI63
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.0705    0.3569    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2460    1.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2632    0.2749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3516   -0.8716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3396   -3.1121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  1  0  0  0  0
  5  9  4  0  0  0  0
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  1 12  1  0  0  0  0
  4 13  1  0  0  0  0
  2 14  1  0  0  0  0
  8 15  1  0  0  0  0
 16 17  1  0  0  0  0
 12 17  1  0  0  0  0
 15 18  1  0  0  0  0
 13 19  1  0  0  0  0
 18 20  1  0  0  0  0
  4  5  4  0  0  0  0
  9 10  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI63

>  <IDNUMBER>
BAS 00004285

>  <Activity>
0
$$$$
ASI21470
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.3094    1.2047    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.3919    0.7839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3094    2.0091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0973    2.0091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3919    2.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3919   -0.0413    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8070    2.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1015    2.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8070    0.7839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3094   -1.2954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5166    2.0091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5166    1.2047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5  6  1  0  0  0  0
  4  6  1  0  0  0  0
  7 15  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  2  0  0  0  0
  7 10  1  0  0  0  0
  5 11  4  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  3 14  4  0  0  0  0
 15 17  1  0  0  0  0
  8 16  1  0  0  0  0
 17 19  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 11 20  4  0  0  0  0
 14 21  4  0  0  0  0
  3  5  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  2   1   1  10  -1
M  END
>  <NAME>
ASI21470

>  <IDNUMBER>
BAS 00329353

>  <Activity>
0
$$$$
ASI25554
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    2.0038    0.0718    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2860   -1.1904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1496   -1.1664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
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  4  8  4  0  0  0  0
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  1 14  1  0  0  0  0
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 15 16  1  0  0  0  0
 13 17  1  0  0  0  0
 12 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
  6 17  1  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI25554

>  <IDNUMBER>
BAS 00363535

>  <Activity>
0
$$$$
ASI13431
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.5292   -0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3476   -0.5332    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  6  9  1  0  0  0  0
  4 10  2  0  0  0  0
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 12 13  4  0  0  0  0
 13 15  4  0  0  0  0
  7 14  1  0  0  0  0
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 12 17  1  0  0  0  0
 14 18  4  0  0  0  0
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 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 24  4  0  0  0  0
  3  4  1  0  0  0  0
 23 24  4  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI13431

>  <IDNUMBER>
BAS 00262592

>  <Activity>
0
$$$$
ASI18183
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.5194    1.1777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3615   -1.1536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  3  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 10  4  0  0  0  0
  9 11  1  0  0  0  0
 12 16  4  0  0  0  0
 12 13  1  0  0  0  0
 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
 15 16  4  0  0  0  0
 14 17  4  0  0  0  0
  7 18  4  0  0  0  0
 10 19  1  0  0  0  0
 10 20  4  0  0  0  0
 18 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  6  1  0  0  0  0
 20 22  4  0  0  0  0
 12 17  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI18183

>  <IDNUMBER>
BAS 00312364

>  <Activity>
0
$$$$
ASI33396
  Marvin  04201015132D          

 26 30  0  0  0  0            999 V2000
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    2.4722    0.7514    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  1  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  4  0  0  0  0
  2  8  4  0  0  0  0
  1  9  1  0  0  0  0
 10 14  1  0  0  0  0
  8 11  4  0  0  0  0
  7 12  4  0  0  0  0
  9 13  1  0  0  0  0
 14 15  1  0  0  0  0
 15 17  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
  8 19  4  0  0  0  0
  7 20  4  0  0  0  0
 12 21  4  0  0  0  0
 11 22  4  0  0  0  0
 20 23  4  0  0  0  0
 19 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
  5 12  4  0  0  0  0
 14 18  1  0  0  0  0
 21 25  4  0  0  0  0
  6 11  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI33396

>  <IDNUMBER>
BAS 00411550

>  <Activity>
0
$$$$
ASI10871
  Marvin  04201015132D          

 20 21  0  0  1  0            999 V2000
    0.6469    3.4267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6516    2.5876    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0891    3.8486    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.7875   -4.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
 11 13  1  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 14 16  4  0  0  0  0
 14 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3 10  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI10871

>  <IDNUMBER>
BAS 00226355

>  <Activity>
0
$$$$
ASI13470
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
    0.0050    0.6708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7182    1.0897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0050   -0.1372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7182   -0.5561    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7182    1.0897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4414    0.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1471    1.0897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
  2 10  1  0  0  0  0
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 12 19  1  0  0  0  0
 11 13  1  0  0  0  0
  5 14  4  0  0  0  0
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  6 16  4  0  0  0  0
  9 17  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 11 21  4  0  0  0  0
 14 22  4  0  0  0  0
 15 23  4  0  0  0  0
 16 24  4  0  0  0  0
 23 25  4  0  0  0  0
  4  6  4  0  0  0  0
 21 25  4  0  0  0  0
 22 24  4  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI13470

>  <IDNUMBER>
BAS 00262674

>  <Activity>
0
$$$$
ASI459
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.2512   -1.2558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2302   -1.9204    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  7 13  1  0  0  0  0
  6  8  2  0  0  0  0
  3  9  1  0  0  0  0
 10 18  1  0  0  0  0
  6 11  1  0  0  0  0
  4 12  4  0  0  0  0
 13 14  1  0  0  0  0
 11 14  1  0  0  0  0
  5 15  4  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 12 20  4  0  0  0  0
 15 21  4  0  0  0  0
  4  5  4  0  0  0  0
 20 21  4  0  0  0  0
 10 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI459

>  <IDNUMBER>
BAS 00016261

>  <Activity>
0
$$$$
ASI11492
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.6213   -0.0679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
  8 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
 12 16  1  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 13 20  1  0  0  0  0
 20 21  1  0  0  0  0
  2  5  4  0  0  0  0
 14 16  1  0  0  0  0
 15 21  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI11492

>  <IDNUMBER>
BAS 00232226

>  <Activity>
0
$$$$
ASI27130
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.5592   -1.7532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1407   -1.7532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  5  7  4  0  0  0  0
  2  6  1  0  0  0  0
  3  7  4  0  0  0  0
  6  8  1  0  0  0  0
  9 11  1  0  0  0  0
  1 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  2  0  0  0  0
  5 13  4  0  0  0  0
  9 14  1  0  0  0  0
  9 15  1  0  0  0  0
  7 16  4  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 21 22  4  0  0  0  0
 16 22  4  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
  2  5  4  0  0  0  0
 13 21  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27130

>  <IDNUMBER>
BAS 00371643

>  <Activity>
0
$$$$
ASI26546
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    0.9125    0.2302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4818    0.9636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8911    1.6799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3684    0.2302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  5  8  4  0  0  0  0
  9 10  1  0  0  0  0
 10 13  4  0  0  0  0
  2 11  1  0  0  0  0
  7 12  4  0  0  0  0
  8 13  4  0  0  0  0
  9 14  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  6 17  4  0  0  0  0
  6 18  4  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 16 22  1  0  0  0  0
 15 23  1  0  0  0  0
 17 24  4  0  0  0  0
 18 25  4  0  0  0  0
 23 26  1  0  0  0  0
 25 27  4  0  0  0  0
 10 12  4  0  0  0  0
 24 27  4  0  0  0  0
 22 26  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26546

>  <IDNUMBER>
BAS 00367503

>  <Activity>
0
$$$$
ASI22537
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -1.3207    0.4983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7250    1.1986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5124    0.4983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7532   -0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5616    1.1986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1034    1.1986    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6192   -0.9448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9659    0.4983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0799   -0.2209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3207    1.9318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5616   -0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7838    0.4983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7285   -0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2103   -0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2103   -1.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  6 13  1  0  0  0  0
  3  7  2  0  0  0  0
  8 18  1  0  0  0  0
  9 12  4  0  0  0  0
  3 10  1  0  0  0  0
  2 11  1  0  0  0  0
  4 12  4  0  0  0  0
 13 15  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
  5  9  4  0  0  0  0
  8 19  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI22537

>  <IDNUMBER>
BAS 00335703

>  <Activity>
0
$$$$
ASI12607
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.9003    1.2004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6502    1.9968    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4271    1.2235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1808    1.9968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2232    0.7310    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7006    1.0157    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    0.6810    2.6701    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9737    0.2308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7775   -1.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  5  1  0  0  0  0
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  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
  6 10  1  0  0  0  0
 11 14  4  0  0  0  0
  9 12  4  0  0  0  0
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 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 11 16  1  0  0  0  0
 10 17  4  0  0  0  0
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 16 19  1  0  0  0  0
 18 20  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
  3  4  1  0  0  0  0
 21 22  4  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12607

>  <IDNUMBER>
BAS 00253548

>  <Activity>
0
$$$$
ASI11491
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.6980   -0.2312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5200   -1.6698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5181   -1.1174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5994   -1.9396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
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  9 12  1  0  0  0  0
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  4 13  1  0  0  0  0
  3 14  1  0  0  0  0
  6 15  1  0  0  0  0
  5 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 11 21  1  0  0  0  0
  2  6  4  0  0  0  0
 16 18  1  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11491

>  <IDNUMBER>
BAS 00232219

>  <Activity>
0
$$$$
ASI26540
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.4236   -0.4142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  5 10  4  0  0  0  0
  5 11  4  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 12 16  4  0  0  0  0
 13 17  4  0  0  0  0
 11 18  4  0  0  0  0
 10 19  4  0  0  0  0
 19 20  4  0  0  0  0
 17 21  4  0  0  0  0
 14 15  1  0  0  0  0
 18 20  4  0  0  0  0
 16 21  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26540

>  <IDNUMBER>
BAS 00367490

>  <Activity>
0
$$$$
ASI2888
  Marvin  04201015132D          

 20 20  0  0  1  0            999 V2000
   -1.2140    0.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9417   -0.3323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6239    0.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5038   -0.3323    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2140    0.8921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3651   -0.3323    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0753    0.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9417   -1.1510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9236   -0.3323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6239    0.8921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2420   -1.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6554   -1.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9417    2.1027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  2  3  4  0  0  0  0
  1  4  1  0  0  0  0
  1  5  4  0  0  0  0
  6 13  1  0  0  0  0
  6  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 10  1  0  0  0  0
  4 10  1  0  0  0  0
 11 12  4  0  0  0  0
  5 12  4  0  0  0  0
  9 13  1  0  0  0  0
  9 14  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
 12 20  1  0  0  0  0
  3 11  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI2888

>  <IDNUMBER>
BAS 00100479

>  <Activity>
0
$$$$
ASI23566
  Marvin  04201015132D          

 18 19  0  0  1  0            999 V2000
   -2.7444   -0.5992    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4980    0.1884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0728   -1.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6620    0.1884    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7876   -0.6137    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1839   -0.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8698    1.2852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8024    0.2270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  8  2  0  0  0  0
  7  9  1  0  0  0  0
  3 10  2  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 13 18  4  0  0  0  0
 13 14  1  0  0  0  0
 12 15  4  0  0  0  0
 12 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
  4  5  1  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI23566

>  <IDNUMBER>
BAS 00341264

>  <Activity>
0
$$$$
ASI14623
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.4607    0.8293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0628    0.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8460    1.2941    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.4732    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0209    1.5161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067    0.8293    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7088    0.1256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1591   -0.6324    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6292    0.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5506    0.1256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067   -0.5948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4072    1.8344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3225    2.2825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8302   -1.2984    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6292   -0.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3328    0.6743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0574   -0.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  5  4  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
  3 12  1  0  0  0  0
  5 13  1  0  0  0  0
 11 14  1  0  0  0  0
  9 15  4  0  0  0  0
  9 16  4  0  0  0  0
 14 17  1  0  0  0  0
 14 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 15 21  4  0  0  0  0
 16 22  4  0  0  0  0
 22 23  4  0  0  0  0
  3  4  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI14623

>  <IDNUMBER>
BAS 00280476

>  <Activity>
0
$$$$
ASI22488
  Marvin  04201015132D          

 28 29  0  0  0  0            999 V2000
   -0.1485    0.6174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2553    1.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9700   -0.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3971   -0.0928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4991   -0.7845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0954    1.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6409    2.0655    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3207   -0.7845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0954   -0.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4156    1.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4991    0.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7245   -0.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2465    1.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3207    0.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2553   -1.5224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4156   -1.5224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7245   -1.5224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1073    2.8776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5460   -1.5224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  4  6  4  0  0  0  0
  4  5  4  0  0  0  0
  1  6  4  0  0  0  0
  3  7  4  0  0  0  0
  8 12  4  0  0  0  0
  2  9  2  0  0  0  0
 10 16  1  0  0  0  0
 11 15  4  0  0  0  0
 12 14  4  0  0  0  0
  3 13  1  0  0  0  0
  9 14  1  0  0  0  0
 15 17  4  0  0  0  0
 13 16  1  0  0  0  0
 14 17  4  0  0  0  0
  4 18  1  0  0  0  0
  5 19  1  0  0  0  0
  8 20  1  0  0  0  0
 11 21  1  0  0  0  0
 10 22  1  0  0  0  0
 10 23  1  0  0  0  0
 10 24  1  0  0  0  0
 18 25  1  0  0  0  0
 19 26  1  0  0  0  0
 20 27  1  0  0  0  0
 21 28  1  0  0  0  0
  5  7  4  0  0  0  0
  8 11  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI22488

>  <IDNUMBER>
BAS 00334923

>  <Activity>
0
$$$$
ASI30163
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.2570   -0.7759    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.8915    0.4636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8915   -0.3627    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6941   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9732   -0.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4056   -0.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4591   -0.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1706    0.8768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1706   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6030    0.8768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6941   -1.6068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1310   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4056    0.4775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2570   -1.6068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8379    0.4775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.5634    0.8906    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  1  0  0  0  0
  1  7  4  0  0  0  0
  2  8  2  0  0  0  0
  7  9  4  0  0  0  0
  2 10  1  0  0  0  0
  4 11  2  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
  1 14  4  0  0  0  0
 15 16  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  4  0  0  0  0
 15 18  1  0  0  0  0
 14 19  4  0  0  0  0
 19 20  4  0  0  0  0
 10 21  4  0  0  0  0
 10 22  4  0  0  0  0
 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
 24 25  4  0  0  0  0
  9 20  4  0  0  0  0
 15 17  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30163

>  <IDNUMBER>
BAS 00393740

>  <Activity>
0
$$$$
ASI27314
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    1.5125    0.7135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9848    0.7135    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4 12  1  0  0  0  0
  1  5  2  0  0  0  0
  3  6  1  0  0  0  0
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 10 14  4  0  0  0  0
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 11 16  1  0  0  0  0
 14 17  1  0  0  0  0
 18 19  4  0  0  0  0
  6 19  4  0  0  0  0
 18 20  4  0  0  0  0
 16 21  4  0  0  0  0
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 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
 24 25  4  0  0  0  0
  4 13  1  0  0  0  0
 14 20  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI27314

>  <IDNUMBER>
BAS 00376922

>  <Activity>
0
$$$$
ASI18187
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.3466   -0.3285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8231    0.3177    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  1  6  2  0  0  0  0
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  3  9  2  0  0  0  0
  8 10  4  0  0  0  0
  6 11  1  0  0  0  0
 12 17  4  0  0  0  0
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 11 14  4  0  0  0  0
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 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
  8 18  4  0  0  0  0
 10 19  1  0  0  0  0
 10 20  4  0  0  0  0
 18 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  5  1  0  0  0  0
 12 16  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18187

>  <IDNUMBER>
BAS 00312371

>  <Activity>
0
$$$$
ASI15371
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.9816    1.1747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4266    1.1388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
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  1  8  2  0  0  0  0
  7  9  4  0  0  0  0
  9 10  4  0  0  0  0
 11 13  4  0  0  0  0
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 12 13  4  0  0  0  0
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 10 17  1  0  0  0  0
 13 18  1  0  0  0  0
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 15 20  4  0  0  0  0
 17 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 11  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15371

>  <IDNUMBER>
BAS 00285519

>  <Activity>
0
$$$$
ASI27135
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
    0.8922    0.2372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1145   -0.8716    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6864    0.5054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0294    1.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0196    0.3507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1501   -1.9236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  7 10  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
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  3 12  1  0  0  0  0
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 12 18  1  0  0  0  0
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  4  0  0  0  0
  2  5  4  0  0  0  0
 16 18  1  0  0  0  0
 17 22  1  0  0  0  0
 19 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI27135

>  <IDNUMBER>
BAS 00371660

>  <Activity>
0
$$$$
ASI24412
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
   -1.4249   -0.7554    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4726    0.0765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0089    0.5546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8361    0.6503    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1373   -1.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5259    1.2241    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1612    0.5356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3012   -1.7405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1373   -1.9890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3142    0.0048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5574   -1.9890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  4  7  1  0  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5  7  1  0  0  0  0
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  1  9  1  0  0  0  0
  4 10  1  0  0  0  0
  2 11  2  0  0  0  0
  3 12  2  0  0  0  0
  9 13  4  0  0  0  0
  9 14  4  0  0  0  0
  8 15  1  0  0  0  0
 16 18  4  0  0  0  0
 10 17  1  0  0  0  0
 14 18  4  0  0  0  0
 13 19  4  0  0  0  0
 16 20  1  0  0  0  0
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 17 23  4  0  0  0  0
 17 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 26  4  0  0  0  0
 21 27  4  0  0  0  0
 22 28  4  0  0  0  0
 26 29  4  0  0  0  0
 28 30  4  0  0  0  0
  5  6  1  0  0  0  0
 16 19  4  0  0  0  0
 27 30  4  0  0  0  0
 25 29  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24412

>  <IDNUMBER>
BAS 00345434

>  <Activity>
0
$$$$
ASI16326
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
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   -4.0507   -0.3832    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -5.2696    0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 16  1  0  0  0  0
  3 14  1  0  0  0  0
  4 10  4  0  0  0  0
  1  5  1  0  0  0  0
  6 13  4  0  0  0  0
  1  7  1  0  0  0  0
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  3  9  2  0  0  0  0
 10 15  4  0  0  0  0
  5 11  4  0  0  0  0
  5 12  4  0  0  0  0
 13 21  4  0  0  0  0
 14 20  4  0  0  0  0
  9 15  1  0  0  0  0
  8 16  1  0  0  0  0
  7 17  1  0  0  0  0
  4 18  1  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 15 21  4  0  0  0  0
  6 22  1  0  0  0  0
  2 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  2 17  1  0  0  0  0
 14 19  4  0  0  0  0
  4  6  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16326

>  <IDNUMBER>
BAS 00289816

>  <Activity>
0
$$$$
ASI31328
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.0547    0.4178    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7759    0.8356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4873   -0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565    0.8356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3281   -2.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6342   -0.8107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6342   -1.6116    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3778    0.4178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3778   -0.4178    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.2010    0.8356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565    1.6539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2010   -0.8107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1040    0.8182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9098    0.4178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3778    2.0890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9098   -0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1040    1.6713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  5  6  4  0  0  0  0
  1  7  1  0  0  0  0
  8 11  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  1  0  0  0  0
 10 11  1  0  0  0  0
  8 12  2  0  0  0  0
  7 13  4  0  0  0  0
  8 14  1  0  0  0  0
 13 15  1  0  0  0  0
  5 16  4  0  0  0  0
  7 17  4  0  0  0  0
  6 18  4  0  0  0  0
 13 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 21 23  4  0  0  0  0
  4  6  4  0  0  0  0
 19 23  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI31328

>  <IDNUMBER>
BAS 00401064

>  <Activity>
0
$$$$
ASI12382
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
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   -1.2284   -1.2900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4741    1.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5406   -0.4765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  4  6  4  0  0  0  0
  5  8  1  0  0  0  0
  5  6  4  0  0  0  0
  3  7  4  0  0  0  0
  1  8  1  0  0  0  0
  9 18  1  0  0  0  0
  2 10  4  0  0  0  0
 11 13  4  0  0  0  0
 11 12  4  0  0  0  0
  5 13  4  0  0  0  0
 14 28  1  0  0  0  0
 15 21  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 14 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
 14 22  2  0  0  0  0
 16 23  1  0  0  0  0
 16 24  1  0  0  0  0
 15 25  1  0  0  0  0
  6 26  1  0  0  0  0
 10 27  1  0  0  0  0
 28 29  1  0  0  0  0
 27 29  1  0  0  0  0
  2 30  1  0  0  0  0
 12 31  1  0  0  0  0
  7 10  4  0  0  0  0
  4 12  4  0  0  0  0
 15 24  1  0  0  0  0
 17 23  1  0  0  0  0
 17 25  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI12382

>  <IDNUMBER>
BAS 00247227

>  <Activity>
0
$$$$
ASI13531
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
   -1.4507   -0.2379    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4200   -0.1036    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.7594   -0.0154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 11  1  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  4  0  0  0  0
  2  8  4  0  0  0  0
  8  9  4  0  0  0  0
  7 10  4  0  0  0  0
 11 13  1  0  0  0  0
  1 12  1  0  0  0  0
 12 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 16  4  0  0  0  0
  8 17  4  0  0  0  0
  9 18  4  0  0  0  0
 10 19  4  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 17 22  4  0  0  0  0
 16 23  4  0  0  0  0
 22 24  4  0  0  0  0
 23 25  4  0  0  0  0
  5 10  4  0  0  0  0
 19 25  4  0  0  0  0
  6  9  4  0  0  0  0
 18 24  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI13531

>  <IDNUMBER>
BAS 00263190

>  <Activity>
0
$$$$
ASI24408
  Marvin  04201015132D          

 33 37  0  0  1  0            999 V2000
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   -1.3592    0.3815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  4  0  0  0  0
  9 15  1  0  0  0  0
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 11 17  1  0  0  0  0
 10 18  4  0  0  0  0
 16 19  4  0  0  0  0
 19 20  4  0  0  0  0
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 17 24  4  0  0  0  0
 17 25  4  0  0  0  0
 18 26  4  0  0  0  0
 26 27  4  0  0  0  0
 24 28  4  0  0  0  0
 25 29  4  0  0  0  0
 22 30  4  0  0  0  0
 23 31  4  0  0  0  0
 29 32  4  0  0  0  0
 31 33  4  0  0  0  0
  6  7  1  0  0  0  0
 14 20  4  0  0  0  0
 21 27  4  0  0  0  0
 30 33  4  0  0  0  0
 28 32  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24408

>  <IDNUMBER>
BAS 00345430

>  <Activity>
0
$$$$
ASI16607
  Marvin  04201015132D          

 31 35  0  0  1  0            999 V2000
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    3.8681   -2.5130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6379   -2.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6 16  1  0  0  0  0
  6  7  1  0  0  0  0
  1  8  1  0  0  0  0
  9 18  1  0  0  0  0
  5 10  4  0  0  0  0
  4 11  4  0  0  0  0
  2 12  4  0  0  0  0
  3 13  4  0  0  0  0
  7 14  4  0  0  0  0
  8 15  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 15 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 13 21  4  0  0  0  0
 22 24  4  0  0  0  0
 10 23  4  0  0  0  0
 11 24  4  0  0  0  0
 22 25  1  0  0  0  0
 21 26  1  0  0  0  0
 15 27  1  0  0  0  0
  7 28  4  0  0  0  0
 14 29  4  0  0  0  0
 28 30  4  0  0  0  0
 29 31  4  0  0  0  0
  2  3  4  0  0  0  0
 21 23  4  0  0  0  0
 12 22  4  0  0  0  0
  6 17  1  0  0  0  0
 30 31  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI16607

>  <IDNUMBER>
BAS 00291892

>  <Activity>
0
$$$$
ASI30167
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
   -0.6643    0.1328    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0504    0.5406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7650   -0.6962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4796   -1.1085    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3789    0.5406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0935    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6643   -0.6962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0504   -1.1085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8172    0.5406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1942    0.1328    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9088   -1.1085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0935   -0.6962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5409    0.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8172    1.3651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3380   -1.9331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3 10  4  0  0  0  0
  4  6  1  0  0  0  0
  2  5  4  0  0  0  0
  3  6  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  1  9  4  0  0  0  0
  9 10  4  0  0  0  0
  8 11  1  0  0  0  0
  4 12  2  0  0  0  0
  4 13  1  0  0  0  0
  8 14  2  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 17 18  4  0  0  0  0
 16 18  4  0  0  0  0
 15 19  4  0  0  0  0
 17 20  1  0  0  0  0
  5 21  4  0  0  0  0
  2 22  4  0  0  0  0
 13 23  4  0  0  0  0
 13 24  4  0  0  0  0
 25 26  4  0  0  0  0
 22 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 28 29  4  0  0  0  0
  3  5  4  0  0  0  0
 21 25  4  0  0  0  0
 17 19  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30167

>  <IDNUMBER>
BAS 00393745

>  <Activity>
0
$$$$
ASI10162
  Marvin  04201015132D          

 29 32  0  0  1  0            999 V2000
    0.1950   -0.2770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950    0.5657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5306   -0.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5306   -1.5137    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1950    1.3888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089   -0.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6476    0.5657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5306   -3.1639    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5306    1.7984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089    1.7984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0221    0.5657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950    3.0351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5306    2.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089    2.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950    3.8544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950   -1.9271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2445   -1.9271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2445   -2.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950   -2.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6229   -0.2770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089   -1.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0572   -0.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6229   -1.9271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3329   -0.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8803    1.2796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8803   -0.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2900    0.5657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3329   -1.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8 19  1  0  0  0  0
  5  9  4  0  0  0  0
  5 10  4  0  0  0  0
  2 11  1  0  0  0  0
 12 14  4  0  0  0  0
  9 13  4  0  0  0  0
 10 14  4  0  0  0  0
 12 15  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
  6 20  4  0  0  0  0
  6 21  4  0  0  0  0
  7 22  1  0  0  0  0
  7 23  1  0  0  0  0
 21 24  4  0  0  0  0
 20 25  4  0  0  0  0
 23 26  1  0  0  0  0
 22 27  1  0  0  0  0
 26 28  1  0  0  0  0
 24 29  4  0  0  0  0
  8 18  1  0  0  0  0
 25 29  4  0  0  0  0
 12 13  4  0  0  0  0
 27 28  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI10162

>  <IDNUMBER>
BAS 00217929

>  <Activity>
0
$$$$
ASI12606
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.7279    0.6050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0599    1.0871    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3592   -0.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6144    0.6113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4853   -0.1985    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5314    0.8602    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9043   -0.7783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490    0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4337    0.8949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9493    0.5577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7078   -0.6144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3243   -0.2647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1321    1.3612    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.1278   -0.0883    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3873   -0.8161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  6  8  1  0  0  0  0
  4  9  2  0  0  0  0
  8 10  4  0  0  0  0
  7 11  1  0  0  0  0
 12 18  4  0  0  0  0
 10 13  1  0  0  0  0
 12 14  1  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 16 17  4  0  0  0  0
 15 18  4  0  0  0  0
  8 19  4  0  0  0  0
 10 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  4  1  0  0  0  0
 20 22  4  0  0  0  0
 12 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12606

>  <IDNUMBER>
BAS 00253547

>  <Activity>
0
$$$$
ASI23509
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
   -1.3143   -1.2445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5257   -1.4868    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0167   -0.0082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5257   -0.1560    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4789   -1.6635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0167    0.8502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0024    3.4502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  2  7  4  0  0  0  0
  3  8  4  0  0  0  0
  3  9  4  0  0  0  0
  5 10  1  0  0  0  0
  8 11  2  0  0  0  0
  7 12  1  0  0  0  0
  4 13  1  0  0  0  0
  9 14  1  0  0  0  0
 15 17  1  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 14 18  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
  6  8  4  0  0  0  0
  7  9  4  0  0  0  0
M  CHG  1  15   1
M  STY  1   1 DAT
M  SAL   1  1   6
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI23509

>  <IDNUMBER>
BAS 00341116

>  <Activity>
0
$$$$
ASI28781
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
   -1.4446    0.0781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472    0.6754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3235    0.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3341    1.6320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0893   -1.3118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8344   -0.2616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  9  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 10  1  0  0  0  0
 10 13  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  8 13  1  0  0  0  0
  6 14  4  0  0  0  0
  6 15  4  0  0  0  0
  5 16  4  0  0  0  0
  5 17  4  0  0  0  0
  7 18  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
 18 21  1  0  0  0  0
 15 22  4  0  0  0  0
 16 23  4  0  0  0  0
 17 24  4  0  0  0  0
 14 25  4  0  0  0  0
 24 26  4  0  0  0  0
 22 27  4  0  0  0  0
 19 28  1  0  0  0  0
 20 29  1  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
 28 29  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI28781

>  <IDNUMBER>
BAS 00386093

>  <Activity>
0
$$$$
ASI4698
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
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   -0.1677    1.0863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  5  8  4  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  4 11  4  0  0  0  0
 12 18  1  0  0  0  0
 11 13  4  0  0  0  0
  8 14  4  0  0  0  0
 13 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
  4  5  4  0  0  0  0
 13 14  4  0  0  0  0
 12 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI4698

>  <IDNUMBER>
BAS 00121217

>  <Activity>
0
$$$$
ASI8006
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
   -0.2739   -0.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7495    0.4984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4185    1.3316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9518   -2.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  1  4  4  0  0  0  0
  3  5  1  0  0  0  0
  2  6  4  0  0  0  0
  5  7  1  0  0  0  0
  3  8  1  0  0  0  0
  2  9  1  0  0  0  0
  4 10  4  0  0  0  0
  7 11  1  0  0  0  0
  8 12  4  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
  8 16  4  0  0  0  0
  6 17  4  0  0  0  0
 10 18  4  0  0  0  0
 12 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 20 23  4  0  0  0  0
  6 10  4  0  0  0  0
  7  9  1  0  0  0  0
 21 22  4  0  0  0  0
 19 23  4  0  0  0  0
M  CHG  2   5   1  14  -1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI8006

>  <IDNUMBER>
BAS 00161894

>  <Activity>
0
$$$$
ASI7960
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.8844    0.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3649    0.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3649   -0.4245    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490    0.6515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1490   -0.1798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0966    1.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6391    2.3229    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0442   -1.2146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5830   -1.2146    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1762   -0.4923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2918    1.8602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8565    1.0613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  2  0  0  0  0
 11 12  1  0  0  0  0
  8 12  1  0  0  0  0
  7 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 17 22  1  0  0  0  0
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
  4  5  4  0  0  0  0
 20 21  1  0  0  0  0
 23 25  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI7960

>  <IDNUMBER>
BAS 00161543

>  <Activity>
0
$$$$
ASI18203
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
   -0.0683   -0.4807    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6712    0.0910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0735    0.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  2  6  2  0  0  0  0
  1  7  1  0  0  0  0
  3  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  4  0  0  0  0
  7 13  4  0  0  0  0
 10 14  4  0  0  0  0
 10 15  4  0  0  0  0
 11 16  4  0  0  0  0
 11 17  4  0  0  0  0
 13 18  4  0  0  0  0
 12 19  4  0  0  0  0
 15 20  4  0  0  0  0
 14 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 19 24  4  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
  4  5  1  0  0  0  0
 18 24  4  0  0  0  0
 20 25  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18203

>  <IDNUMBER>
BAS 00312456

>  <Activity>
0
$$$$
ASI27581
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
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  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
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  9 17  1  0  0  0  0
  3 10  2  0  0  0  0
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 13 19  1  0  0  0  0
  8 14  1  0  0  0  0
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 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 14 18  1  0  0  0  0
  9 19  1  0  0  0  0
 16 20  1  0  0  0  0
  5 21  4  0  0  0  0
  4 22  4  0  0  0  0
 20 23  4  0  0  0  0
 20 24  4  0  0  0  0
 22 25  4  0  0  0  0
 21 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 28 29  4  0  0  0  0
  4  5  4  0  0  0  0
 25 26  4  0  0  0  0
  9 18  1  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27581

>  <IDNUMBER>
BAS 00380522

>  <Activity>
0
$$$$
ASI12545
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
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   -0.7928    0.6918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
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  4 10  4  0  0  0  0
  6 11  4  0  0  0  0
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 11 14  4  0  0  0  0
 12 15  2  0  0  0  0
 16 18  4  0  0  0  0
 11 17  1  0  0  0  0
 13 18  4  0  0  0  0
 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
  7 21  4  0  0  0  0
 10 22  4  0  0  0  0
 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
  7 10  4  0  0  0  0
  8  9  1  0  0  0  0
 23 24  4  0  0  0  0
 14 16  4  0  0  0  0
M  CHG  2   5   1  19  -1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI12545

>  <IDNUMBER>
BAS 00253369

>  <Activity>
0
$$$$
ASI14372
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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   -2.6917   -0.5228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4006    1.3020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0246   -0.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  9 13  1  0  0  0  0
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 13 17  4  0  0  0  0
 12 14  4  0  0  0  0
 12 15  4  0  0  0  0
 15 16  4  0  0  0  0
 14 17  4  0  0  0  0
  8 18  1  0  0  0  0
  3  5  1  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI14372

>  <IDNUMBER>
BAS 00276524

>  <Activity>
0
$$$$
ASI28875
  Marvin  04201015132D          

 32 37  0  0  1  0            999 V2000
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   -0.8544   -0.3702    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 16 23  1  0  0  0  0
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 14 18  4  0  0  0  0
 13 19  1  0  0  0  0
  3 20  1  0  0  0  0
 12 21  1  0  0  0  0
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 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  6 25  1  0  0  0  0
 16 26  1  0  0  0  0
 25 27  1  0  0  0  0
 19 28  1  0  0  0  0
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 28 30  1  0  0  0  0
 29 31  1  0  0  0  0
 31 32  1  0  0  0  0
  5  7  4  0  0  0  0
 20 27  1  0  0  0  0
 10 11  1  0  0  0  0
 13 18  4  0  0  0  0
 16 24  1  0  0  0  0
 30 32  1  0  0  0  0
M  CHG  1  16   1
M  END
>  <NAME>
ASI28875

>  <IDNUMBER>
BAS 00386715

>  <Activity>
0
$$$$
ASI3710
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.1726    0.8688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9272    0.4929    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 11 13  4  0  0  0  0
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 11 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 10 20  4  0  0  0  0
 21 22  4  0  0  0  0
 19 22  4  0  0  0  0
 15 18  1  0  0  0  0
 20 21  4  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI3710

>  <IDNUMBER>
BAS 00110665

>  <Activity>
0
$$$$
ASI22228
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
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  2  5  1  0  0  0  0
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  1 10  4  0  0  0  0
  3 11  2  0  0  0  0
  5 12  2  0  0  0  0
 13 14  4  0  0  0  0
 10 14  4  0  0  0  0
  9 15  4  0  0  0  0
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 15 17  1  0  0  0  0
 14 18  1  0  0  0  0
  2 19  1  0  0  0  0
 16 20  1  0  0  0  0
 16 21  1  0  0  0  0
 13 15  4  0  0  0  0
  3  6  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22228

>  <IDNUMBER>
BAS 00333709

>  <Activity>
0
$$$$
ASI5560
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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   -0.8494   -1.4014    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5998    1.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5787   -0.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0809    1.8049    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7179    0.5309    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2827   -0.5787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2827    1.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2846   -0.1593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5787   -1.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9886   -0.1593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0013   -0.5787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2846   -1.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0013   -1.3802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  5  6  4  0  0  0  0
  7 11  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  1 10  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
 10 16  4  0  0  0  0
 10 17  4  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
  4  6  4  0  0  0  0
 21 22  4  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI5560

>  <IDNUMBER>
BAS 00129541

>  <Activity>
0
$$$$
ASI12610
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.6864    0.5479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0157    1.0296    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3999   -0.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6549    0.5541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4408   -0.2550    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4893    0.8029    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9446   -0.8312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1033    0.2519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4736    0.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7507   -0.6707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8873    0.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0152    0.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0605    1.2941    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8338    0.2897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0920    1.0768    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.1266   -1.1084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9427   -0.5573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3080   -1.2784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5013   -0.0504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3943   -0.3212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5472   -1.1084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3407   -0.8596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  6  8  1  0  0  0  0
  4  9  2  0  0  0  0
  7 10  1  0  0  0  0
  8 11  4  0  0  0  0
 10 12  4  0  0  0  0
 11 13  1  0  0  0  0
 12 14  4  0  0  0  0
 14 15  1  0  0  0  0
 16 18  4  0  0  0  0
  8 17  4  0  0  0  0
 10 18  4  0  0  0  0
 11 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  4  1  0  0  0  0
 19 22  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12610

>  <IDNUMBER>
BAS 00253559

>  <Activity>
0
$$$$
ASI11474
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
   -0.6283   -0.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0702   -1.1163    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6283   -2.3570    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3428   -1.1004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3428   -1.9424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0702   -1.9424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6283    0.1212    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0827   -2.3570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7942   -2.3666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5150    1.3650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2198    1.7765    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0765    0.5295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5022    0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7942    1.7765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1752   -1.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6075   -0.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0765    1.3555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7942    0.1244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2198    2.6058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9279    1.3715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6504   -0.5039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0589    0.2934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9215    3.0077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9279    0.5517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4733   -0.5677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3300    1.0749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  6  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  2  0  0  0  0
  5  8  2  0  0  0  0
  6  9  2  0  0  0  0
 10 14  4  0  0  0  0
 10 11  1  0  0  0  0
  7 12  1  0  0  0  0
 13 18  4  0  0  0  0
 14 17  4  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
 12 17  4  0  0  0  0
 12 18  4  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
  3  5  1  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI11474

>  <IDNUMBER>
BAS 00232096

>  <Activity>
0
$$$$
ASI23032
  Marvin  04201015132D          

 19 22  0  0  0  0            999 V2000
   -1.4646   -0.0492    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1970    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1970   -0.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2227    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9898   -0.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9898    0.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5151    0.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5151   -0.8957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2227   -0.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9348    0.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9348   -0.8957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0993    0.0941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6425    0.3270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9348   -0.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8094    0.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6425   -0.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6246    0.7793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7545   -0.6584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3725    0.7390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  5  1  0  0  0  0
  4  7  4  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  4  0  0  0  0
  3  8  4  0  0  0  0
  8  9  4  0  0  0  0
  4 10  4  0  0  0  0
  9 11  4  0  0  0  0
 12 17  1  0  0  0  0
 10 13  4  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
 11 16  4  0  0  0  0
 15 17  1  0  0  0  0
 14 18  1  0  0  0  0
 13 19  1  0  0  0  0
 12 18  1  0  0  0  0
  2  3  4  0  0  0  0
  4  9  4  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI23032

>  <IDNUMBER>
BAS 00338413

>  <Activity>
0
$$$$
ASI25325
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -1.7185    1.3832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1901    0.7020    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1901    2.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8802    1.3832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9760    1.7866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9760    0.9535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4611    0.6759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3772    0.6759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6085   -1.4618    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.7963   -0.0210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4611    2.0852    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9123    2.8396    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.6085   -0.0210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3772   -0.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0329   -2.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7963   -1.4618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0329   -0.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6727    2.2109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8659   -2.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6727    0.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.3800    1.7866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  1  0  0  0  0
  3  5  4  0  0  0  0
  2  6  4  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 17  1  0  0  0  0
  8 10  2  0  0  0  0
  4 11  2  0  0  0  0
  3 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  1  0  0  0  0
  9 15  1  0  0  0  0
 14 16  1  0  0  0  0
 13 17  1  0  0  0  0
  5 18  4  0  0  0  0
 15 19  1  0  0  0  0
  6 20  4  0  0  0  0
 19 21  4  0  0  0  0
 19 22  4  0  0  0  0
 18 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
 26 27  4  0  0  0  0
  5  6  4  0  0  0  0
 23 24  4  0  0  0  0
  9 16  1  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI25325

>  <IDNUMBER>
BAS 00355768

>  <Activity>
0
$$$$
ASI18792
  Marvin  04201015132D          

 16 17  0  0  0  0            999 V2000
   -2.6791   -0.3538    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2111   -0.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2083    0.3566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2739    0.3566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2739   -1.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5151   -0.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5037    0.3566    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.4437    0.3566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4437   -1.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4494    1.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4494   -0.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2626   -0.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2626    1.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  2  3  2  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6 11  4  0  0  0  0
  3  7  1  0  0  0  0
  8 15  4  0  0  0  0
  1  9  1  0  0  0  0
  8 10  1  0  0  0  0
  4 11  4  0  0  0  0
  5 12  4  0  0  0  0
  7 13  4  0  0  0  0
  7 14  4  0  0  0  0
 14 15  4  0  0  0  0
 13 16  4  0  0  0  0
  6 12  4  0  0  0  0
  8 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18792

>  <IDNUMBER>
BAS 00315008

>  <Activity>
0
$$$$
ASI11039
  Marvin  04201015132D          

 41 43  0  0  1  0            999 V2000
    4.1980    1.4452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2883    0.3096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
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  6 17  1  0  0  0  0
  1  7  4  0  0  0  0
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  2 10  4  0  0  0  0
 11 27  1  0  0  0  0
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 13 21  4  0  0  0  0
 16 22  4  0  0  0  0
 23 36  1  0  0  0  0
 24 39  1  0  0  0  0
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 12 26  1  0  0  0  0
 27 35  1  0  0  0  0
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  9 30  1  0  0  0  0
  7 31  1  0  0  0  0
 10 32  1  0  0  0  0
  8 33  1  0  0  0  0
 24 34  1  0  0  0  0
 23 35  1  0  0  0  0
 29 36  1  0  0  0  0
 26 37  1  0  0  0  0
 25 38  1  0  0  0  0
 38 39  1  0  0  0  0
 21 40  1  0  0  0  0
 22 41  1  0  0  0  0
 14 21  4  0  0  0  0
 28 34  1  0  0  0  0
 15 22  4  0  0  0  0
M  CHG  2  11   1  12   1
M  END
>  <NAME>
ASI11039

>  <IDNUMBER>
BAS 00227517

>  <Activity>
0
$$$$
ASI28646
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -1.1531    1.5082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4428    0.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2629   -0.1522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9963    0.2676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8634    0.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
 16 20  1  0  0  0  0
 18 21  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI28646

>  <IDNUMBER>
BAS 00385296

>  <Activity>
0
$$$$
ASI11621
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.6109    0.7713    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4353   -0.0382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0993    1.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7153    0.7229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0339    0.6007    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.1960    2.0085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
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  4  9  4  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
  9 12  4  0  0  0  0
 12 13  1  0  0  0  0
 14 19  1  0  0  0  0
  8 15  4  0  0  0  0
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 13 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
  4  5  4  0  0  0  0
 14 20  1  0  0  0  0
 12 15  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI11621

>  <IDNUMBER>
BAS 00233285

>  <Activity>
0
$$$$
ASI24270
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
   -0.4234    0.1202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1309    1.3658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8493    0.1202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
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  1  4  1  0  0  0  0
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  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
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  2  9  4  0  0  0  0
  6 10  4  0  0  0  0
  9 11  4  0  0  0  0
  3 12  1  0  0  0  0
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 10 14  4  0  0  0  0
 14 15  4  0  0  0  0
 12 16  1  0  0  0  0
  7 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 12 20  1  0  0  0  0
 12 21  1  0  0  0  0
 17 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  1  0  0  0  0
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 22 26  4  0  0  0  0
 23 27  4  0  0  0  0
 27 28  4  0  0  0  0
  8 16  1  0  0  0  0
  7 11  4  0  0  0  0
 13 15  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI24270

>  <IDNUMBER>
BAS 00345156

>  <Activity>
0
$$$$
ASI21273
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.2537   -0.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9547    0.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1317   -0.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  2  9  4  0  0  0  0
  4 10  4  0  0  0  0
  8 11  2  0  0  0  0
 12 16  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  7 15  1  0  0  0  0
 14 16  1  0  0  0  0
 13 17  1  0  0  0  0
  8 18  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  1  0  0  0  0
  9 10  4  0  0  0  0
 12 17  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI21273

>  <IDNUMBER>
BAS 00327810

>  <Activity>
0
$$$$
ASI7027
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
   -0.6872   -0.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4076    0.3790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  7  1  0  0  0  0
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  9 15  1  0  0  0  0
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 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 13 22  4  0  0  0  0
 16 23  4  0  0  0  0
  5  6  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   9   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI7027

>  <IDNUMBER>
BAS 00141377

>  <Activity>
0
$$$$
ASI21174
  Marvin  04201015132D          

 27 29  0  0  0  0            999 V2000
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  3  9  2  0  0  0  0
  2 10  2  0  0  0  0
 11 14  4  0  0  0  0
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  8 18  1  0  0  0  0
 13 19  1  0  0  0  0
 11 20  1  0  0  0  0
 18 21  1  0  0  0  0
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 20 24  1  0  0  0  0
 22 25  4  0  0  0  0
 23 26  4  0  0  0  0
 26 27  4  0  0  0  0
  4  6  1  0  0  0  0
  8 11  4  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI21174

>  <IDNUMBER>
BAS 00327319

>  <Activity>
0
$$$$
ASI18781
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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 10 12  4  0  0  0  0
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 13 18  1  0  0  0  0
 17 19  1  0  0  0  0
 11 15  4  0  0  0  0
  4 10  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18781

>  <IDNUMBER>
BAS 00314911

>  <Activity>
0
$$$$
ASI11564
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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 20 21  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI11564

>  <IDNUMBER>
BAS 00232854

>  <Activity>
0
$$$$
2jf0_HBP
  Marvin  04201014582D          

 25 26  0  0  0  0            999 V2000
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 21 22  4  0  0  0  0
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 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
M  CHG  2   9   1  17   1
M  END
>  <Activity>
1

>  <PDB_ID>
2jf0_HBP

$$$$
ASI4790
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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  5 16  1  0  0  0  0
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 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 15 20  4  0  0  0  0
 20 21  4  0  0  0  0
  8  9  4  0  0  0  0
  7 11  1  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI4790

>  <IDNUMBER>
BAS 00123865

>  <Activity>
0
$$$$
ASI3265
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
    1.6181    0.8412    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2202    1.5688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3790    1.5688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2580   -1.2846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6945    0.1364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0189   -0.5759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4555    0.8412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2202    0.1364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8526   -0.5759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  3 12  4  0  0  0  0
  3 13  4  0  0  0  0
  4 14  4  0  0  0  0
  4 15  4  0  0  0  0
 13 16  4  0  0  0  0
 12 17  4  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 17 20  4  0  0  0  0
 19 21  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI3265

>  <IDNUMBER>
BAS 00104526

>  <Activity>
0
$$$$
ASI22912
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
    0.3732    1.3943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5199    0.7395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0102    0.7395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4749    1.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8176    1.0856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3164   -1.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6420   -0.3970    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  3  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  3  9  1  0  0  0  0
  1 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  4  0  0  0  0
  4 13  1  0  0  0  0
 12 14  1  0  0  0  0
  2 15  1  0  0  0  0
  1 16  1  0  0  0  0
 13 17  1  0  0  0  0
  5 18  4  0  0  0  0
 12 19  4  0  0  0  0
 17 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
 21 24  4  0  0  0  0
 20 25  4  0  0  0  0
 24 26  4  0  0  0  0
  2 11  1  0  0  0  0
  2  9  1  0  0  0  0
 25 26  4  0  0  0  0
 19 23  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI22912

>  <IDNUMBER>
BAS 00337650

>  <Activity>
0
$$$$
ASI23989
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
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   -0.0275    0.4732    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7429    1.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5163   -1.6399    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
  1  6  1  0  0  0  0
  5  7  4  0  0  0  0
  6  8  1  0  0  0  0
  4  9  1  0  0  0  0
  3 10  1  0  0  0  0
  8 11  2  0  0  0  0
  8 12  1  0  0  0  0
 13 18  1  0  0  0  0
  9 14  1  0  0  0  0
  5 15  4  0  0  0  0
 12 16  1  0  0  0  0
  7 17  4  0  0  0  0
 16 18  1  0  0  0  0
 13 19  1  0  0  0  0
 13 20  1  0  0  0  0
 14 21  4  0  0  0  0
 14 22  4  0  0  0  0
 15 23  4  0  0  0  0
 23 24  4  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 22 27  4  0  0  0  0
 21 28  4  0  0  0  0
 27 29  4  0  0  0  0
  4  7  4  0  0  0  0
 17 24  4  0  0  0  0
 28 29  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI23989

>  <IDNUMBER>
BAS 00342734

>  <Activity>
0
$$$$
ASI21620
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.0589    0.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6109    0.2640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3589   -0.5280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4760    0.7080    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  4  0  0  0  0
  2  4  4  0  0  0  0
  1  5  4  0  0  0  0
  3  6  4  0  0  0  0
  7 12  1  0  0  0  0
  8 11  2  0  0  0  0
  5  9  4  0  0  0  0
 10 14  1  0  0  0  0
  6 11  1  0  0  0  0
  8 12  1  0  0  0  0
  4 13  4  0  0  0  0
  7 14  1  0  0  0  0
  7 15  2  0  0  0  0
  4 16  1  0  0  0  0
 13 17  1  0  0  0  0
  2 18  4  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 18 21  4  0  0  0  0
 21 22  4  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
  6  9  4  0  0  0  0
 13 22  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI21620

>  <IDNUMBER>
BAS 00330022

>  <Activity>
0
$$$$
ASI22390
  Marvin  04201015132D          

 20 23  0  0  1  0            999 V2000
   -0.2423   -0.5973    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.2560   -1.0991    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3 10  1  0  0  0  0
  1 11  1  0  0  0  0
 11 12  1  0  0  0  0
 13 18  4  0  0  0  0
  3 14  1  0  0  0  0
  4 15  1  0  0  0  0
 13 16  1  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 12 19  4  0  0  0  0
 12 20  4  0  0  0  0
  3  9  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  1  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22390

>  <IDNUMBER>
BAS 00334631

>  <Activity>
0
$$$$
ASI17599
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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   -1.4129    2.3435    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  4  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  4  0  0  0  0
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  4  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
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  2  3  4  0  0  0  0
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M  CHG  1   4   1
M  END
>  <NAME>
ASI17599

>  <IDNUMBER>
BAS 00297165

>  <Activity>
0
$$$$
ASI24143
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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  6  9  4  0  0  0  0
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 11 12  4  0  0  0  0
 10 12  4  0  0  0  0
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 15 19  1  0  0  0  0
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 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
 11 13  4  0  0  0  0
 19 20  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24143

>  <IDNUMBER>
BAS 00344301

>  <Activity>
0
$$$$
ASI12603
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 13 17  4  0  0  0  0
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 20 21  4  0  0  0  0
  3  4  1  0  0  0  0
 19 21  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI12603

>  <IDNUMBER>
BAS 00253535

>  <Activity>
0
$$$$
ASI582
  Marvin  04201015132D          

 21 24  0  0  0  0            999 V2000
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 10 16  4  0  0  0  0
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 15 18  4  0  0  0  0
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 16 20  4  0  0  0  0
 19 21  4  0  0  0  0
  7 10  4  0  0  0  0
 18 20  4  0  0  0  0
  6  9  4  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI582

>  <IDNUMBER>
BAS 00023181

>  <Activity>
0
$$$$
ASI29628
  Marvin  04201015132D          

 28 31  0  0  1  0            999 V2000
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 11 18  1  0  0  0  0
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 16 19  1  0  0  0  0
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 13 18  1  0  0  0  0
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 16 20  1  0  0  0  0
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 20 24  1  0  0  0  0
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  4  5  4  0  0  0  0
 11 12  1  0  0  0  0
 27 28  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI29628

>  <IDNUMBER>
BAS 00391437

>  <Activity>
0
$$$$
ASI62
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 15 20  1  0  0  0  0
  4  5  4  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI62

>  <IDNUMBER>
BAS 00004282

>  <Activity>
0
$$$$
1h23_E12
  Marvin  04201014582D          

 36 39  0  0  0  0            999 V2000
    4.1312   30.5147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  CHG  2  12   1  25   1
M  STY  2   1 DAT   2 DAT
M  SAL   1  1   3
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  SAL   2  1  36
M  SDT   2 MRV_IMPLICIT_H                                        
M  SDD   2     0.0000    0.0000    DR    ALL  0       0  
M  SED   2 IMPL_H1
M  END
>  <Activity>
1

>  <PDB_ID>
1h23_E12

$$$$
ASI31331
  Marvin  04201015132D          

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M  CHG  1   1   1
M  END
>  <NAME>
ASI31331

>  <IDNUMBER>
BAS 00401077

>  <Activity>
0
$$$$
ASI6603
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 15 20  1  0  0  0  0
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 14 20  1  0  0  0  0
 10 13  4  0  0  0  0
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M  CHG  1   3   1
M  END
>  <NAME>
ASI6603

>  <IDNUMBER>
BAS 00139201

>  <Activity>
0
$$$$
ASI10835
  Marvin  04201015132D          

 32 35  0  0  1  0            999 V2000
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 29 32  4  0  0  0  0
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 27 31  4  0  0  0  0
 28 32  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI10835

>  <IDNUMBER>
BAS 00226233

>  <Activity>
0
$$$$
ASI7268
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
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 18 20  4  0  0  0  0
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 17 20  4  0  0  0  0
 16 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI7268

>  <IDNUMBER>
BAS 00147794

>  <Activity>
0
$$$$
ASI21796
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
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    0.9360   -0.2210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2774   -0.7196    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1317    0.5503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3998   -0.2399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
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  4  8  2  0  0  0  0
  9 14  1  0  0  0  0
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 11 13  1  0  0  0  0
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 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
  3  5  1  0  0  0  0
  9 13  1  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI21796

>  <IDNUMBER>
BAS 00331465

>  <Activity>
0
$$$$
ASI29625
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
    1.4136    0.3096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8570   -0.4019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5682   -0.7067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0765    0.3511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6447    0.4019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  4  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  1  6  4  0  0  0  0
  6  7  4  0  0  0  0
  3  8  4  0  0  0  0
  2  9  4  0  0  0  0
 10 15  1  0  0  0  0
  7 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  2  0  0  0  0
  4 14  1  0  0  0  0
 12 15  1  0  0  0  0
 10 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 21 22  4  0  0  0  0
  7  9  4  0  0  0  0
  5  8  4  0  0  0  0
 10 11  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1  10   1
M  STY  1   1 DAT
M  SAL   1  1   5
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI29625

>  <IDNUMBER>
BAS 00391407

>  <Activity>
0
$$$$
ASI10115
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
   -1.3926    0.4932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6854    1.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2065    0.1582    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0279    0.4932    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.3926    1.3182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6854    0.0713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9509   -0.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2065    1.1321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0279    1.3182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5614   -0.2605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7661    0.0465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5521   -1.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1923   -2.3107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6699    2.5464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1835    0.2605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9212   -2.6798    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2375   -2.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2530   -1.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  3 10  1  0  0  0  0
  4 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  4  0  0  0  0
 13 14  4  0  0  0  0
  2 15  1  0  0  0  0
  1 16  1  0  0  0  0
 14 17  1  0  0  0  0
 11 18  1  0  0  0  0
 19 20  4  0  0  0  0
 12 20  4  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
 18 23  4  0  0  0  0
 22 24  4  0  0  0  0
 23 25  4  0  0  0  0
 25 26  4  0  0  0  0
  2  9  1  0  0  0  0
  2  8  1  0  0  0  0
 24 26  4  0  0  0  0
 14 21  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI10115

>  <IDNUMBER>
BAS 00216525

>  <Activity>
0
$$$$
ASI28814
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
   -1.1259    0.5295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5273   -0.1616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3299   -0.1616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3455    0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7312    0.5295    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8806   -0.2619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9642    0.2899    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.5273    1.2263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3299    1.2263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2741   -0.1394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6967    1.7446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1227    1.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9708   -0.9642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5  9  1  0  0  0  0
  1  6  1  0  0  0  0
  7 10  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  4 10  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
  4 13  1  0  0  0  0
  7 14  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  6 17  4  0  0  0  0
  6 18  4  0  0  0  0
 11 19  4  0  0  0  0
 11 20  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 24 26  4  0  0  0  0
  3  5  1  0  0  0  0
 22 25  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI28814

>  <IDNUMBER>
BAS 00386298

>  <Activity>
0
$$$$
ASI6
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
   -1.2535   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5423   -0.0819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  1  0  0  0  0
  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
  8  9  4  0  0  0  0
  2 10  4  0  0  0  0
 10 11  4  0  0  0  0
 12 15  1  0  0  0  0
  5 13  1  0  0  0  0
 14 20  1  0  0  0  0
 14 15  1  0  0  0  0
  8 16  4  0  0  0  0
  9 17  4  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
 13 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 17 24  4  0  0  0  0
 16 25  4  0  0  0  0
  6  9  4  0  0  0  0
  7 11  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI6

>  <IDNUMBER>
BAS 00001620

>  <Activity>
0
$$$$
ASI26002
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.2288   -0.6803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9655    0.0841    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6003   -0.3109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3976   -0.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2075    1.4226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9843    1.0643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  4  0  0  0  0
  6 10  1  0  0  0  0
  9 11  4  0  0  0  0
  4 12  2  0  0  0  0
 10 13  4  0  0  0  0
  8 14  4  0  0  0  0
 15 18  4  0  0  0  0
 13 16  1  0  0  0  0
  9 17  1  0  0  0  0
 14 18  4  0  0  0  0
 15 19  1  0  0  0  0
 10 20  4  0  0  0  0
 13 21  4  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
 20 24  4  0  0  0  0
 24 25  4  0  0  0  0
  3  4  1  0  0  0  0
 21 25  4  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI26002

>  <IDNUMBER>
BAS 00365580

>  <Activity>
0
$$$$
ASI24426
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
   -0.8379    0.1708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5705    0.9442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  8 17  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  8 11  4  0  0  0  0
  8 12  4  0  0  0  0
 11 13  4  0  0  0  0
 12 14  4  0  0  0  0
  6 15  4  0  0  0  0
  6 16  4  0  0  0  0
  7 17  1  0  0  0  0
 18 20  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  1  0  0  0  0
  4  5  1  0  0  0  0
 18 19  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI24426

>  <IDNUMBER>
BAS 00345458

>  <Activity>
0
$$$$
ASI11182
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -0.0671   -0.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3206    0.2498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
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  1  5  1  0  0  0  0
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  5  7  1  0  0  0  0
  2  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 10  2  0  0  0  0
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  6 13  1  0  0  0  0
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 11 16  4  0  0  0  0
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 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 23 26  4  0  0  0  0
  4  6  4  0  0  0  0
 18 19  1  0  0  0  0
 22 26  4  0  0  0  0
 24 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11182

>  <IDNUMBER>
BAS 00229094

>  <Activity>
0
$$$$
ASI26507
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
   -0.0992    0.6556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5234   -0.0717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8294    1.3610    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7687    2.0718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5897    2.0718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4 17  1  0  0  0  0
  1  5  2  0  0  0  0
  6 20  1  0  0  0  0
  2  7  2  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
 10 15  4  0  0  0  0
 10 11  1  0  0  0  0
  9 12  4  0  0  0  0
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  8 14  1  0  0  0  0
 12 15  4  0  0  0  0
 13 16  4  0  0  0  0
 14 17  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 10 16  4  0  0  0  0
  6 21  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI26507

>  <IDNUMBER>
BAS 00367291

>  <Activity>
0
$$$$
ASI45
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.0951   -1.4659    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  3  4  0  0  0  0
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 18 19  4  0  0  0  0
  2  5  4  0  0  0  0
  8 12  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI45

>  <IDNUMBER>
BAS 00004241

>  <Activity>
0
$$$$
ASI22518
  Marvin  04201015132D          

 20 20  0  0  0  0            999 V2000
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   -1.4123    0.2097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  3  6  2  0  0  0  0
  7  9  4  0  0  0  0
  2  8  1  0  0  0  0
  4  9  4  0  0  0  0
  3 10  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
  7 13  1  0  0  0  0
 12 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 13 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  5  7  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI22518

>  <IDNUMBER>
BAS 00335529

>  <Activity>
0
$$$$
ASI7033
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.1330    0.1761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8495    0.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4043   -1.1129    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1506    0.1842    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  4  0  0  0  0
  1  3  4  0  0  0  0
  3  4  4  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  9 15  1  0  0  0  0
  7 10  2  0  0  0  0
  2 11  1  0  0  0  0
  7 12  1  0  0  0  0
 13 21  1  0  0  0  0
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 15 16  1  0  0  0  0
 16 20  1  0  0  0  0
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 12 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 14 23  4  0  0  0  0
 17 24  4  0  0  0  0
  5  6  4  0  0  0  0
 23 24  4  0  0  0  0
 13 22  1  0  0  0  0
M  CHG  1   9   1
M  STY  1   1 DAT
M  SAL   1  1   4
M  SDT   1 MRV_IMPLICIT_H                                        
M  SDD   1     0.0000    0.0000    DR    ALL  0       0  
M  SED   1 IMPL_H1
M  END
>  <NAME>
ASI7033

>  <IDNUMBER>
BAS 00141384

>  <Activity>
0
$$$$
ASI29412
  Marvin  04201015132D          

 33 37  0  0  0  0            999 V2000
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   -1.9500   -0.4658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  4  0  0  0  0
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  2  4  1  0  0  0  0
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  1  6  1  0  0  0  0
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  5  8  1  0  0  0  0
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 11 22  1  0  0  0  0
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 14 15  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
 18 27  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
 12 23  4  0  0  0  0
 12 24  4  0  0  0  0
 13 25  4  0  0  0  0
 13 26  4  0  0  0  0
 14 27  1  0  0  0  0
 23 28  4  0  0  0  0
 24 29  4  0  0  0  0
 25 30  4  0  0  0  0
 26 31  4  0  0  0  0
 29 32  4  0  0  0  0
 31 33  4  0  0  0  0
  8 20  1  0  0  0  0
  2  9  4  0  0  0  0
 11 21  1  0  0  0  0
 30 33  4  0  0  0  0
 28 32  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI29412

>  <IDNUMBER>
BAS 00390065

>  <Activity>
0
$$$$
ASI3698
  Marvin  04201015132D          

 27 28  0  0  0  0            999 V2000
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   -0.6831   -2.5682    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3812   -1.3288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3812   -2.1538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6831   -0.0933    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1837    1.5715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1165   -2.5682    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  1  0  0  0  0
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  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  8 12  4  0  0  0  0
  5  9  2  0  0  0  0
  6 10  2  0  0  0  0
 11 13  4  0  0  0  0
 12 16  4  0  0  0  0
 13 18  4  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
 16 21  1  0  0  0  0
  7 17  1  0  0  0  0
 16 18  4  0  0  0  0
  8 19  1  0  0  0  0
 11 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 14 24  1  0  0  0  0
 15 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
  4  5  1  0  0  0  0
  8 11  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI3698

>  <IDNUMBER>
BAS 00110581

>  <Activity>
0
$$$$
ASI25331
  Marvin  04201015132D          

 16 17  0  0  0  0            999 V2000
   -0.5453    0.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6986   -1.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  6 11  4  0  0  0  0
  6  7  1  0  0  0  0
  5  8  4  0  0  0  0
  5  9  4  0  0  0  0
  8 10  4  0  0  0  0
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  4 12  4  0  0  0  0
  4 13  4  0  0  0  0
 12 14  4  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
  6 10  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25331

>  <IDNUMBER>
BAS 00355877

>  <Activity>
0
$$$$
ASI18271
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  3 10  1  0  0  0  0
 10 11  3  0  0  0  0
 12 17  1  0  0  0  0
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 14 22  1  0  0  0  0
  6 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
  8 18  4  0  0  0  0
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 12 20  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
  8  9  4  0  0  0  0
  4  7  4  0  0  0  0
 24 25  4  0  0  0  0
 14 23  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI18271

>  <IDNUMBER>
BAS 00312736

>  <Activity>
0
$$$$
ASI26001
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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    2.9184   -1.2686    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9651    0.5462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5599    0.0770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3509    0.8762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  5  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  3  7  2  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  4  0  0  0  0
  4 11  2  0  0  0  0
  8 12  4  0  0  0  0
  9 13  4  0  0  0  0
 10 14  4  0  0  0  0
 12 15  4  0  0  0  0
 13 16  1  0  0  0  0
 15 17  4  0  0  0  0
 15 18  1  0  0  0  0
 10 19  1  0  0  0  0
  9 20  4  0  0  0  0
 13 21  4  0  0  0  0
 20 22  4  0  0  0  0
 22 23  4  0  0  0  0
  3  4  1  0  0  0  0
 21 23  4  0  0  0  0
 14 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI26001

>  <IDNUMBER>
BAS 00365573

>  <Activity>
0
$$$$
ASI22328
  Marvin  04201015132D          

 32 35  0  0  1  0            999 V2000
    2.0792    0.1985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7906   -0.2316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0662   -0.2316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6453    0.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5076    0.1985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5076    1.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.0960    0.2978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  4  0  0  0  0
  3  6  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  2  7  4  0  0  0  0
  8 18  1  0  0  0  0
  1  9  4  0  0  0  0
 10 15  4  0  0  0  0
  3 11  2  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  9 15  4  0  0  0  0
  8 16  1  0  0  0  0
 13 17  1  0  0  0  0
 12 18  1  0  0  0  0
  2 19  1  0  0  0  0
 16 20  1  0  0  0  0
  7 21  1  0  0  0  0
 10 22  1  0  0  0  0
 14 23  4  0  0  0  0
 14 24  4  0  0  0  0
 20 25  4  0  0  0  0
 20 26  4  0  0  0  0
 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 25 29  4  0  0  0  0
 26 30  4  0  0  0  0
 28 31  4  0  0  0  0
 30 32  4  0  0  0  0
  7 10  4  0  0  0  0
 27 31  4  0  0  0  0
  8 17  1  0  0  0  0
 29 32  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22328

>  <IDNUMBER>
BAS 00334038

>  <Activity>
0
$$$$
ASI24200
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    1.4141    0.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4809    0.0594    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4141    0.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6718    1.3213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1378   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1378    1.3065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7683   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1935   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8504    0.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8504    0.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0557    0.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7683    1.3213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1378   -1.1729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9246    0.0371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8393   -1.5848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6261   -0.3860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6187   -1.2137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3  5  1  0  0  0  0
  1  4  4  0  0  0  0
  1  5  1  0  0  0  0
  4  6  4  0  0  0  0
  1  7  4  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
  2 10  1  0  0  0  0
 11 12  4  0  0  0  0
  7 12  4  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 16  1  0  0  0  0
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 15 19  1  0  0  0  0
 15 20  1  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
  6 11  4  0  0  0  0
  2  8  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI24200

>  <IDNUMBER>
BAS 00344504

>  <Activity>
0
$$$$
ASI6600
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -1.0512    0.8634    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3398    1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0512    2.5142    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7587    1.2871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3398    2.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7587    2.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3878    0.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3677   -1.6109    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7908   -2.4542    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3878    2.5342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0512    0.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0992    1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3518   -2.4343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7908   -1.6109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0593   -2.8580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0713   -1.2071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3398   -0.3638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0992    2.1305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3677   -1.2071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4782    0.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4782   -3.7214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1977    1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1977    2.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  6  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  4  6  4  0  0  0  0
  2  7  4  0  0  0  0
  8 19  1  0  0  0  0
  9 15  1  0  0  0  0
  5 10  4  0  0  0  0
  1 11  1  0  0  0  0
  7 12  4  0  0  0  0
  8 13  1  0  0  0  0
 14 16  1  0  0  0  0
 13 15  1  0  0  0  0
  8 16  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  4  0  0  0  0
 17 19  1  0  0  0  0
 12 20  1  0  0  0  0
  4 21  4  0  0  0  0
  9 22  1  0  0  0  0
  6 23  4  0  0  0  0
 24 25  1  0  0  0  0
 22 25  1  0  0  0  0
 21 26  4  0  0  0  0
 26 27  4  0  0  0  0
  3  5  1  0  0  0  0
 23 27  4  0  0  0  0
 10 18  4  0  0  0  0
  9 14  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI6600

>  <IDNUMBER>
BAS 00139131

>  <Activity>
0
$$$$
