ASI19861
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
   -0.2567    0.2860    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0729    0.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4768   -0.4334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2034   -1.2076    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8807   -1.6956    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2847   -0.4461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5161   -1.2287    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5512    0.3029    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5021    0.9929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2398   -0.5218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2777    1.1107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3142    0.9803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7966   -0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7139    0.2524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9719   -0.3830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7797    0.4628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4697    0.9088    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6381   -0.3450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8260   -1.1908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2187    0.5386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4319    1.7545    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
  4  5  4  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  1  8  1  0  0  0  0
  2  9  4  0  0  0  0
  1 10  2  0  0  0  0
  1 11  2  0  0  0  0
  9 12  4  0  0  0  0
 13 15  1  0  0  0  0
 12 14  4  0  0  0  0
  8 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 13 18  1  0  0  0  0
 13 19  1  0  0  0  0
 17 20  1  0  0  0  0
 17 21  1  0  0  0  0
  6 14  4  0  0  0  0
  5  7  4  0  0  0  0
M  CHG  1  17   1
M  END
>  <NAME>
ASI19861

>  <IDNUMBER>
BAS 00318964

>  <Activity>
0
$$$$
ASI24192
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
   -0.8215   -0.1238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0487    0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6465   -0.1238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.8422    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.9122   -0.0997    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -0.8422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0453   -0.8422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8634    0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0975   -0.0997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6465    1.3028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8215    1.3028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8147   -1.5503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8147   -0.1238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6397   -1.5503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6397   -0.1238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0487   -0.8422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2725   -0.1134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8703   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6884    0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8634   -0.2372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8634    1.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    2.0144    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  1  0  0  0  0
  5  9  3  0  0  0  0
  1  6  1  0  0  0  0
  7 15  1  0  0  0  0
  2  8  1  0  0  0  0
  9 18  1  0  0  0  0
  1 10  4  0  0  0  0
 11 12  4  0  0  0  0
 10 12  4  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  3 17  1  0  0  0  0
 18 19  1  0  0  0  0
  7 19  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
 12 23  1  0  0  0  0
  2 11  4  0  0  0  0
  7 16  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24192

>  <IDNUMBER>
BAS 00344488

>  <Activity>
0
$$$$
ASI21474
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -0.0724    0.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6608    0.5457    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0724   -0.7078    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7887    0.5201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6608    1.3388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6608   -1.1171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7887    1.3643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3771   -0.7078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0724    1.7737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3771    0.1108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6608   -1.9570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0934   -1.1171    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.5050    1.7737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0702    2.0551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4411    1.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5050    0.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0427   -2.3706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7419   -1.9741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0427   -3.1893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2214    1.3388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2214    0.5457    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  4  0  0  0  0
  6  8  1  0  0  0  0
  5  9  1  0  0  0  0
  8 10  2  0  0  0  0
  6 11  1  0  0  0  0
  8 12  1  0  0  0  0
  7 13  4  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  4 16  4  0  0  0  0
 11 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 20 21  4  0  0  0  0
 16 21  4  0  0  0  0
  7  9  1  0  0  0  0
 13 20  4  0  0  0  0
M  CHG  2   2   1  12  -1
M  END
>  <NAME>
ASI21474

>  <IDNUMBER>
BAS 00329358

>  <Activity>
0
$$$$
ASI18740
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.4125    0.0860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0773    0.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2117    0.1805    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.6703    1.4180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0258   -0.6617    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7477    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3922    0.9626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6101    2.2085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3867   -1.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9368    1.8563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3235    0.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0087   -2.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2117   -1.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1141    0.6617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7360    2.0367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3867   -2.8015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6071   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3548    1.4695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2117   -2.8015    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
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 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
 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
 12 16  4  0  0  0  0
 13 17  4  0  0  0  0
 15 18  4  0  0  0  0
 17 19  4  0  0  0  0
  4  7  1  0  0  0  0
 16 19  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI18740

>  <IDNUMBER>
BAS 00314693

>  <Activity>
0
$$$$
ASI15363
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.3923   -0.4159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9801    0.2859    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0891   -0.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1782    0.1188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8391   -1.0396    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.6756   -1.0507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2127   -0.4604    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3515   -0.5496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1200   -0.8910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7772   -0.3713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4456    0.6721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2623    0.2673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6880    0.4456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6732    0.2079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9232    0.7611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2202   -1.7079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3489    0.9207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4936    0.1633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3167    0.9653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5668   -2.2016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0915    0.6089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9614    0.8316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7808    1.6336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6013    1.5890    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
  8  9  4  0  0  0  0
  9 10  4  0  0  0  0
  4 11  2  0  0  0  0
  8 12  4  0  0  0  0
 13 15  4  0  0  0  0
  7 14  1  0  0  0  0
 12 15  4  0  0  0  0
  9 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  4  0  0  0  0
 14 19  4  0  0  0  0
 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
 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI15363

>  <IDNUMBER>
BAS 00285500

>  <Activity>
0
$$$$
ASI22487
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
    0.3750    0.5556    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0464    0.5556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3333    0.1528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0464    1.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7593    0.1528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4676    0.5556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7593    1.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4676    1.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7964   -1.1111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3333   -0.6945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3750    1.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7964   -1.9398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880   -0.6945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3333    1.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3750   -1.1111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880   -2.3612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9537    1.1297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3750   -1.9398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1111    0.1297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2037    0.1297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2037    1.8195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5325   -0.6667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5325   -2.3843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2037    2.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2037   -0.7361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2640   -1.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5325   -3.2223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7547    0.9120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3334    1.5000    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 14  1  0  0  0  0
  2  5  4  0  0  0  0
  5  6  4  0  0  0  0
  4  7  4  0  0  0  0
  7  8  4  0  0  0  0
  9 13  4  0  0  0  0
  3 10  1  0  0  0  0
  1 11  1  0  0  0  0
 12 16  4  0  0  0  0
 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
  6 20  1  0  0  0  0
  8 21  1  0  0  0  0
  9 22  1  0  0  0  0
 12 23  1  0  0  0  0
 21 24  1  0  0  0  0
 20 25  1  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 17 28  1  0  0  0  0
 28 29  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>
ASI22487

>  <IDNUMBER>
BAS 00334922

>  <Activity>
0
$$$$
ASI15427
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -0.7918   -1.0340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3136   -0.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6177   -1.0340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6675    0.3664    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.1021   -0.3726    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4873    0.4316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8412    1.1737    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
  7  8  1  0  0  0  0
  2  9  2  0  0  0  0
  8 10  4  0  0  0  0
  8 11  4  0  0  0  0
  3 12  1  0  0  0  0
 10 13  4  0  0  0  0
 11 14  4  0  0  0  0
  9 15  1  0  0  0  0
 14 16  4  0  0  0  0
 10 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
 13 16  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI15427

>  <IDNUMBER>
BAS 00285724

>  <Activity>
0
$$$$
ASI28843
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.2244   -0.3265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2244    0.5305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4897   -0.7397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1987   -0.3265    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
  3  4  1  0  0  0  0
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  2  6  4  0  0  0  0
  3  7  1  0  0  0  0
  2  8  1  0  0  0  0
  5  9  4  0  0  0  0
  9 10  4  0  0  0  0
  4 11  1  0  0  0  0
  7 12  2  0  0  0  0
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 10 14  1  0  0  0  0
  9 15  1  0  0  0  0
  8 16  1  0  0  0  0
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 13 18  1  0  0  0  0
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 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
  6 10  4  0  0  0  0
  8 11  1  0  0  0  0
 21 22  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI28843

>  <IDNUMBER>
BAS 00386407

>  <Activity>
0
$$$$
ASI30737
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
   -2.2850   -0.6573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5631   -0.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5609    0.6504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8445   -0.6777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8445   -1.4950    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5631   -1.9037    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
  3  5  4  0  0  0  0
  2  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 15  1  0  0  0  0
 11 20  1  0  0  0  0
  6 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
 15 16  1  0  0  0  0
 16 19  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 12 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 13 22  1  0  0  0  0
 14 23  1  0  0  0  0
  4  5  4  0  0  0  0
  6  8  4  0  0  0  0
 22 23  1  0  0  0  0
 11 21  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI30737

>  <IDNUMBER>
BAS 00396341

>  <Activity>
0
$$$$
ASI13602
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    2.6956    0.2548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0329    0.2656    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2 13  1  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  5  9  2  0  0  0  0
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  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
  8  9  1  0  0  0  0
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  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  5 15  1  0  0  0  0
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  2 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 11 20  1  0  0  0  0
 12 21  1  0  0  0  0
  7 10  4  0  0  0  0
  6 19  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI13602

>  <IDNUMBER>
BAS 00266402

>  <Activity>
0
$$$$
ASI25556
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
   -0.4304   -0.6838    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  5  1  0  0  0  0
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  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
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  5 10  4  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
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  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
 16 19  4  0  0  0  0
 14 20  1  0  0  0  0
 18 21  4  0  0  0  0
 17 21  4  0  0  0  0
 13 20  1  0  0  0  0
 15 19  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25556

>  <IDNUMBER>
BAS 00363560

>  <Activity>
0
$$$$
ASI18197
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.8589   -0.3428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 14  4  0  0  0  0
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 13 15  4  0  0  0  0
 11 16  1  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  5  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>
ASI18197

>  <IDNUMBER>
BAS 00312388

>  <Activity>
0
$$$$
ASI20041
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.2338    0.4496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  9  2  0  0  0  0
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 10 12  4  0  0  0  0
 11 13  1  0  0  0  0
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  8 17  4  0  0  0  0
 10 18  4  0  0  0  0
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 16 20  4  0  0  0  0
 15 21  1  0  0  0  0
 17 22  4  0  0  0  0
 22 23  4  0  0  0  0
  3  4  1  0  0  0  0
 19 23  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI20041

>  <IDNUMBER>
BAS 00319486

>  <Activity>
0
$$$$
ASI30169
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
    2.5607   -0.6138    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
  3 14  1  0  0  0  0
  1  4  1  0  0  0  0
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  6 13  4  0  0  0  0
 14 18  4  0  0  0  0
  8 15  4  0  0  0  0
  8 16  4  0  0  0  0
 13 17  4  0  0  0  0
 15 18  4  0  0  0  0
 16 19  4  0  0  0  0
 10 20  4  0  0  0  0
 10 21  4  0  0  0  0
 13 22  1  0  0  0  0
 12 23  1  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
 12 17  4  0  0  0  0
 14 19  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30169

>  <IDNUMBER>
BAS 00393750

>  <Activity>
0
$$$$
ASI643
  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
  2  6  4  0  0  0  0
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  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
  5 15  1  0  0  0  0
 10 16  1  0  0  0  0
  9 17  1  0  0  0  0
 13 18  1  0  0  0  0
 19 22  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
 20 22  1  0  0  0  0
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 19 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
  6  7  4  0  0  0  0
  4  9  4  0  0  0  0
 17 21  1  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1  19   1
M  END
>  <NAME>
ASI643

>  <IDNUMBER>
BAS 00024547

>  <Activity>
0
$$$$
ASI1247
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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  2  6  1  0  0  0  0
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  3  4  1  0  0  0  0
  1  5  2  0  0  0  0
  4  6  1  0  0  0  0
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  2 10  1  0  0  0  0
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 13 17  1  0  0  0  0
  4 14  1  0  0  0  0
 11 15  1  0  0  0  0
 10 16  1  0  0  0  0
  9 17  1  0  0  0  0
  7 18  4  0  0  0  0
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 13 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
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
 22 26  4  0  0  0  0
  8 15  1  0  0  0  0
 24 27  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI1247

>  <IDNUMBER>
BAS 00068940

>  <Activity>
0
$$$$
1odc_A8B
  Marvin  04201014582D          

 34 38  0  0  0  0            999 V2000
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 17 18  4  0  0  0  0
 18 19  4  0  0  0  0
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 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 30  4  0  0  0  0
 25 26  4  0  0  0  0
 26 27  4  0  0  0  0
 27 28  4  0  0  0  0
 28 29  4  0  0  0  0
 29 34  4  0  0  0  0
 29 30  4  0  0  0  0
 30 31  4  0  0  0  0
 31 32  4  0  0  0  0
 32 33  4  0  0  0  0
 33 34  4  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
1odc_A8B

$$$$
ASI27134
  Marvin  04201015132D          

 29 33  0  0  0  0            999 V2000
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  1  5  4  0  0  0  0
  6  7  4  0  0  0  0
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  4  8  1  0  0  0  0
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  3 10  1  0  0  0  0
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 12 14  1  0  0  0  0
  3 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 13 20  4  0  0  0  0
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 16 22  4  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
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 27 28  4  0  0  0  0
 24 29  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
 23 29  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI27134

>  <IDNUMBER>
BAS 00371652

>  <Activity>
0
$$$$
ASI24693
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
  2  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
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
  7  9  4  0  0  0  0
 10 11  4  0  0  0  0
  6 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
  5 15  1  0  0  0  0
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 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 10 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 18  1  0  0  0  0
  4 10  4  0  0  0  0
  8  9  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI24693

>  <IDNUMBER>
BAS 00347795

>  <Activity>
0
$$$$
ASI27446
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
   -0.0039    0.4279    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0039   -0.4124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2680   -0.0039    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 10 15  4  0  0  0  0
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 13 17  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  6  2  0  0  0  0
  4  7  1  0  0  0  0
 17 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI27446

>  <IDNUMBER>
BAS 00380029

>  <Activity>
0
$$$$
ASI31879
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
    2.4484   -0.7333    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4335    0.9055    0.0000 S   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  4  0  0  0  0
  1  4  4  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  7 12  4  0  0  0  0
  8 16  1  0  0  0  0
  5  9  4  0  0  0  0
  5 10  4  0  0  0  0
 10 11  4  0  0  0  0
  9 12  4  0  0  0  0
  3 13  4  0  0  0  0
  4 14  4  0  0  0  0
  1 15  1  0  0  0  0
 14 16  1  0  0  0  0
  7 17  1  0  0  0  0
 13 18  4  0  0  0  0
  3 19  1  0  0  0  0
 17 20  1  0  0  0  0
 17 21  1  0  0  0  0
 14 18  4  0  0  0  0
  7 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI31879

>  <IDNUMBER>
BAS 00403824

>  <Activity>
0
$$$$
ASI25633
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 13 20  1  0  0  0  0
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 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 13 21  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>
ASI25633

>  <IDNUMBER>
BAS 00363935

>  <Activity>
0
$$$$
ASI16020
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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   -4.2950    0.9988    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8671   -0.6622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2802    0.9877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3 11  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  1  6  2  0  0  0  0
  7 10  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  1 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
  7 13  1  0  0  0  0
 14 19  4  0  0  0  0
 14 15  1  0  0  0  0
 13 16  4  0  0  0  0
 13 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
  3 20  1  0  0  0  0
 14 18  4  0  0  0  0
  3 12  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI16020

>  <IDNUMBER>
BAS 00288379

>  <Activity>
0
$$$$
ASI24687
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
    0.7779   -1.4045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2753   -2.0642    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2753   -0.7284    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0559   -1.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0559   -1.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4837   -0.7119    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0549   -1.4045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3193   -0.7119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1237    1.4485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7705   -2.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5479   -1.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4210    3.5566    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
  6  7  1  0  0  0  0
  1  7  1  0  0  0  0
  6  8  1  0  0  0  0
  9 12  1  0  0  0  0
  9 10  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
  4 13  4  0  0  0  0
  5 14  4  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
 10 17  4  0  0  0  0
 10 18  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
 15 22  1  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 22 25  1  0  0  0  0
 24 26  4  0  0  0  0
  4  5  4  0  0  0  0
 19 20  4  0  0  0  0
 21 25  1  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   6   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>
ASI24687

>  <IDNUMBER>
BAS 00347692

>  <Activity>
0
$$$$
ASI3319
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
    1.5900    1.6495    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8922    2.0658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4196    0.8763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6107    0.7930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2934    1.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3394    1.9707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6067   -0.6226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1982    0.0912    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6265   -1.3323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8168    2.8549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4315   -0.6226    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.9707    0.2498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1982   -1.3323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5132   -2.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3577   -2.0936    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0056    1.4869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4346    2.7795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7788    1.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8620    2.6487    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
  7  8  1  0  0  0  0
  4  8  1  0  0  0  0
  9 13  1  0  0  0  0
  2 10  2  0  0  0  0
  7 11  2  0  0  0  0
  3 12  2  0  0  0  0
  7 13  1  0  0  0  0
 14 18  4  0  0  0  0
 14 15  1  0  0  0  0
  6 16  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
  9 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  4  0  0  0  0
 20 22  4  0  0  0  0
  6 23  4  0  0  0  0
 15 24  1  0  0  0  0
 15 25  1  0  0  0  0
 16 26  1  0  0  0  0
 16 27  4  0  0  0  0
 23 28  4  0  0  0  0
 28 29  4  0  0  0  0
  4  5  1  0  0  0  0
 27 29  4  0  0  0  0
 14 17  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3319

>  <IDNUMBER>
BAS 00105078

>  <Activity>
0
$$$$
ASI22327
  Marvin  04201015132D          

 19 21  0  0  1  0            999 V2000
   -1.1393    0.5893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4161    0.1915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4322    0.1915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5879   -0.6090    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2750    0.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1393   -1.0607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8465    0.1915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1232    0.5893    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7089    0.6138    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8465   -0.6335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4322   -0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9821    0.2160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2750    1.4388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3884   -0.7071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7125    0.0245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  9  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3  5  1  0  0  0  0
  6 11  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 12  1  0  0  0  0
  7 10  4  0  0  0  0
  3 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  2  0  0  0  0
  4 14  1  0  0  0  0
  8 15  1  0  0  0  0
  7 16  4  0  0  0  0
 10 17  4  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
  6 10  1  0  0  0  0
 17 19  4  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI22327

>  <IDNUMBER>
BAS 00334030

>  <Activity>
0
$$$$
ASI5038
  Marvin  04201015132D          

 16 17  0  0  1  0            999 V2000
    0.1375    0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8176   -0.1264    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6355    0.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4939    0.3753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4051    1.1557    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7990   -0.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2892    0.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2709    0.6317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5720   -0.9848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2263    1.1557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9135    0.7024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2148   -0.4571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1746   -1.2412    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.0587    0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3969   -0.6615    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.9841   -0.7358    0.0000 Cl  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  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
  5 10  1  0  0  0  0
  7 11  2  0  0  0  0
 12 14  4  0  0  0  0
  6 13  1  0  0  0  0
  8 14  4  0  0  0  0
  7 15  1  0  0  0  0
 12 16  1  0  0  0  0
  4 10  1  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  2   2   1  15  -1
M  END
>  <NAME>
ASI5038

>  <IDNUMBER>
BAS 00126116

>  <Activity>
0
$$$$
ASI30197
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
   -1.2241    1.0865    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.4068   -0.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4608   -0.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6653   -0.5914    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1358   -1.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4332   -0.9559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1896    0.2613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4757   -0.0962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6750    1.0865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9805    1.5197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9903   -0.9214    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2666    0.0962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2958   -1.3547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7123   -1.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1210   -1.3892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4040    1.4854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6750    0.2339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5295    1.5197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5003    0.8595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9462   -0.1581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3697   -0.1581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1112    1.2515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9365    1.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9462   -0.9903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3352   -0.9903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6750   -1.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 14  1  0  0  0  0
  3  7  4  0  0  0  0
  4  5  4  0  0  0  0
  2  5  4  0  0  0  0
  3  6  1  0  0  0  0
  1  7  4  0  0  0  0
  2  8  4  0  0  0  0
  9 10  1  0  0  0  0
  1 10  1  0  0  0  0
 11 13  1  0  0  0  0
  8 12  4  0  0  0  0
  6 13  1  0  0  0  0
 11 14  2  0  0  0  0
  6 15  2  0  0  0  0
  9 16  2  0  0  0  0
  9 17  1  0  0  0  0
  1 18  4  0  0  0  0
 19 20  4  0  0  0  0
 18 20  4  0  0  0  0
  8 21  4  0  0  0  0
 12 22  4  0  0  0  0
 17 23  4  0  0  0  0
 17 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 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 19  4  0  0  0  0
 27 29  4  0  0  0  0
  4 12  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  1   1   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>
ASI30197

>  <IDNUMBER>
BAS 00393978

>  <Activity>
0
$$$$
ASI18165
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    2.1515   -0.3660    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1585   -0.3144    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7320    0.4974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1468    0.4974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4546   -0.7320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4288   -0.7719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1515    0.4622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7179    0.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4335    0.9127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7391   -0.3308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7179   -0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0482   -1.3233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1515    1.2881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0459   -1.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1228    0.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0154    1.3021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  4  2  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
  9 12  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
  7 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
  5 21  1  0  0  0  0
  9 13  1  0  0  0  0
  2  6  1  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI18165

>  <IDNUMBER>
BAS 00312234

>  <Activity>
0
$$$$
ASI14899
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
   -0.0088   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8971    0.4653    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.4903    1.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4903   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3951    0.4653    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2378    0.4653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8516   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6475    1.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6475   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3951   -0.9832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0338    0.1141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0192    0.8486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2583   -0.9832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2583    0.4653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7281    0.4653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8516   -1.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8516    1.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1011   -0.9832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2583    1.8963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5108   -1.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2583   -2.4142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5108    1.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1011    1.8963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1011   -2.4142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  1 10  2  0  0  0  0
  4 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  2 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
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 20 24  4  0  0  0  0
 22 25  4  0  0  0  0
  2  4  1  0  0  0  0
 11 12  1  0  0  0  0
 21 25  4  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI14899

>  <IDNUMBER>
BAS 00282563

>  <Activity>
0
$$$$
ASI10850
  Marvin  04201015132D          

 15 16  0  0  0  0            999 V2000
    0.4718    0.6111    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5257   -0.4044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3235    0.3954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3299   -0.6290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6579    1.7523    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9230   -0.0539    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.2561    1.4063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2715    0.3954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2561   -0.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0539   -0.9839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8402    1.9949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8736    0.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5321   -1.4288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1528   -1.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9390   -2.0084    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  4  0  0  0  0
  5 12  1  0  0  0  0
  4  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2 10  4  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  4 13  4  0  0  0  0
 10 14  4  0  0  0  0
 14 15  4  0  0  0  0
  5 11  1  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10850

>  <IDNUMBER>
BAS 00226278

>  <Activity>
0
$$$$
ASI24644
  Marvin  04201015132D          

 32 35  0  0  1  0            999 V2000
   -0.6709    0.5294    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6709   -0.9016    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2516   -0.1783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4886   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4886    0.5294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9080   -0.1783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5085   -0.4665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2726   -1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2726    1.2476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9342   -0.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1532    0.0786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0861   -1.0168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5893    0.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6552   -1.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6290   -2.3640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5504    1.3105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7204   -0.1783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4571   -1.5568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4950    1.1375    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.9080   -1.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9080    1.2370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8724   -1.2947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5504   -1.6826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1397    0.5294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1397   -0.9016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1660    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6144    2.3377    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
  1  5  1  0  0  0  0
  5  6  4  0  0  0  0
  3  7  1  0  0  0  0
  2  8  1  0  0  0  0
  1  9  1  0  0  0  0
 10 11  4  0  0  0  0
  7 11  4  0  0  0  0
 12 18  4  0  0  0  0
 10 13  1  0  0  0  0
  7 14  4  0  0  0  0
  8 15  2  0  0  0  0
  9 16  2  0  0  0  0
  6 17  4  0  0  0  0
 14 18  4  0  0  0  0
 13 19  1  0  0  0  0
  4 20  4  0  0  0  0
  5 21  4  0  0  0  0
 12 22  1  0  0  0  0
  8 23  1  0  0  0  0
  9 24  1  0  0  0  0
 20 25  4  0  0  0  0
 21 26  4  0  0  0  0
 26 27  4  0  0  0  0
 17 28  4  0  0  0  0
 19 29  1  0  0  0  0
 19 30  1  0  0  0  0
 29 31  1  0  0  0  0
 30 32  1  0  0  0  0
  4  6  4  0  0  0  0
 17 27  4  0  0  0  0
 25 28  4  0  0  0  0
 10 12  4  0  0  0  0
M  CHG  2   1   1  19   1
M  END
>  <NAME>
ASI24644

>  <IDNUMBER>
BAS 00347367

>  <Activity>
0
$$$$
ASI15803
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.3813    0.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0137    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7031   -0.7212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6102    0.3218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8805    1.3869    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6072   -0.7212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4493    1.1206    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0817    1.6752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2134   -0.2108    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0277   -0.2108    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7988    0.0832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4478   -0.4770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0344   -1.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8513   -0.7655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6223   -0.4770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1453    0.8764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7833    0.3218    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  4  0  0  0  0
  2  6  4  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  8  9  4  0  0  0  0
 10 13  1  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  7 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
  3  7  4  0  0  0  0
  6  9  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15803

>  <IDNUMBER>
BAS 00287782

>  <Activity>
0
$$$$
ASI20026
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.2973    1.0312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6039    0.2926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5109    1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7339    0.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0047   -0.2183    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7804    1.7326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5421    0.0139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6212    1.7187    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3982    0.0975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0451    1.6861    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7651   -0.7757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2701    1.6304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2077   -1.3656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4306   -2.1460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8547   -2.8010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0949    2.3690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8241   -1.7698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6012   -0.9755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9171    2.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2110   -2.3503    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
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M  CHG  1   8   1
M  END
>  <NAME>
ASI20026

>  <IDNUMBER>
BAS 00319440

>  <Activity>
0
$$$$
1e3q_EBW
  Marvin  04201014582D          

 30 31  0  0  0  0            999 V2000
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 29 30  4  0  0  0  0
M  CHG  2   2   1  23   1
M  END
>  <Activity>
1

>  <PDB_ID>
1e3q_EBW

$$$$
ASI21792
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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 27 28  4  0  0  0  0
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 15 24  1  0  0  0  0
 16 27  4  0  0  0  0
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M  CHG  1  10   1
M  END
>  <NAME>
ASI21792

>  <IDNUMBER>
BAS 00331459

>  <Activity>
0
$$$$
ASI21696
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
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 22 24  4  0  0  0  0
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M  CHG  1   8   1
M  END
>  <NAME>
ASI21696

>  <IDNUMBER>
BAS 00330759

>  <Activity>
0
$$$$
ASI21783
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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 11 17  4  0  0  0  0
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M  CHG  1   6   1
M  END
>  <NAME>
ASI21783

>  <IDNUMBER>
BAS 00331440

>  <Activity>
0
$$$$
ASI30196
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 18 21  4  0  0  0  0
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 19 22  4  0  0  0  0
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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>
ASI30196

>  <IDNUMBER>
BAS 00393927

>  <Activity>
0
$$$$
ASI23362
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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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
  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
  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>
ASI23362

>  <IDNUMBER>
BAS 00340745

>  <Activity>
0
$$$$
ASI12562
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -0.0060    0.6265    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7329    1.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7033    1.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4244   -0.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7329    1.8380    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  1  0  0  0  0
  5  7  4  0  0  0  0
  8  9  1  0  0  0  0
  3  9  1  0  0  0  0
  2 10  1  0  0  0  0
  6 11  4  0  0  0  0
  6 12  4  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
  5 15  4  0  0  0  0
  8 16  4  0  0  0  0
  8 17  4  0  0  0  0
  7 18  4  0  0  0  0
 19 21  4  0  0  0  0
 11 20  4  0  0  0  0
 12 21  4  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
 18 25  4  0  0  0  0
 24 26  4  0  0  0  0
  4  7  4  0  0  0  0
 19 20  4  0  0  0  0
 22 25  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI12562

>  <IDNUMBER>
BAS 00253434

>  <Activity>
0
$$$$
ASI15375
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.0317    1.2113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2886    1.5543    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1252    0.2232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2886    0.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9255    0.3702    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.2096   -0.5308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7611    1.6059    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.3610   -1.3555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1078    1.0588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4797    1.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1694   -1.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4797    0.3402    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
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  4 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
  8 13  1  0  0  0  0
 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
 12 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
 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
  3  4  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI15375

>  <IDNUMBER>
BAS 00285528

>  <Activity>
0
$$$$
ASI23401
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
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    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
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  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
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  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 24  1  0  0  0  0
 11 15  4  0  0  0  0
 16 18  4  0  0  0  0
  8 17  4  0  0  0  0
  7 18  4  0  0  0  0
 16 19  1  0  0  0  0
 15 20  1  0  0  0  0
 12 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
  2  3  4  0  0  0  0
 15 17  4  0  0  0  0
 10 16  4  0  0  0  0
 14 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI23401

>  <IDNUMBER>
BAS 00340849

>  <Activity>
0
$$$$
ASI361
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
    0.2388   -0.2388    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  4  1  0  0  0  0
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  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  3  9  4  0  0  0  0
  8 10  1  0  0  0  0
  4 11  1  0  0  0  0
 10 12  2  0  0  0  0
 10 13  1  0  0  0  0
  6 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
 16 18  1  0  0  0  0
 14 19  4  0  0  0  0
 15 20  4  0  0  0  0
  6  9  4  0  0  0  0
  7  8  1  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  2   5   1  13  -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>
ASI361

>  <IDNUMBER>
BAS 00012706

>  <Activity>
0
$$$$
ASI22941
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
    0.1842   -1.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9907    3.2210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2111   -0.2240    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
  4  5  4  0  0  0  0
  2  6  4  0  0  0  0
  3  7  1  0  0  0  0
  8  9  1  0  0  0  0
  7  9  1  0  0  0  0
  5 10  4  0  0  0  0
  3 11  2  0  0  0  0
  8 12  1  0  0  0  0
  6 13  4  0  0  0  0
 12 14  1  0  0  0  0
 10 15  4  0  0  0  0
 13 16  4  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
 14 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
  5  6  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI22941

>  <IDNUMBER>
BAS 00337804

>  <Activity>
0
$$$$
ASI23020
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.9150   -0.5376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356    0.7205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9150    0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356   -0.9493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3789   -0.5376    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3789    0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356    1.5440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5033   -0.5376    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2116   -0.9493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356    2.3960    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2116    0.7205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356   -1.8071    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.0938    0.7491    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5033    0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2466   -0.9836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9671   -0.5376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6705   -0.9493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6705    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3854   -0.5376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3854    0.2859    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
  5  6  4  0  0  0  0
  2  7  1  0  0  0  0
  8  9  1  0  0  0  0
  1  9  1  0  0  0  0
  7 10  3  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  6 13  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 20 21  4  0  0  0  0
 11 14  1  0  0  0  0
  2  6  4  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  2   8   1  12  -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>
ASI23020

>  <IDNUMBER>
BAS 00338368

>  <Activity>
0
$$$$
ASI7908
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.8172    1.3040    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.3384    0.6324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8172   -0.0390    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6008    1.0541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6008    0.2343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4815    0.6324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5518   -0.8172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0958   -1.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8980   -0.1015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7362   -0.1015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5518    2.1005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8922   -1.2546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1343    0.6324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8459   -2.1942    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3139    1.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3139   -0.1848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7231    1.3353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1343   -0.8172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9725    0.6324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0339   -2.3504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1187    2.0458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0245    1.0541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0245    0.2343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2447   -3.1286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3706   -0.1015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9725   -0.8172    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
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
  1 11  1  0  0  0  0
  8 12  2  0  0  0  0
 10 13  4  0  0  0  0
  8 14  1  0  0  0  0
  4 15  4  0  0  0  0
  5 16  4  0  0  0  0
 13 17  1  0  0  0  0
 10 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 20  1  0  0  0  0
 17 21  1  0  0  0  0
 15 22  4  0  0  0  0
 22 23  4  0  0  0  0
 20 24  1  0  0  0  0
 25 26  4  0  0  0  0
 18 26  4  0  0  0  0
  3  5  4  0  0  0  0
 16 23  4  0  0  0  0
 19 25  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI7908

>  <IDNUMBER>
BAS 00160632

>  <Activity>
0
$$$$
ASI3701
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
   -0.5104    0.6085    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6989   -0.2238    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3180    0.7734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1503    1.1150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0942   -0.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2984   -2.1672    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1503    1.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6753    1.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2827   -1.6019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6949   -0.5654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3180    2.2693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5104    2.4499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8688    0.7027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7696    0.0942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0914   -1.9199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1100   -2.9564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5076    1.5665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8688    2.3635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6019    0.1727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5834    1.1150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6765   -2.4852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -3.5021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9592    0.8912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5834    1.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4880   -3.2784    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
  2  5  1  0  0  0  0
  6  9  1  0  0  0  0
  4  7  4  0  0  0  0
  3  8  4  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  8 11  1  0  0  0  0
  7 12  1  0  0  0  0
  4 13  4  0  0  0  0
  3 14  4  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  8 17  4  0  0  0  0
  7 18  4  0  0  0  0
 14 19  4  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
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 22 25  1  0  0  0  0
 11 12  1  0  0  0  0
 17 23  4  0  0  0  0
 18 24  4  0  0  0  0
 21 25  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI3701

>  <IDNUMBER>
BAS 00110619

>  <Activity>
0
$$$$
ASI11231
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    0.6719   -0.7709    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.9164   -0.0588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3436    0.6470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0866   -0.0588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5912   -0.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1640   -0.7863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4271   -0.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9257    1.3435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1795    0.6470    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8390    0.6409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0866   -1.4860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3219   -0.7709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1919    0.6409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9164   -1.4860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5912    1.3528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8390   -0.7863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4271    1.3528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6716    0.6409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0742   -0.0743    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
  5  7  4  0  0  0  0
  3  8  2  0  0  0  0
  3  9  1  0  0  0  0
  7 10  4  0  0  0  0
  1 11  4  0  0  0  0
 12 14  4  0  0  0  0
  5 13  4  0  0  0  0
 11 14  4  0  0  0  0
 13 15  4  0  0  0  0
  7 16  4  0  0  0  0
 15 17  4  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
  2 12  4  0  0  0  0
 10 17  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI11231

>  <IDNUMBER>
BAS 00229897

>  <Activity>
0
$$$$
ASI12605
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.8791    0.6680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2080    1.1501    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2111   -0.1197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4664    0.6774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6333   -0.1355    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6795    0.9232    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.2856    0.9579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5566   -0.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3003    0.3749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1762   -0.1985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9797   -0.0252    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8055    0.2237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6153    0.4065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1006    0.6207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1332   -0.4254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7150    0.0724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7382   -0.9863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5354   -0.7531    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
  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
  6 10  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
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 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>
ASI12605

>  <IDNUMBER>
BAS 00253546

>  <Activity>
0
$$$$
ASI20027
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.6207    0.0316    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8995   -0.7285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2026    0.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4434   -0.7855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2534   -1.2415    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0767    0.7347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2035   -0.9627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8938    0.5827    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.7418   -0.9375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7157    0.6715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.3927    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
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  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
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 12 19  1  0  0  0  0
 11 13  4  0  0  0  0
 13 14  4  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
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  4  0  0  0  0
 14 22  1  0  0  0  0
  4  5  1  0  0  0  0
 12 20  1  0  0  0  0
 14 21  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI20027

>  <IDNUMBER>
BAS 00319441

>  <Activity>
0
$$$$
ASI15382
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
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  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 20  1  0  0  0  0
 13 17  4  0  0  0  0
 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
 19 20  1  0  0  0  0
 18 21  1  0  0  0  0
 13 22  1  0  0  0  0
  4  5  1  0  0  0  0
 12 21  1  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15382

>  <IDNUMBER>
BAS 00285543

>  <Activity>
0
$$$$
ASI33354
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    0.5075   -0.8702    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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  8 10  1  0  0  0  0
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 10 14  1  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
 13 18  4  0  0  0  0
 16 19  1  0  0  0  0
  5  6  4  0  0  0  0
 17 18  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>
ASI33354

>  <IDNUMBER>
BAS 00411366

>  <Activity>
0
$$$$
ASI2805
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.8905   -1.1524    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
  2  3  4  0  0  0  0
  1  4  4  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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 18 19  4  0  0  0  0
 17 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  5  4  0  0  0  0
  7 15  4  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI2805

>  <IDNUMBER>
BAS 00100027

>  <Activity>
0
$$$$
ASI7803
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
   -2.4070   -0.4518    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3778    0.3216    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  6  1  0  0  0  0
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  5  8  1  0  0  0  0
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 10 14  2  0  0  0  0
 10 15  1  0  0  0  0
 15 16  4  0  0  0  0
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 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
  4  5  1  0  0  0  0
  2  3  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI7803

>  <IDNUMBER>
BAS 00160203

>  <Activity>
0
$$$$
ASI6544
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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   -0.1389   -0.0550    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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  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
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  1 10  1  0  0  0  0
  7 11  1  0  0  0  0
  6 12  1  0  0  0  0
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 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
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 13 17  1  0  0  0  0
 15 18  4  0  0  0  0
 14 19  4  0  0  0  0
 19 20  4  0  0  0  0
  2  6  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI6544

>  <IDNUMBER>
BAS 00138182

>  <Activity>
0
$$$$
ASI22606
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    0.8554   -0.4254    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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  8  9  4  0  0  0  0
  6 10  1  0  0  0  0
  9 11  4  0  0  0  0
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 10 13  4  0  0  0  0
  8 14  4  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
  9 18  1  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
 18 22  1  0  0  0  0
 19 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>
ASI22606

>  <IDNUMBER>
BAS 00336162

>  <Activity>
0
$$$$
ASI10833
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4 11  1  0  0  0  0
  2  5  4  0  0  0  0
  1  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
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 12 15  1  0  0  0  0
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 13 15  1  0  0  0  0
  2 16  4  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
  5 19  4  0  0  0  0
 17 20  4  0  0  0  0
 17 21  4  0  0  0  0
 16 22  4  0  0  0  0
 22 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  4 10  1  0  0  0  0
 19 23  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI10833

>  <IDNUMBER>
BAS 00226231

>  <Activity>
0
$$$$
ASI16213
  Marvin  04201015132D          

 20 23  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  5  9  1  0  0  0  0
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  3 10  1  0  0  0  0
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 15 17  4  0  0  0  0
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 12 17  4  0  0  0  0
  5 18  1  0  0  0  0
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 15 20  1  0  0  0  0
  6 11  1  0  0  0  0
  5 10  1  0  0  0  0
  5 14  1  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI16213

>  <IDNUMBER>
BAS 00289191

>  <Activity>
0
$$$$
ASI10536
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
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  6  8  1  0  0  0  0
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 10 18  1  0  0  0  0
  8 11  1  0  0  0  0
  3 12  4  0  0  0  0
  2 13  4  0  0  0  0
  4 14  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
 10 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10536

>  <IDNUMBER>
BAS 00221465

>  <Activity>
0
$$$$
ASI6095
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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 16 18  1  0  0  0  0
 17 20  1  0  0  0  0
 18 22  4  0  0  0  0
 17 19  1  0  0  0  0
 16 20  1  0  0  0  0
 14 21  4  0  0  0  0
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 17 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 10 26  1  0  0  0  0
  7 11  1  0  0  0  0
  6 13  1  0  0  0  0
  6 12  1  0  0  0  0
 18 21  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI6095

>  <IDNUMBER>
BAS 00134220

>  <Activity>
0
$$$$
ASI3113
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
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 11 17  1  0  0  0  0
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 20 23  4  0  0  0  0
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 22 23  4  0  0  0  0
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 10 18  1  0  0  0  0
  9 17  1  0  0  0  0
  9 19  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI3113

>  <IDNUMBER>
BAS 00102736

>  <Activity>
0
$$$$
ASI22667
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.5382    0.7262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6413    1.5511    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
  1  5  1  0  0  0  0
  6  9  4  0  0  0  0
  3  7  2  0  0  0  0
  1  8  2  0  0  0  0
  9 12  4  0  0  0  0
 10 13  4  0  0  0  0
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  4 14  2  0  0  0  0
  9 15  1  0  0  0  0
  6 16  1  0  0  0  0
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 10 18  1  0  0  0  0
 17 19  4  0  0  0  0
 17 20  4  0  0  0  0
 18 21  1  0  0  0  0
 20 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
  6 10  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22667

>  <IDNUMBER>
BAS 00336311

>  <Activity>
0
$$$$
ASI4789
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.2382    0.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9497    0.0774    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  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
  9 10  4  0  0  0  0
  9 11  4  0  0  0  0
 12 17  4  0  0  0  0
 13 18  1  0  0  0  0
  5 14  1  0  0  0  0
  7 15  1  0  0  0  0
 11 16  4  0  0  0  0
 10 17  4  0  0  0  0
  4 18  1  0  0  0  0
 12 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>
ASI4789

>  <IDNUMBER>
BAS 00123864

>  <Activity>
0
$$$$
ASI7041
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
   -0.5851    0.1482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5851   -0.6827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0129    0.1482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9803    0.5617    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.2990    1.3770    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  4  4  0  0  0  0
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  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
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  4 13  1  0  0  0  0
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 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
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 13 21  1  0  0  0  0
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 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
 15 25  4  0  0  0  0
 21 26  1  0  0  0  0
  5  6  4  0  0  0  0
 22 25  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7041

>  <IDNUMBER>
BAS 00141394

>  <Activity>
0
$$$$
ASI12613
  Marvin  04201015132D          

 15 16  0  0  0  0            999 V2000
   -1.3014    0.9885    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9743    0.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7723    1.0467    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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    1.0246   -1.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0879   -0.3406    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
  3  6  2  0  0  0  0
  2  7  2  0  0  0  0
  4  8  2  0  0  0  0
  6  9  1  0  0  0  0
  9 10  4  0  0  0  0
 10 11  4  0  0  0  0
 11 12  1  0  0  0  0
 13 14  4  0  0  0  0
  9 14  4  0  0  0  0
 13 15  4  0  0  0  0
  3  5  1  0  0  0  0
 11 15  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI12613

>  <IDNUMBER>
BAS 00253573

>  <Activity>
0
$$$$
ASI27028
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
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  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
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 13 17  1  0  0  0  0
  5 14  4  0  0  0  0
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 12 16  1  0  0  0  0
 16 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
 13 21  1  0  0  0  0
 22 23  4  0  0  0  0
 14 23  4  0  0  0  0
 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 18 26  4  0  0  0  0
 19 27  4  0  0  0  0
 26 28  4  0  0  0  0
  4  6  4  0  0  0  0
 15 22  4  0  0  0  0
 27 28  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI27028

>  <IDNUMBER>
BAS 00370454

>  <Activity>
0
$$$$
ASI2128
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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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
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  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
 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
 19 24  4  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
  5  6  1  0  0  0  0
 22 26  4  0  0  0  0
 24 25  4  0  0  0  0
 12 13  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI2128

>  <IDNUMBER>
BAS 00090306

>  <Activity>
0
$$$$
ASI27151
  Marvin  04201015132D          

 27 29  0  0  0  0            999 V2000
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    0.9356   -0.6985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2015    2.2012    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4870    1.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6242    3.0215    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4063   -0.6985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4063   -1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1176   -1.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9096   -0.6985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9096   -1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8353   -1.5508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1176   -0.2755    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
 12 19  1  0  0  0  0
  2 13  1  0  0  0  0
  4 14  4  0  0  0  0
  5 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
  7 18  4  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 13 21  1  0  0  0  0
 15 22  1  0  0  0  0
 22 23  1  0  0  0  0
 14 24  4  0  0  0  0
 24 25  4  0  0  0  0
 23 26  1  0  0  0  0
 21 27  1  0  0  0  0
  3  7  4  0  0  0  0
 18 25  4  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27151

>  <IDNUMBER>
BAS 00371689

>  <Activity>
0
$$$$
ASI2127
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
   -0.7140    0.4189    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8187    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7140   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7044   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4279   -0.8187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7044    2.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7140    2.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8654   -1.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  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
  3  7  1  0  0  0  0
  4  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
  7 12  4  0  0  0  0
  7 13  4  0  0  0  0
  9 14  4  0  0  0  0
  9 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  0  0  0  0
 10 18  4  0  0  0  0
 11 19  4  0  0  0  0
 12 20  4  0  0  0  0
 13 21  4  0  0  0  0
 16 22  4  0  0  0  0
 19 23  4  0  0  0  0
 21 24  4  0  0  0  0
  5  6  1  0  0  0  0
 20 24  4  0  0  0  0
 18 23  4  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI2127

>  <IDNUMBER>
BAS 00090305

>  <Activity>
0
$$$$
ASI31856
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
    1.0377   -0.6434    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5656   -1.3283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5396   -0.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2283   -1.0949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2283   -0.2699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0326    0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8976   -0.4566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2854    0.3995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6656   -0.2699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9754    0.8302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6656   -1.0949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8679   -0.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -2.0911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7680    0.7731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2363    0.1504    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4411    0.8302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3919    0.1504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0562    0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4411    1.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1132   -0.2699    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
  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
  2 13  2  0  0  0  0
  3 14  2  0  0  0  0
 12 15  1  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
 15 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
 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
  4  5  1  0  0  0  0
  9 11  4  0  0  0  0
  8 10  4  0  0  0  0
 23 25  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI31856

>  <IDNUMBER>
BAS 00403650

>  <Activity>
0
$$$$
ASI16225
  Marvin  04201015132D          

 19 21  0  0  1  0            999 V2000
   -0.3815   -0.1272    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0518    1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7186   -0.1272    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
  3  5  1  0  0  0  0
  4 11  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  3 10  1  0  0  0  0
  2 11  1  0  0  0  0
  9 12  4  0  0  0  0
 12 13  4  0  0  0  0
 13 14  1  0  0  0  0
  2 15  1  0  0  0  0
  3 16  1  0  0  0  0
 17 18  4  0  0  0  0
  9 18  4  0  0  0  0
 17 19  4  0  0  0  0
  3  7  1  0  0  0  0
  4 10  1  0  0  0  0
 13 19  4  0  0  0  0
M  CHG  2   1   1   4   1
M  END
>  <NAME>
ASI16225

>  <IDNUMBER>
BAS 00289320

>  <Activity>
0
$$$$
ASI31746
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  9 14  2  0  0  0  0
 13 15  1  0  0  0  0
  4 16  4  0  0  0  0
  5 17  4  0  0  0  0
  8 18  4  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 13 21  4  0  0  0  0
 22 24  4  0  0  0  0
 18 23  4  0  0  0  0
 17 24  4  0  0  0  0
 20 25  1  0  0  0  0
 19 26  1  0  0  0  0
 23 27  4  0  0  0  0
 25 28  1  0  0  0  0
  2  4  1  0  0  0  0
 16 22  4  0  0  0  0
 26 28  1  0  0  0  0
 21 27  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI31746

>  <IDNUMBER>
BAS 00403048

>  <Activity>
0
$$$$
ASI21328
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
   -1.7661    0.7666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0495   -0.3861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9927    0.0511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  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
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  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
 15 25  1  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
  3  5  1  0  0  0  0
 27 28  4  0  0  0  0
  2  6  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI21328

>  <IDNUMBER>
BAS 00328661

>  <Activity>
0
$$$$
ASI24271
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.7085   -0.2673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4107    0.9571    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  4  0  0  0  0
  1  5  2  0  0  0  0
  2  6  4  0  0  0  0
  7 11  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  4  0  0  0  0
  6 10  4  0  0  0  0
  5 11  1  0  0  0  0
 10 12  4  0  0  0  0
  8 13  1  0  0  0  0
  7 14  2  0  0  0  0
  7 15  1  0  0  0  0
 10 16  1  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
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
  4 13  1  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24271

>  <IDNUMBER>
BAS 00345157

>  <Activity>
0
$$$$
ASI60
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    1.4233   -0.5230    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8850    0.7040    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6042    0.2816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2767    0.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6889   -1.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1717   -1.8506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3636    0.6285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8348   -2.6001    0.0000 O   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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  1  4  4  0  0  0  0
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  4  6  4  0  0  0  0
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  2  9  1  0  0  0  0
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  1 13  1  0  0  0  0
  3 14  1  0  0  0  0
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 15 17  1  0  0  0  0
 16 18  4  0  0  0  0
 16 19  4  0  0  0  0
 13 20  1  0  0  0  0
 18 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  2  5  4  0  0  0  0
 10 11  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI60

>  <IDNUMBER>
BAS 00004279

>  <Activity>
0
$$$$
ASI10929
  Marvin  04201015132D          

 19 19  0  0  1  0            999 V2000
    0.2130    1.3563    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2130   -0.7823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0091   -0.7823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2589    0.6388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0091   -2.2266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0184    2.0506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  9  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  4  0  0  0  0
  2  6  4  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  8 12  1  0  0  0  0
 13 15  4  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10929

>  <IDNUMBER>
BAS 00226750

>  <Activity>
0
$$$$
ASI3347
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
   -1.2461   -0.1802    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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  6 12  1  0  0  0  0
  2  7  1  0  0  0  0
  1  8  1  0  0  0  0
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  6 10  1  0  0  0  0
 11 15  1  0  0  0  0
  8 12  1  0  0  0  0
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 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
  3 16  1  0  0  0  0
  9 17  4  0  0  0  0
 13 18  4  0  0  0  0
 14 19  1  0  0  0  0
  7 20  1  0  0  0  0
 11 21  1  0  0  0  0
 11 22  1  0  0  0  0
 20 23  1  0  0  0  0
 18 24  1  0  0  0  0
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
 26 27  1  0  0  0  0
  3  4  4  0  0  0  0
  6  7  1  0  0  0  0
 17 18  4  0  0  0  0
 16 23  1  0  0  0  0
 25 27  1  0  0  0  0
M  CHG  2   6   1  11   1
M  END
>  <NAME>
ASI3347

>  <IDNUMBER>
BAS 00107367

>  <Activity>
0
$$$$
ASI10977
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.0548    0.2814    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5299    0.9501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2558   -1.1731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8734    1.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4544    0.5190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7674   -1.1402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0136   -0.4313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209    1.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209   -0.5409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1768   -1.8565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4192   -1.1402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0136   -1.8565    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
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
 10 12  1  0  0  0  0
 10 11  2  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  4 15  4  0  0  0  0
  5 16  4  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  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  4  0  0  0  0
 19 20  4  0  0  0  0
 17 21  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10977

>  <IDNUMBER>
BAS 00227044

>  <Activity>
0
$$$$
ASI3346
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
   -1.2356   -0.0157    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5156    0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9493    1.2230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9493    0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1981   -0.8457    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1981   -0.0157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2230   -0.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6694   -0.0157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5156   -1.2639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9244   -1.2639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6694    1.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0561   -0.8269    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6318   -0.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1981    1.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3831    0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3518   -1.2451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9244    0.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6224   -0.0157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9244    1.2262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7730   -1.2230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1031    1.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8013   -2.0531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4804   -0.7986    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
 13 18  1  0  0  0  0
 11 14  1  0  0  0  0
  3 15  1  0  0  0  0
  9 16  4  0  0  0  0
 12 17  4  0  0  0  0
 14 18  1  0  0  0  0
  7 19  1  0  0  0  0
 14 20  1  0  0  0  0
 19 21  1  0  0  0  0
 13 22  1  0  0  0  0
 17 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  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
 15 21  1  0  0  0  0
M  CHG  2   6   1  13   1
M  END
>  <NAME>
ASI3346

>  <IDNUMBER>
BAS 00107364

>  <Activity>
0
$$$$
ASI11242
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    0.6924   -0.0563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5208   -0.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5208   -1.4876    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.2949   -0.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9184   -0.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7024   -1.4876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9184    0.6594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7726    1.3750    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.0117    0.6594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7434   -0.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5976    1.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5843   -0.0364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2783    0.6594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7301    0.6693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5467    0.6594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8500    0.6594    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1410   -0.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1111    1.3850    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9675    1.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2949   -2.2033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7726    2.1801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7726    0.5433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9443   -1.4777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5301   -2.2033    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 11  1  0  0  0  0
  5 10  4  0  0  0  0
  8 11  1  0  0  0  0
  9 12  2  0  0  0  0
  1 13  1  0  0  0  0
  7 14  4  0  0  0  0
 13 15  1  0  0  0  0
  9 16  1  0  0  0  0
 14 17  4  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  4 20  4  0  0  0  0
  6 21  4  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
 20 24  4  0  0  0  0
 24 25  4  0  0  0  0
  3  5  1  0  0  0  0
 21 25  4  0  0  0  0
 10 17  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI11242

>  <IDNUMBER>
BAS 00230416

>  <Activity>
0
$$$$
ASI15001
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.6974   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0288    0.3825    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2931    0.3825    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5351   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6752    0.3825    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1874    0.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2931   -1.0381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4295   -0.3387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4295    1.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9357   -1.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7868   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7686    1.1109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4735    0.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2526   -0.3387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2709    1.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7771   -1.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0510   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0510    1.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1960   -1.7374    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.4947    0.3934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9357    0.3934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7589    0.3934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1778   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9172   -0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  5 14  1  0  0  0  0
  6 12  4  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
  4 10  4  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
  3 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  4  0  0  0  0
 13 17  4  0  0  0  0
 13 18  4  0  0  0  0
 16 19  1  0  0  0  0
  5 20  1  0  0  0  0
  4 21  4  0  0  0  0
 21 22  4  0  0  0  0
 22 23  4  0  0  0  0
 20 24  1  0  0  0  0
 16 23  4  0  0  0  0
  6 11  4  0  0  0  0
  5 15  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI15001

>  <IDNUMBER>
BAS 00283052

>  <Activity>
0
$$$$
ASI531
  Marvin  04201015132D          

 18 17  0  0  0  0            999 V2000
    1.1705    0.0028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2672   -0.2368    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2699    0.6775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2947   -0.9832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5919    0.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8866    0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8645   -0.4930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0961    0.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2669   -1.1319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5476    1.1072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5916    0.4379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5834   -0.3608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6470    1.4377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8040   -1.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5478    2.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2859    0.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9114   -2.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3989   -1.4624    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
  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
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 14 18  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI531

>  <IDNUMBER>
BAS 00019413

>  <Activity>
0
$$$$
ASI23405
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
    0.4025   -0.0671    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6305   -0.7894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6305    0.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8101   -0.7894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8101    0.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4489   -0.0671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4025   -1.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4025    1.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0381   -1.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0381    1.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8668    0.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7337    0.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6305   -2.2187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6305    2.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2857    0.0103    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8101   -2.2187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8101    2.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0485   -2.9617    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.0485    2.8275    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.4282    1.3776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5509   -0.3560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1526    0.1548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0020   -0.8359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7150   -0.5160    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
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  2  9  4  0  0  0  0
  3 10  4  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 13 16  4  0  0  0  0
 14 17  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
 21 24  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
  2  3  4  0  0  0  0
 10 14  4  0  0  0  0
  9 13  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI23405

>  <IDNUMBER>
BAS 00340854

>  <Activity>
0
$$$$
ASI19924
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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   -1.1803    0.7658    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
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  4  7  1  0  0  0  0
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  3  9  4  0  0  0  0
  5 10  1  0  0  0  0
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 10 12  4  0  0  0  0
 12 13  4  0  0  0  0
 14 17  4  0  0  0  0
 10 15  4  0  0  0  0
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 11 18  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
  6 21  4  0  0  0  0
  9 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
  6  9  4  0  0  0  0
  7  8  1  0  0  0  0
 25 26  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  2   4   1  18  -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>
ASI19924

>  <IDNUMBER>
BAS 00319151

>  <Activity>
0
$$$$
ASI10857
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
    2.2915   -0.9282    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1389   -0.0896    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  4  1  0  0  0  0
  4 12  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  3  8  2  0  0  0  0
  9 24  1  0  0  0  0
 10 13  1  0  0  0  0
 10 11  2  0  0  0  0
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  1 13  1  0  0  0  0
  6 14  1  0  0  0  0
 14 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 15 20  4  0  0  0  0
 15 21  4  0  0  0  0
  3 22  1  0  0  0  0
 17 23  1  0  0  0  0
 16 24  1  0  0  0  0
  9 23  1  0  0  0  0
 12 18  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10857

>  <IDNUMBER>
BAS 00226306

>  <Activity>
0
$$$$
ASI18191
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.8328   -0.5824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3557    0.0580    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
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  5  7  1  0  0  0  0
  3  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
 12 18  4  0  0  0  0
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 11 16  4  0  0  0  0
 14 17  4  0  0  0  0
 15 18  4  0  0  0  0
 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>
ASI18191

>  <IDNUMBER>
BAS 00312377

>  <Activity>
0
$$$$
ASI1975
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
   -0.8633    2.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5871    0.8284    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.8633    2.9356    0.0000 O   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  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 10  1  0  0  0  0
  8 10  1  0  0  0  0
  1 11  2  0  0  0  0
  9 12  2  0  0  0  0
  8 13  2  0  0  0  0
  6 14  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  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
 20 23  1  0  0  0  0
 22 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  4  6  1  0  0  0  0
 24 26  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI1975

>  <IDNUMBER>
BAS 00086954

>  <Activity>
0
$$$$
ASI20613
  Marvin  04201015132D          

 18 18  0  0  0  0            999 V2000
   -0.2224    0.5144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0728    0.5144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  3  8  1  0  0  0  0
  3  4  3  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
  5  8  1  0  0  0  0
  6  9  4  0  0  0  0
  9 10  4  0  0  0  0
 10 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
 14 15  4  0  0  0  0
  6 15  4  0  0  0  0
 14 16  4  0  0  0  0
 13 17  1  0  0  0  0
 12 18  1  0  0  0  0
 10 16  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI20613

>  <IDNUMBER>
BAS 00322550

>  <Activity>
0
$$$$
ASI30170
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
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   -3.6830    1.6674    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
  2  4  1  0  0  0  0
  1  5  4  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  1  8  1  0  0  0  0
  7  9  1  0  0  0  0
  3 10  2  0  0  0  0
  3 11  1  0  0  0  0
  4 12  2  0  0  0  0
  7 13  2  0  0  0  0
 14 19  4  0  0  0  0
  9 15  4  0  0  0  0
  9 16  4  0  0  0  0
  1 17  4  0  0  0  0
  4 18  1  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 21 22  4  0  0  0  0
 17 22  4  0  0  0  0
 11 23  4  0  0  0  0
 11 24  4  0  0  0  0
 18 25  1  0  0  0  0
 25 26  1  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
  2 21  4  0  0  0  0
 14 20  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30170

>  <IDNUMBER>
BAS 00393753

>  <Activity>
0
$$$$
ASI11246
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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  2 10  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  3  0  0  0  0
  5  6  1  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  5  9  2  0  0  0  0
  4 10  1  0  0  0  0
  1 11  1  0  0  0  0
  5 12  1  0  0  0  0
  2 13  1  0  0  0  0
  2 14  1  0  0  0  0
  7 15  4  0  0  0  0
  7 16  4  0  0  0  0
  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  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
 18 24  4  0  0  0  0
 22 25  4  0  0  0  0
 24 26  4  0  0  0  0
 23 26  4  0  0  0  0
 21 25  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI11246

>  <IDNUMBER>
BAS 00230434

>  <Activity>
0
$$$$
ASI23033
  Marvin  04201015132D          

 30 32  0  0  0  0            999 V2000
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    3.7381   -0.1336    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    4.8396    1.0647    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  6  3  0  0  0  0
  4  8  1  0  0  0  0
  4  5  3  0  0  0  0
  6 14  1  0  0  0  0
  3  7  1  0  0  0  0
  1  8  1  0  0  0  0
  9 28  1  0  0  0  0
 10 27  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
  5 13  1  0  0  0  0
 14 23  4  0  0  0  0
 12 15  2  0  0  0  0
 11 16  2  0  0  0  0
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  1 20  1  0  0  0  0
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 23 25  4  0  0  0  0
 13 24  4  0  0  0  0
 13 25  4  0  0  0  0
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 22 27  1  0  0  0  0
 20 28  1  0  0  0  0
 19 29  1  0  0  0  0
 21 30  1  0  0  0  0
  9 29  1  0  0  0  0
 14 26  4  0  0  0  0
 10 30  1  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI23033

>  <IDNUMBER>
BAS 00338414

>  <Activity>
0
$$$$
ASI4709
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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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
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  3  9  1  0  0  0  0
  4 10  2  0  0  0  0
  8 11  1  0  0  0  0
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 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 14 17  4  0  0  0  0
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 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 20 22  4  0  0  0  0
  5  6  1  0  0  0  0
 18 21  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI4709

>  <IDNUMBER>
BAS 00121241

>  <Activity>
0
$$$$
ASI24199
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
   -1.3105    0.4297    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8425    1.1063    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
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 11 16  4  0  0  0  0
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 14 18  4  0  0  0  0
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 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
  3  7  4  0  0  0  0
  6 10  1  0  0  0  0
 15 19  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24199

>  <IDNUMBER>
BAS 00344503

>  <Activity>
0
$$$$
ASI10935
  Marvin  04201015132D          

 25 26  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
  3 12  1  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  6  7  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  4  0  0  0  0
  4  9  4  0  0  0  0
  6 10  4  0  0  0  0
  8 11  4  0  0  0  0
 12 14  1  0  0  0  0
  2 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  6 19  4  0  0  0  0
  5 20  1  0  0  0  0
  4 21  1  0  0  0  0
 10 22  4  0  0  0  0
 11 23  1  0  0  0  0
 19 24  4  0  0  0  0
 24 25  4  0  0  0  0
  9 11  4  0  0  0  0
 22 25  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10935

>  <IDNUMBER>
BAS 00226767

>  <Activity>
0
$$$$
ASI7030
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
   -0.9500   -0.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6708    0.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9500   -1.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3833   -0.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0958    0.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8125   -0.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8125   -1.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542    1.8708    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
 19 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 13 23  4  0  0  0  0
 16 24  4  0  0  0  0
 20 25  1  0  0  0  0
  5  6  4  0  0  0  0
 23 24  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>
ASI7030

>  <IDNUMBER>
BAS 00141380

>  <Activity>
0
$$$$
ASI21162
  Marvin  04201015132D          

 24 25  0  0  1  0            999 V2000
   -0.2878   -0.1567    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1302   -0.1694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5366   -0.8932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2953   -1.6805    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3704   -0.8932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5577    0.5291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3132    0.6730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2794   -0.9948    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1377    1.3207    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
  8 14  1  0  0  0  0
 10 15  4  0  0  0  0
 15 16  4  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0  0  0  0
  8 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
 22 23  1  0  0  0  0
 21 24  1  0  0  0  0
  5 16  4  0  0  0  0
  6  7  4  0  0  0  0
M  CHG  1  18   1
M  END
>  <NAME>
ASI21162

>  <IDNUMBER>
BAS 00327277

>  <Activity>
0
$$$$
2ha6_SCK
  Marvin  04201014582D          

 20 19  0  0  0  0            999 V2000
   17.5701    8.7427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2845    9.1552    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   18.6970    8.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8720    9.8697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9990    9.5677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7135    9.1552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4279    9.5677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1424    9.1552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1424    8.3302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8569    9.5677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5714    9.1552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2858    9.5677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2858   10.3927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.0003    9.1552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.7148    9.5677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4292    9.1552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.1437    9.5677    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   26.8582    9.9802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.5562    8.8532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7312   10.2822    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  2  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
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
M  CHG  2   2   1  17   1
M  END
>  <Activity>
1

>  <PDB_ID>
2ha6_SCK

$$$$
ASI27127
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
   -0.0056    0.6582    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.8022    0.4548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3672    0.2825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2994   -1.6836    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2768    1.1327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4124   -0.9011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1074    1.1751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6497    0.5650    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
  4  5  4  0  0  0  0
  1  5  1  0  0  0  0
  6  7  3  0  0  0  0
  4  7  1  0  0  0  0
  4  8  4  0  0  0  0
  5  9  4  0  0  0  0
 10 11  4  0  0  0  0
  9 11  4  0  0  0  0
 10 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 18  1  0  0  0  0
  8 10  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI27127

>  <IDNUMBER>
BAS 00371624

>  <Activity>
0
$$$$
1w6r_GNT
  Marvin  04201014582D          

 21 24  0  0  0  0            999 V2000
    2.6306   34.3750    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
  3 20  4  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6 21  4  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
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 18  1  0  0  0  0
 12 21  1  6  0  0  0
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 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 17  1  0  0  0  0
 18 17  1  6  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <Activity>
1

>  <PDB_ID>
1w6r_GNT

$$$$
ASI23368
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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   -1.5465    0.1632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1719    0.1170    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1996    0.7086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1380   -1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6770    2.0547    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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    3.4810    0.7333    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
  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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  9 13  1  0  0  0  0
  2 10  4  0  0  0  0
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 12 13  1  0  0  0  0
 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
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 15 18  1  0  0  0  0
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 12 20  1  0  0  0  0
  9 21  1  0  0  0  0
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 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>
ASI23368

>  <IDNUMBER>
BAS 00340753

>  <Activity>
0
$$$$
ASI10869
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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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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 10 15  1  0  0  0  0
  3 11  1  0  0  0  0
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 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  9 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  4  0  0  0  0
 10 16  1  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10869

>  <IDNUMBER>
BAS 00226350

>  <Activity>
0
$$$$
ASI24390
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
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 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>
ASI24390

>  <IDNUMBER>
BAS 00345393

>  <Activity>
0
$$$$
ASI30593
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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  2  3  4  0  0  0  0
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  1  7  1  0  0  0  0
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  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
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 15 18  1  0  0  0  0
 16 19  4  0  0  0  0
  2  5  4  0  0  0  0
 13 19  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI30593

>  <IDNUMBER>
BAS 00395375

>  <Activity>
0
$$$$
ASI10790
  Marvin  04201015132D          

 27 30  0  0  1  0            999 V2000
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 11 12  4  0  0  0  0
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 10 14  4  0  0  0  0
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  5 16  1  0  0  0  0
  9 11  4  0  0  0  0
  4  6  4  0  0  0  0
 14 15  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI10790

>  <IDNUMBER>
BAS 00225283

>  <Activity>
0
$$$$
ASI20615
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 14 15  4  0  0  0  0
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 13 16  1  0  0  0  0
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  7 18  4  0  0  0  0
 14 19  4  0  0  0  0
 11 20  4  0  0  0  0
 18 21  4  0  0  0  0
 21 22  4  0  0  0  0
  9 17  1  0  0  0  0
 11 19  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI20615

>  <IDNUMBER>
BAS 00322556

>  <Activity>
0
$$$$
ASI21237
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  6 14  1  0  0  0  0
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 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
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
 17 25  4  0  0  0  0
 20 26  1  0  0  0  0
  9 10  1  0  0  0  0
  4  7  4  0  0  0  0
 21 26  1  0  0  0  0
 22 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>
ASI21237

>  <IDNUMBER>
BAS 00327489

>  <Activity>
0
$$$$
ASI20066
  Marvin  04201015132D          

 28 33  0  0  1  0            999 V2000
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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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  4  7  1  0  0  0  0
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  6  9  1  0  0  0  0
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 12 13  1  0  0  0  0
  3 14  2  0  0  0  0
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 16 23  1  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
  8 20  4  0  0  0  0
 13 21  1  0  0  0  0
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 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 19 25  4  0  0  0  0
 20 26  4  0  0  0  0
 17 27  4  0  0  0  0
 18 28  4  0  0  0  0
  4  5  1  0  0  0  0
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 16 24  1  0  0  0  0
  8 10  4  0  0  0  0
 26 28  4  0  0  0  0
 25 27  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI20066

>  <IDNUMBER>
BAS 00319566

>  <Activity>
0
$$$$
ASI8929
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.0989   -0.5677    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3478   -0.5677    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
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  1  4  4  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  3  8  2  0  0  0  0
  5  9  2  0  0  0  0
  7 10  4  0  0  0  0
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  1 12  4  0  0  0  0
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 14 15  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
 12 19  4  0  0  0  0
 13 20  1  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
  2 17  4  0  0  0  0
 14 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI8929

>  <IDNUMBER>
BAS 00187765

>  <Activity>
0
$$$$
ASI30420
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
   -1.2490    0.4811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9853    1.2582    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
  1 13  1  0  0  0  0
 14 17  4  0  0  0  0
 12 15  4  0  0  0  0
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 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
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 14 20  1  0  0  0  0
  5 21  4  0  0  0  0
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 20 24  1  0  0  0  0
 19 25  4  0  0  0  0
 25 26  4  0  0  0  0
  5  8  1  0  0  0  0
 21 26  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI30420

>  <IDNUMBER>
BAS 00394662

>  <Activity>
0
$$$$
ASI15514
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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  2  3  1  0  0  0  0
  1  4  4  0  0  0  0
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  3  9  1  0  0  0  0
  5 10  1  0  0  0  0
  1 11  4  0  0  0  0
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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
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 16 17  4  0  0  0  0
 15 18  4  0  0  0  0
 18 19  4  0  0  0  0
  2 13  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI15514

>  <IDNUMBER>
BAS 00286352

>  <Activity>
0
$$$$
ASI27165
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
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    2.7527   -3.6404    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 15  1  0  0  0  0
 13 19  1  0  0  0  0
  3 14  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  2  0  0  0  0
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 12 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  6 21  4  0  0  0  0
 13 22  1  0  0  0  0
  7 23  4  0  0  0  0
 14 24  4  0  0  0  0
 14 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
 25 29  4  0  0  0  0
 29 30  4  0  0  0  0
  9 10  1  0  0  0  0
  4  6  4  0  0  0  0
 26 27  4  0  0  0  0
 28 30  4  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI27165

>  <IDNUMBER>
BAS 00371731

>  <Activity>
0
$$$$
ASI23948
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.9146    1.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6752    1.8363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4109    1.0896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1500    1.8363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2465    0.5787    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2111    0.8538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7184    0.8752    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4004    0.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1935   -0.1751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6287    2.4936    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  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
  8  9  4  0  0  0  0
  9 10  4  0  0  0  0
  4 11  2  0  0  0  0
  8 12  4  0  0  0  0
 13 16  4  0  0  0  0
  7 14  1  0  0  0  0
  9 15  1  0  0  0  0
 12 16  4  0  0  0  0
 13 17  1  0  0  0  0
 14 18  4  0  0  0  0
 14 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
  3  4  1  0  0  0  0
 21 22  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI23948

>  <IDNUMBER>
BAS 00342585

>  <Activity>
0
$$$$
ASI11035
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
    1.6677    0.5103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9240   -0.7505    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3882    0.9340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6644   -0.3369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9606    0.9340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6017   -2.1080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4288   -0.4169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9240   -1.5877    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 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
  3 10  1  0  0  0  0
  2 11  1  0  0  0  0
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 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  6 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 20  1  0  0  0  0
 10 21  4  0  0  0  0
 10 22  4  0  0  0  0
 22 23  4  0  0  0  0
 21 24  4  0  0  0  0
 23 25  4  0  0  0  0
 24 25  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI11035

>  <IDNUMBER>
BAS 00227510

>  <Activity>
0
$$$$
ASI26547
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    1.1427    0.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7163    1.0574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1427   -1.1085    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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  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
 20 21  1  0  0  0  0
 19 21  1  0  0  0  0
 14 22  1  0  0  0  0
 15 23  1  0  0  0  0
 20 24  1  0  0  0  0
 16 25  4  0  0  0  0
 17 26  4  0  0  0  0
 25 27  4  0  0  0  0
 23 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>
ASI26547

>  <IDNUMBER>
BAS 00367505

>  <Activity>
0
$$$$
ASI14373
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -1.4297   -0.8706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1608   -0.1416    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
  8  9  1  0  0  0  0
  9 13  1  0  0  0  0
  4 10  2  0  0  0  0
  8 11  2  0  0  0  0
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 13 18  4  0  0  0  0
  6 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
  8 19  1  0  0  0  0
 14 20  4  0  0  0  0
 14 21  4  0  0  0  0
 20 22  4  0  0  0  0
 21 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
 13 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI14373

>  <IDNUMBER>
BAS 00276525

>  <Activity>
0
$$$$
ASI28451
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    1.2757    0.1966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 18  4  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
 11 13  4  0  0  0  0
 18 22  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI28451

>  <IDNUMBER>
BAS 00384331

>  <Activity>
0
$$$$
ASI21028
  Marvin  04201015132D          

 32 36  0  0  0  0            999 V2000
    0.4174   -1.8224    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2424   -1.3735    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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  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  8 10  1  0  0  0  0
  1  9  1  0  0  0  0
 10 14  4  0  0  0  0
  3 11  2  0  0  0  0
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 13 21  1  0  0  0  0
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 15 18  4  0  0  0  0
  6 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
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  9 23  4  0  0  0  0
  9 24  4  0  0  0  0
 16 25  4  0  0  0  0
 16 26  4  0  0  0  0
 24 27  4  0  0  0  0
 23 28  4  0  0  0  0
 26 29  4  0  0  0  0
 25 30  4  0  0  0  0
 29 31  4  0  0  0  0
 27 32  4  0  0  0  0
  4  5  1  0  0  0  0
 28 32  4  0  0  0  0
 10 15  4  0  0  0  0
 30 31  4  0  0  0  0
 13 22  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI21028

>  <IDNUMBER>
BAS 00324572

>  <Activity>
0
$$$$
ASI28526
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
   -1.3803   -0.7177    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6588   -0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8503    0.5190    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9986   -0.1435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6526    0.5889    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3803   -1.5459    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0515   -0.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3276    1.1484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5079    1.0159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0515   -1.5459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6588   -1.9618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7730   -0.2981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6588   -2.7826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6232    0.1325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1385    0.7767    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
  1  6  4  0  0  0  0
  2  7  4  0  0  0  0
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  4  0  0  0  0
  6 11  4  0  0  0  0
  7 12  1  0  0  0  0
  9 13  4  0  0  0  0
 13 14  1  0  0  0  0
  9 15  4  0  0  0  0
 11 16  1  0  0  0  0
 13 17  4  0  0  0  0
 15 18  4  0  0  0  0
 18 19  4  0  0  0  0
  3  5  4  0  0  0  0
  7 10  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI28526

>  <IDNUMBER>
BAS 00384546

>  <Activity>
0
$$$$
ASI23403
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
    0.5930    0.0773    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -0.6394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9899   -0.6394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9899    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2681    0.0773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5930   -1.3611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5930    1.5158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2273    1.5158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2273   -1.3611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6858    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5415    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097    2.2273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -2.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1035    0.1547    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9899   -2.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2273    2.9697    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2475    1.5210    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
  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
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
 15 23  1  0  0  0  0
 15 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
 13 17  4  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI23403

>  <IDNUMBER>
BAS 00340851

>  <Activity>
0
$$$$
ASI24214
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -1.6748    1.2304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8918   -0.8357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3896    1.6392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2418    1.2125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9743    1.6392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1079    1.2304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  9  4  0  0  0  0
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 12 14  1  0  0  0  0
 11 13  1  0  0  0  0
  5 14  1  0  0  0  0
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  1 17  4  0  0  0  0
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  9 19  1  0  0  0  0
 10 20  1  0  0  0  0
 18 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
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
  9 24  4  0  0  0  0
  6 12  1  0  0  0  0
 10 23  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI24214

>  <IDNUMBER>
BAS 00344551

>  <Activity>
0
$$$$
ASI17600
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -2.0778    1.0541    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3368    2.2857    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
  3  6  4  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
  4  7  2  0  0  0  0
  7  8  1  0  0  0  0
  9 11  1  0  0  0  0
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 11 13  4  0  0  0  0
  8 12  1  0  0  0  0
 13 16  4  0  0  0  0
 14 15  4  0  0  0  0
 12 15  4  0  0  0  0
 12 16  4  0  0  0  0
  9 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  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>
ASI17600

>  <IDNUMBER>
BAS 00297166

>  <Activity>
0
$$$$
ASI30572
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.3499    0.5772    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0222   -0.1564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1255    1.9752    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  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
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  5  9  2  0  0  0  0
  8 10  4  0  0  0  0
 11 16  1  0  0  0  0
 10 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  4  0  0  0  0
 14 16  1  0  0  0  0
 13 17  1  0  0  0  0
 10 18  4  0  0  0  0
 15 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3  4  1  0  0  0  0
 11 17  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30572

>  <IDNUMBER>
BAS 00395327

>  <Activity>
0
$$$$
ASI22375
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
   -1.6097    0.3085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.6876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6097    1.2551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0069   -0.5105    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.0069    1.0211    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
  3 10  2  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 16 18  4  0  0  0  0
 16 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
 19 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
  2  9  1  0  0  0  0
  2  8  1  0  0  0  0
 24 27  4  0  0  0  0
 22 26  4  0  0  0  0
M  CHG  2   4   1   5   1
M  END
>  <NAME>
ASI22375

>  <IDNUMBER>
BAS 00334595

>  <Activity>
0
$$$$
ASI15045
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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   -3.6225    0.2261    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  4  0  0  0  0
  4  9  4  0  0  0  0
 10 16  4  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
 13 14  4  0  0  0  0
 14 15  4  0  0  0  0
  8 16  4  0  0  0  0
  9 17  4  0  0  0  0
 15 18  1  0  0  0  0
  2 19  1  0  0  0  0
 20 21  4  0  0  0  0
 13 21  4  0  0  0  0
 20 22  4  0  0  0  0
 19 23  1  0  0  0  0
  2 11  1  0  0  0  0
 10 17  4  0  0  0  0
 15 22  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI15045

>  <IDNUMBER>
BAS 00283331

>  <Activity>
0
$$$$
ASI21330
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
   -0.2062    0.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4439   -0.1719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  8  1  0  0  0  0
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  1 10  1  0  0  0  0
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 11 12  1  0  0  0  0
  6 13  1  0  0  0  0
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 16 17  4  0  0  0  0
 15 18  4  0  0  0  0
 18 19  4  0  0  0  0
  2  4  1  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI21330

>  <IDNUMBER>
BAS 00328694

>  <Activity>
0
$$$$
2j3q_TFL
  Marvin  04201014582D          

 20 22  0  0  0  0            999 V2000
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   -8.2301   59.1349    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  4  0  0  0  0
  2 20  4  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  4 17  4  0  0  0  0
  5  6  4  0  0  0  0
  5 19  4  0  0  0  0
  6  7  4  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
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  8 13  4  0  0  0  0
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 10 11  4  0  0  0  0
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 11 14  1  0  0  0  0
 12 13  4  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 19 20  4  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
2j3q_TFL

$$$$
ASI11021
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
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 13 27  4  0  0  0  0
 17 28  4  0  0  0  0
 27 29  4  0  0  0  0
 29 30  4  0  0  0  0
  4  5  1  0  0  0  0
 21 23  4  0  0  0  0
 14 17  4  0  0  0  0
 28 30  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI11021

>  <IDNUMBER>
BAS 00227355

>  <Activity>
0
$$$$
ASI22900
  Marvin  04201015132D          

 19 22  0  0  1  0            999 V2000
    0.2068   -0.2804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9149   -1.4701    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3824   -1.8270    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3115   -2.2264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2068   -1.8412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1925   -1.8270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3370    0.6204    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0029    1.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6146    1.3879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8271    0.9886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3115    1.8978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3455    1.6344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2209    2.5577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0367    2.4218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  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
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  2  0  0  0  0
  5 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  4  0  0  0  0
 13 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
  3 11  1  0  0  0  0
  2 10  1  0  0  0  0
  2  9  1  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI22900

>  <IDNUMBER>
BAS 00337621

>  <Activity>
0
$$$$
ASI10930
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
    0.6060    1.7479    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4356    1.7479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0534   -1.1186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6245   -0.4055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8550    1.0255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1771   -1.8597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1771   -0.4055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060    0.3169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4356    0.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -1.1186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060    2.5729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060    0.9136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6661    1.0255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8597   -1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6245    1.0255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6292    2.4470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2839   -1.8318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8597   -2.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  4  4  0  0  0  0
  4  9  4  0  0  0  0
  5  8  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8 12  4  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  4  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  7 15  1  0  0  0  0
  3 16  4  0  0  0  0
  5 17  4  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
  3  5  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10930

>  <IDNUMBER>
BAS 00226751

>  <Activity>
0
$$$$
ASI21726
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
    1.2997   -0.3866    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7154   -0.8461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9070    0.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0426   -0.4871    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0944    0.3288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0394   -0.5601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7366    0.3288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8248   -1.6650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2997    1.1993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1383   -0.3866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1505    1.0470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5659   -0.0091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3178   -0.1735    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2496    1.1475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3894    0.3288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9876   -0.3866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9876    1.0470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2203    0.3288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8444    0.3805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5491   -0.9040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6343   -0.3866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4592   -0.3775    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
  7 10  4  0  0  0  0
  7 11  4  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
  5 14  1  0  0  0  0
 15 16  4  0  0  0  0
 10 16  4  0  0  0  0
 11 17  4  0  0  0  0
 15 18  1  0  0  0  0
 13 19  1  0  0  0  0
 13 20  1  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
 15 17  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI21726

>  <IDNUMBER>
BAS 00331146

>  <Activity>
0
$$$$
ASI15304
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
   -0.0071   -0.0142    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7125   -0.4254    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7090    0.4041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4148    0.6948    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4325   -0.7232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1412   -1.2336    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.7125   -1.2336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4251   -0.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4251   -1.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1412   -0.4254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4463    0.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7090    1.2336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1482    0.4254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4144    1.6590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1376    1.2620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8537   -1.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8359    1.6874    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
  1  5  2  0  0  0  0
  6  9  1  0  0  0  0
  2  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
  3 11  4  0  0  0  0
  3 12  4  0  0  0  0
 11 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
 15 17  1  0  0  0  0
  6 10  1  0  0  0  0
 14 15  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI15304

>  <IDNUMBER>
BAS 00284761

>  <Activity>
0
$$$$
ASI3945
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
    0.3041    0.5557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0171   -0.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3041   -1.0765    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0171    0.1538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3949   -0.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3041    1.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4054    1.7685    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.3949    0.1538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8035   -0.6186    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7336   -1.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1079   -1.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7441   -1.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4571   -0.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7126    0.5732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4676   -2.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2015   -1.0521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2120   -1.8978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4089    2.5829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9670   -2.2963    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
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  5  8  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  1  8  4  0  0  0  0
  9 11  1  0  0  0  0
  2 10  1  0  0  0  0
  5 11  1  0  0  0  0
 10 12  4  0  0  0  0
 10 13  4  0  0  0  0
  4 14  1  0  0  0  0
 12 15  4  0  0  0  0
 13 16  4  0  0  0  0
 15 17  4  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
 17 22  1  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
 21 26  1  0  0  0  0
 24 27  1  0  0  0  0
 26 28  1  0  0  0  0
  2  3  4  0  0  0  0
 23 27  1  0  0  0  0
 16 17  4  0  0  0  0
 25 28  1  0  0  0  0
M  CHG  2   7   1   9   1
M  END
>  <NAME>
ASI3945

>  <IDNUMBER>
BAS 00113572

>  <Activity>
0
$$$$
ASI10937
  Marvin  04201015132D          

 30 32  0  0  1  0            999 V2000
    3.5886   -0.0918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8841   -0.5137    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5628   -0.0183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4457   -0.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8400   -0.4440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1208   -0.0367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5886    0.7265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3261   -0.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1832    0.7412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0220   -0.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2783   -0.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6935   -0.0660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4163   -0.4733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6568    0.7595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5849   -1.6695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8583   -1.2696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5408    0.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2894   -1.2402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3408   -1.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8878    1.1411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9828    0.0037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2453    1.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9645    0.8293    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  4  0  0  0  0
  3  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8 15  1  0  0  0  0
  1  9  4  0  0  0  0
  1 10  4  0  0  0  0
  3 11  2  0  0  0  0
  4 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
 14 16  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
 19 22  4  0  0  0  0
 20 21  4  0  0  0  0
  7 21  4  0  0  0  0
 10 22  4  0  0  0  0
  9 23  4  0  0  0  0
  5 24  4  0  0  0  0
 20 25  4  0  0  0  0
 10 26  1  0  0  0  0
  9 27  1  0  0  0  0
 13 28  4  0  0  0  0
 24 29  4  0  0  0  0
 29 30  4  0  0  0  0
 19 23  4  0  0  0  0
 13 25  4  0  0  0  0
 28 30  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI10937

>  <IDNUMBER>
BAS 00226772

>  <Activity>
0
$$$$
ASI19878
  Marvin  04201015132D          

 31 35  0  0  1  0            999 V2000
   -0.6469   -0.7854    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4852   -1.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4832   -0.6745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8389   -1.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8852    0.0693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5894    2.3564    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  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  5 10  1  0  0  0  0
  4 11  1  0  0  0  0
 12 13  1  0  0  0  0
  7 13  1  0  0  0  0
  2 14  2  0  0  0  0
  3 15  2  0  0  0  0
 10 16  4  0  0  0  0
  7 17  2  0  0  0  0
 11 18  1  0  0  0  0
 19 25  1  0  0  0  0
  9 20  4  0  0  0  0
  8 21  4  0  0  0  0
 10 22  4  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 16 27  4  0  0  0  0
 20 28  4  0  0  0  0
 21 29  4  0  0  0  0
 22 30  4  0  0  0  0
 30 31  4  0  0  0  0
  8  9  4  0  0  0  0
 28 29  4  0  0  0  0
 16 18  1  0  0  0  0
 27 31  4  0  0  0  0
 19 26  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI19878

>  <IDNUMBER>
BAS 00318998

>  <Activity>
0
$$$$
ASI21213
  Marvin  04201015132D          

 30 33  0  0  0  0            999 V2000
   -3.4913   -0.3524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4774    0.3570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6567   -0.3524    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0432   -0.3524    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0293    0.3570    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -3.9039   -1.0664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9086    1.0757    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2533   -0.3524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2673   -1.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2673    0.3570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2533    1.0757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.9039    0.3570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7153    1.7851    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  9  1  0  0  0  0
  1  4  1  0  0  0  0
  5 18  1  0  0  0  0
  6 19  1  0  0  0  0
  1  7  2  0  0  0  0
  2  8  2  0  0  0  0
  9 16  1  0  0  0  0
  4 10  1  0  0  0  0
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 12 15  1  0  0  0  0
  2 13  1  0  0  0  0
  1 14  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
 11 17  1  0  0  0  0
 10 18  1  0  0  0  0
 19 20  1  0  0  0  0
  5 20  1  0  0  0  0
 14 21  4  0  0  0  0
 14 22  4  0  0  0  0
 13 23  4  0  0  0  0
 13 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
 25 29  4  0  0  0  0
 28 30  4  0  0  0  0
  5 17  1  0  0  0  0
 26 29  4  0  0  0  0
  3 12  1  0  0  0  0
 27 30  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI21213

>  <IDNUMBER>
BAS 00327416

>  <Activity>
0
$$$$
ASI19985
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.3835    0.6102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4867    1.4351    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1632    1.1815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7004    1.7616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5757    0.4426    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5113    2.5694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9378   -0.7133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9807    0.7691    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
  7  9  1  0  0  0  0
  6 10  1  0  0  0  0
  9 11  4  0  0  0  0
 11 12  4  0  0  0  0
 12 13  1  0  0  0  0
 14 15  4  0  0  0  0
  9 15  4  0  0  0  0
 14 16  4  0  0  0  0
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 13 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
 12 16  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI19985

>  <IDNUMBER>
BAS 00319363

>  <Activity>
0
$$$$
ASI22647
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
   -1.8343   -0.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1099   -0.3727    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5379   -0.4900    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  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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  3  7  2  0  0  0  0
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  7  9  1  0  0  0  0
  6 10  1  0  0  0  0
  1 11  2  0  0  0  0
 12 13  4  0  0  0  0
  9 13  4  0  0  0  0
  4 14  2  0  0  0  0
 10 15  4  0  0  0  0
 11 16  1  0  0  0  0
 15 17  1  0  0  0  0
 10 18  4  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 16 21  4  0  0  0  0
 18 22  4  0  0  0  0
 22 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  3  4  1  0  0  0  0
 24 26  4  0  0  0  0
  6 12  4  0  0  0  0
 19 23  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI22647

>  <IDNUMBER>
BAS 00336266

>  <Activity>
0
$$$$
ASI22617
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    1.2205   -0.5419    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
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  4  7  2  0  0  0  0
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  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
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 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
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 12 17  1  0  0  0  0
  8 18  1  0  0  0  0
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 17 20  1  0  0  0  0
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 19 22  1  0  0  0  0
  4  5  1  0  0  0  0
 21 22  1  0  0  0  0
 12 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI22617

>  <IDNUMBER>
BAS 00336187

>  <Activity>
0
$$$$
ASI15362
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.6570    0.8521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0815    1.2028    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
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  1  5  1  0  0  0  0
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  3  7  2  0  0  0  0
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  6 10  1  0  0  0  0
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 11 12  4  0  0  0  0
 12 13  1  0  0  0  0
 14 15  4  0  0  0  0
  9 15  4  0  0  0  0
 14 16  4  0  0  0  0
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 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
 12 16  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI15362

>  <IDNUMBER>
BAS 00285499

>  <Activity>
0
$$$$
ASI29133
  Marvin  04201015132D          

 30 34  0  0  1  0            999 V2000
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   -2.2049    1.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3898   -1.9867    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
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  7 10  1  0  0  0  0
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 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  9 16  1  0  0  0  0
  2 17  4  0  0  0  0
  3 18  4  0  0  0  0
 11 19  1  0  0  0  0
  4 20  4  0  0  0  0
  5 21  4  0  0  0  0
 19 22  4  0  0  0  0
 19 23  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
 17 26  4  0  0  0  0
 18 27  4  0  0  0  0
 22 28  4  0  0  0  0
 23 29  4  0  0  0  0
 29 30  4  0  0  0  0
  4  5  4  0  0  0  0
 21 25  4  0  0  0  0
 20 24  4  0  0  0  0
  8 12  1  0  0  0  0
 28 30  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI29133

>  <IDNUMBER>
BAS 00388253

>  <Activity>
0
$$$$
ASI12604
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.7390    1.2825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3909    1.9971    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5618    1.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4152    1.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1344    0.7207    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5269    1.0322    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3436    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0015    2.4551    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4413   -0.0183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7344    0.2015    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
  7  9  1  0  0  0  0
  6 10  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
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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
 10 18  4  0  0  0  0
 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>
ASI12604

>  <IDNUMBER>
BAS 00253545

>  <Activity>
0
$$$$
ASI15368
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -1.1887    1.3161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4621    1.6602    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0898    0.4876    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9248    1.7112    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 11  2  0  0  0  0
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 13 15  4  0  0  0  0
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 12 15  4  0  0  0  0
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 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  4  0  0  0  0
 14 21  4  0  0  0  0
 19 22  1  0  0  0  0
 18 23  1  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  3  4  1  0  0  0  0
 24 26  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI15368

>  <IDNUMBER>
BAS 00285508

>  <Activity>
0
$$$$
ASI28812
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.8769    0.4599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3430   -0.1840    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
  5 14  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  4  0  0  0  0
  4  8  4  0  0  0  0
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 11 20  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  4  0  0  0  0
 14 19  1  0  0  0  0
 10 15  4  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
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 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 13 22  1  0  0  0  0
  4  7  4  0  0  0  0
 13 15  4  0  0  0  0
 11 21  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI28812

>  <IDNUMBER>
BAS 00386247

>  <Activity>
0
$$$$
ASI26541
  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
  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
 25 26  4  0  0  0  0
 22 23  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>
ASI26541

>  <IDNUMBER>
BAS 00367491

>  <Activity>
0
$$$$
ASI24156
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -1.4703   -0.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9528    0.5002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1250    0.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1598   -0.9269    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  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
  6  8  4  0  0  0  0
  4  9  1  0  0  0  0
  2 10  1  0  0  0  0
  7 11  4  0  0  0  0
 11 12  4  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
  9 15  4  0  0  0  0
  9 16  4  0  0  0  0
 12 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
 10 13  1  0  0  0  0
 18 20  4  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24156

>  <IDNUMBER>
BAS 00344340

>  <Activity>
0
$$$$
ASI2454
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
    1.5637   -0.4150    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2581   -0.0304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3056    1.0779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9979    0.7136    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
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  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
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  2 10  2  0  0  0  0
  6 11  2  0  0  0  0
  3 12  2  0  0  0  0
 13 16  1  0  0  0  0
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 13 15  4  0  0  0  0
  9 16  2  0  0  0  0
  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
 15 19  1  0  0  0  0
 20 22  4  0  0  0  0
 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 20 23  1  0  0  0  0
 13 24  4  0  0  0  0
 15 25  4  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
 24 28  4  0  0  0  0
 28 29  4  0  0  0  0
  4  5  1  0  0  0  0
 20 21  4  0  0  0  0
 25 29  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI2454

>  <IDNUMBER>
BAS 00094316

>  <Activity>
0
$$$$
ASI30161
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    0.7582    0.2384    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0381    0.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8991    0.6675    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
  1  3  4  0  0  0  0
  2  4  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
  7  8  4  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  3 12  4  0  0  0  0
  6 13  4  0  0  0  0
 10 14  4  0  0  0  0
 10 15  4  0  0  0  0
 16 17  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
 19 20  4  0  0  0  0
  6  8  4  0  0  0  0
 13 16  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30161

>  <IDNUMBER>
BAS 00393728

>  <Activity>
0
$$$$
ASI24210
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.9449   -0.5846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6509   -1.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6509   -0.9964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2243    0.6802    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.2279   -1.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2243    1.4891    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  6  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  1  8  4  0  0  0  0
  9 13  4  0  0  0  0
 10 15  1  0  0  0  0
 11 14  1  0  0  0  0
  4 12  1  0  0  0  0
  8 13  4  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  3 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
 12 20  4  0  0  0  0
 12 21  4  0  0  0  0
 13 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
  2  9  4  0  0  0  0
  4 11  1  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24210

>  <IDNUMBER>
BAS 00344541

>  <Activity>
0
$$$$
ASI33490
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -1.2642    0.6039    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.3900   -0.3019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0567   -2.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  2  3  3  0  0  0  0
  4  8  1  0  0  0  0
  4  5  3  0  0  0  0
  1  6  1  0  0  0  0
  7 14  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
  1 11  1  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
  9 16  4  0  0  0  0
  9 17  4  0  0  0  0
 17 18  4  0  0  0  0
 16 19  4  0  0  0  0
 19 20  4  0  0  0  0
  7 15  1  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI33490

>  <IDNUMBER>
BAS 00412868

>  <Activity>
0
$$$$
ASI5505
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
    0.2106   -0.6619    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4213    0.5303    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.3388    1.6511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
  3  4  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
  7  8  1  0  0  0  0
  9 10  4  0  0  0  0
  4 10  4  0  0  0  0
  6 11  1  0  0  0  0
  5 12  1  0  0  0  0
  4 13  4  0  0  0  0
  9 14  4  0  0  0  0
 12 15  4  0  0  0  0
 11 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
 18 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
  2  8  1  0  0  0  0
 14 19  4  0  0  0  0
 20 24  4  0  0  0  0
 22 25  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI5505

>  <IDNUMBER>
BAS 00128267

>  <Activity>
0
$$$$
ASI27393
  Marvin  04201015132D          

 21 21  0  0  0  0            999 V2000
    0.5020    0.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0753    0.8200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0628   -0.5104    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7865   -0.1674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4184    1.5772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0836    2.2424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5061   -0.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9664   -1.9371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2509   -2.5396    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
  7 11  1  0  0  0  0
  4 12  1  0  0  0  0
 13 15  1  0  0  0  0
  5 14  1  0  0  0  0
  8 15  1  0  0  0  0
 13 16  1  0  0  0  0
 11 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
  4  5  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI27393

>  <IDNUMBER>
BAS 00379904

>  <Activity>
0
$$$$
ASI6546
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.4853   -0.5338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2135   -0.9316    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4853    0.3057    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2083   -0.9559    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2135    1.5382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6547   -0.9559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7711    0.3057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6398   -0.9413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1690   -0.4173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3288    0.2912    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
  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
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 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
 13 19  4  0  0  0  0
 14 20  4  0  0  0  0
 20 21  4  0  0  0  0
  4  6  1  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI6546

>  <IDNUMBER>
BAS 00138220

>  <Activity>
0
$$$$
ASI21698
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
   -1.0720    0.1044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1684    0.8954    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4055    1.2527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7104   -0.4416    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
  3  5  1  0  0  0  0
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  1  8  2  0  0  0  0
  9 12  4  0  0  0  0
  9 10  4  0  0  0  0
 11 13  4  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
  4 16  2  0  0  0  0
 15 17  1  0  0  0  0
  8 18  1  0  0  0  0
 12 19  1  0  0  0  0
 18 20  4  0  0  0  0
 18 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
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 11  4  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI21698

>  <IDNUMBER>
BAS 00330761

>  <Activity>
0
$$$$
ASI3496
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.4473    0.5661    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5733   -0.6611    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
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  7 16  1  0  0  0  0
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  1  9  1  0  0  0  0
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  1 11  1  0  0  0  0
 12 17  1  0  0  0  0
  5 13  1  0  0  0  0
  2 14  1  0  0  0  0
 10 15  1  0  0  0  0
  9 16  1  0  0  0  0
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 12 18  4  0  0  0  0
 12 19  4  0  0  0  0
 14 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
  7 15  1  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI3496

>  <IDNUMBER>
BAS 00108120

>  <Activity>
0
$$$$
ASI27166
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
    0.7511   -0.9038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  CHG  1  14   1
M  END
>  <NAME>
ASI27166

>  <IDNUMBER>
BAS 00371738

>  <Activity>
0
$$$$
ASI26511
  Marvin  04201015132D          

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 20 21  4  0  0  0  0
  5 16  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI26511

>  <IDNUMBER>
BAS 00367299

>  <Activity>
0
$$$$
ASI19870
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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  9 10  4  0  0  0  0
  8 19  1  0  0  0  0
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M  CHG  1   4   1
M  END
>  <NAME>
ASI19870

>  <IDNUMBER>
BAS 00318984

>  <Activity>
0
$$$$
ASI14621
  Marvin  04201015132D          

 33 36  0  0  1  0            999 V2000
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M  CHG  1  10   1
M  END
>  <NAME>
ASI14621

>  <IDNUMBER>
BAS 00280474

>  <Activity>
0
$$$$
ASI606
  Marvin  04201015132D          

 34 38  0  0  0  0            999 V2000
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M  CHG  1  12   1
M  END
>  <NAME>
ASI606

>  <IDNUMBER>
BAS 00024118

>  <Activity>
0
$$$$
ASI23988
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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   -3.1684   -0.5519    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
  4  5  1  0  0  0  0
  6 15  1  0  0  0  0
  2  7  1  0  0  0  0
  3  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
  5 12  1  0  0  0  0
  5 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  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 20 21  4  0  0  0  0
  7  8  1  0  0  0  0
  6 14  1  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI23988

>  <IDNUMBER>
BAS 00342713

>  <Activity>
0
$$$$
ASI15799
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
    1.5896   -0.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3721    0.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3928   -0.5020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5968    0.6917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9578    1.0542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9785    0.0502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900   -1.6398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9872    1.1378    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7609    0.8088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3849    1.4558    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  1  0  0  0  0
  1  6  4  0  0  0  0
  2  7  4  0  0  0  0
  3  8  4  0  0  0  0
  6  9  4  0  0  0  0
 10 16  1  0  0  0  0
  8 11  4  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
  9 18  1  0  0  0  0
 17 19  4  0  0  0  0
 17 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  9  4  0  0  0  0
  7 11  4  0  0  0  0
 10 15  1  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15799

>  <IDNUMBER>
BAS 00287774

>  <Activity>
0
$$$$
ASI24218
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
    1.5966   -0.4452    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9021   -0.0296    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9765    0.8251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5224    0.7953    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.6887    1.2524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1692   -1.1336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4010    0.8251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5224   -0.0296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2614   -1.6738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4010    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3744   -2.1664    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 11  1  0  0  0  0
  1  4  1  0  0  0  0
  5 13  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
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
  4 15  4  0  0  0  0
  4 16  4  0  0  0  0
  6 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
  3 21  4  0  0  0  0
 12 22  1  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
 20 25  1  0  0  0  0
 22 26  1  0  0  0  0
  5 14  1  0  0  0  0
 18 20  4  0  0  0  0
 12 24  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24218

>  <IDNUMBER>
BAS 00344558

>  <Activity>
0
$$$$
ASI27397
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.3323    1.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8059    1.7607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8059    0.4430    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5813    1.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5813    0.6799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5309    2.5591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7034   -2.5094    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4927   -0.3476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7417   -1.0618    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  3  0  0  0  0
 10 12  1  0  0  0  0
 11 16  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
  4 18  1  0  0  0  0
  5 19  1  0  0  0  0
 11 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
  4  5  4  0  0  0  0
 22 23  1  0  0  0  0
 11 17  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27397

>  <IDNUMBER>
BAS 00379910

>  <Activity>
0
$$$$
ASI31344
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
    0.7725   -0.1191    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2449    0.1800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7115    0.2382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3185   -1.3736    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7367    1.7657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1452    1.7831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8083    0.7958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4840    2.2798    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
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  9 14  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
 13 24  1  0  0  0  0
 12 14  1  0  0  0  0
 11 15  4  0  0  0  0
 16 18  4  0  0  0  0
  8 17  4  0  0  0  0
  7 18  4  0  0  0  0
 16 19  1  0  0  0  0
 15 20  1  0  0  0  0
 12 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
  2  3  4  0  0  0  0
 15 17  4  0  0  0  0
 10 16  4  0  0  0  0
 13 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI31344

>  <IDNUMBER>
BAS 00401152

>  <Activity>
0
$$$$
ASI27170
  Marvin  04201015132D          

 30 34  0  0  1  0            999 V2000
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   -0.2861    1.6565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9847    2.9007    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.3950    3.7322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  4  7  4  0  0  0  0
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  2 10  1  0  0  0  0
 11 14  1  0  0  0  0
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  6 18  4  0  0  0  0
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  7 21  4  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 17 24  4  0  0  0  0
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 21 27  4  0  0  0  0
 25 28  4  0  0  0  0
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 28 30  4  0  0  0  0
 10 12  1  0  0  0  0
  3  6  4  0  0  0  0
 26 27  4  0  0  0  0
 29 30  4  0  0  0  0
 16 23  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27170

>  <IDNUMBER>
BAS 00371745

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

 19 22  0  0  0  0            999 V2000
    1.0220   34.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 19  1  1  0  0  0
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 13 15  1  0  0  0  0
 15 16  1  1  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
M  CHG  1  19   1
M  STY  1   1 DAT
M  SAL   1  1  12
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>
1gpn_HUB

$$$$
ASI12371
  Marvin  04201015132D          

 21 24  0  0  1  0            999 V2000
   -0.8377   -0.1487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6210    1.1302    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
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 13 15  1  0  0  0  0
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 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 12  1  0  0  0  0
  2 10  1  0  0  0  0
  2  9  1  0  0  0  0
 19 21  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI12371

>  <IDNUMBER>
BAS 00246871

>  <Activity>
0
$$$$
ASI24223
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
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   -0.7923    1.0065    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 18  4  0  0  0  0
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 17 21  4  0  0  0  0
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 19 23  4  0  0  0  0
 23 24  4  0  0  0  0
  3  5  1  0  0  0  0
  7 12  1  0  0  0  0
 16 20  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24223

>  <IDNUMBER>
BAS 00344578

>  <Activity>
0
$$$$
ASI6605
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 11 14  4  0  0  0  0
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 11 16  1  0  0  0  0
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 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
 12 17  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>
ASI6605

>  <IDNUMBER>
BAS 00139204

>  <Activity>
0
$$$$
ASI18153
  Marvin  04201015132D          

 21 24  0  0  0  0            999 V2000
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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
 20 21  4  0  0  0  0
  3  4  4  0  0  0  0
 11 12  1  0  0  0  0
 19 21  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18153

>  <IDNUMBER>
BAS 00312131

>  <Activity>
0
$$$$
ASI228
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
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   -1.1493    0.9475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3075    2.1933    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
  2  5  4  0  0  0  0
  6 18  1  0  0  0  0
  2  7  4  0  0  0  0
  5  8  4  0  0  0  0
  6  9  1  0  0  0  0
  7 10  4  0  0  0  0
 10 11  4  0  0  0  0
  9 12  1  0  0  0  0
  6 13  2  0  0  0  0
  6 14  2  0  0  0  0
  1 15  1  0  0  0  0
 12 16  2  0  0  0  0
  4 17  1  0  0  0  0
 18 24  1  0  0  0  0
 11 19  1  0  0  0  0
 10 20  1  0  0  0  0
  3 21  1  0  0  0  0
 12 22  1  0  0  0  0
 15 23  1  0  0  0  0
 23 24  1  0  0  0  0
 17 25  1  0  0  0  0
  4  5  4  0  0  0  0
  8 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI228

>  <IDNUMBER>
BAS 00009536

>  <Activity>
0
$$$$
ASI7047
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
   -0.5955    0.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5955   -0.8233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3150    0.4237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3150   -1.2271    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0224    0.0160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0224   -0.8154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1319    0.4636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1239    1.2870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3150    1.2470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8434    0.0480    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3230   -2.0464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7299    0.4237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4534   -0.8233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4047    0.4317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7011    1.6787    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
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  2  0  0  0  0
  3 10  1  0  0  0  0
  7 11  1  0  0  0  0
  4 12  1  0  0  0  0
 13 17  1  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 13 18  1  0  0  0  0
 13 19  1  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
 19 23  1  0  0  0  0
  5  6  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI7047

>  <IDNUMBER>
BAS 00141400

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

 24 25  0  0  0  0            999 V2000
   17.0768   11.4045    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.3623   10.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6478   11.4045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3623   10.1670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6478    9.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6478    8.9295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3623    8.5170    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   16.3623    7.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0768    7.2795    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0768    6.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7912    6.0420    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   17.7912    5.2170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5057    4.8045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2202    5.2170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9346    4.8045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9346    3.9795    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6491    3.5670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2202    6.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5057    6.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5057    7.2795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7912    7.6920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.7912    8.5170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0768    8.9295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0768    9.7545    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
  2  4  1  0  0  0  0
  4 24  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 23  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 19  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  1  0  0  0  0
 14 18  4  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 18 19  4  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  2   7   1  11   1
M  END
>  <Activity>
1

>  <PDB_ID>
2jez_HLO

$$$$
ASI25828
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    0.9026   -0.4319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1883   -0.8306    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9026    0.4263    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6279   -0.8528    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5592   -0.4319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3422   -0.4541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1883    0.8472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2735   -0.8306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2735    0.8472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3422    0.3655    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0289   -0.8804    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9878   -0.4319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9878    0.4263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7077   -0.8528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1883    1.6722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0455    0.7807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4220   -0.4541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0455    1.6057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1141   -0.8804    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
  6  8  4  0  0  0  0
  4  7  1  0  0  0  0
  3  8  4  0  0  0  0
  5  9  4  0  0  0  0
  6 10  4  0  0  0  0
  7 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  4  0  0  0  0
 10 14  4  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
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  5  6  4  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI25828

>  <IDNUMBER>
BAS 00364215

>  <Activity>
0
$$$$
ASI8715
  Marvin  04201015132D          

 18 18  0  0  0  0            999 V2000
    0.8527   -0.7456    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.8754    1.3842    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    0.8527    0.0994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4510    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3976   -0.0268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3190   -0.7686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  7  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
  1  6  1  0  0  0  0
  7 14  1  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
 14 15  1  0  0  0  0
 13 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 18  1  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI8715

>  <IDNUMBER>
BAS 00170757

>  <Activity>
0
$$$$
ASI11569
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.4797   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6496   -1.6280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1950   -0.4193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8089   -0.9483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2850   -0.4659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4800   -1.6280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9487    1.8281    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.9624   -2.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1163   -1.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7874   -2.3817    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
  1  5  1  0  0  0  0
  2  6  4  0  0  0  0
  7 14  1  0  0  0  0
  4  8  4  0  0  0  0
  5  9  2  0  0  0  0
  6 10  4  0  0  0  0
  5 11  1  0  0  0  0
  8 12  4  0  0  0  0
 10 13  4  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 12 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
  4  6  4  0  0  0  0
 12 13  4  0  0  0  0
 19 21  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI11569

>  <IDNUMBER>
BAS 00232865

>  <Activity>
0
$$$$
ASI30168
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    2.6904   -0.6600    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3146    0.5775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6087    0.9900    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4  5  1  0  0  0  0
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  2  7  2  0  0  0  0
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  1 10  4  0  0  0  0
  1 11  4  0  0  0  0
 12 16  4  0  0  0  0
  6 13  4  0  0  0  0
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 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 17 19  4  0  0  0  0
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  8 20  4  0  0  0  0
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 17 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
 17 18  4  0  0  0  0
 12 15  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30168

>  <IDNUMBER>
BAS 00393748

>  <Activity>
0
$$$$
ASI24136
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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 12 14  1  0  0  0  0
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  2 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  9 11  4  0  0  0  0
  5 18  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI24136

>  <IDNUMBER>
BAS 00344283

>  <Activity>
0
$$$$
ASI51
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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  3 17  1  0  0  0  0
 12 18  1  0  0  0  0
  4  5  4  0  0  0  0
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M  CHG  2   1   1  18  -1
M  END
>  <NAME>
ASI51

>  <IDNUMBER>
BAS 00004255

>  <Activity>
0
$$$$
ASI6549
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
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 13 16  4  0  0  0  0
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 13 18  1  0  0  0  0
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 23 24  1  0  0  0  0
 22 25  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>
ASI6549

>  <IDNUMBER>
BAS 00138228

>  <Activity>
0
$$$$
ASI21863
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
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 11 13  1  0  0  0  0
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 16 20  4  0  0  0  0
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 25 28  4  0  0  0  0
 28 29  4  0  0  0  0
 15 21  4  0  0  0  0
  4 11  1  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI21863

>  <IDNUMBER>
BAS 00331578

>  <Activity>
0
$$$$
ASI20277
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
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  1  8  1  0  0  0  0
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 13 15  4  0  0  0  0
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  8 18  4  0  0  0  0
  8 19  4  0  0  0  0
 11 20  4  0  0  0  0
 11 21  4  0  0  0  0
 19 22  4  0  0  0  0
 18 23  4  0  0  0  0
 21 24  4  0  0  0  0
 20 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
  4  5  1  0  0  0  0
 22 26  4  0  0  0  0
 12 16  4  0  0  0  0
 24 27  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI20277

>  <IDNUMBER>
BAS 00320546

>  <Activity>
0
$$$$
ASI10163
  Marvin  04201015132D          

 30 33  0  0  1  0            999 V2000
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  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
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  1  9  1  0  0  0  0
  5 10  4  0  0  0  0
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 12 15  4  0  0  0  0
  6 13  1  0  0  0  0
 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
 12 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
  7 21  4  0  0  0  0
  7 22  4  0  0  0  0
 13 23  4  0  0  0  0
 13 24  4  0  0  0  0
 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
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 23 28  4  0  0  0  0
 25 29  4  0  0  0  0
 28 30  4  0  0  0  0
 12 14  4  0  0  0  0
 27 30  4  0  0  0  0
  8 20  1  0  0  0  0
 26 29  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10163

>  <IDNUMBER>
BAS 00217930

>  <Activity>
0
$$$$
ASI30174
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
    2.1221   -0.5729    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
  3 14  1  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
  4  7  1  0  0  0  0
  6  8  4  0  0  0  0
  2  9  2  0  0  0  0
  2 10  1  0  0  0  0
  1 11  4  0  0  0  0
  4 12  2  0  0  0  0
 13 17  4  0  0  0  0
 14 18  4  0  0  0  0
  7 15  4  0  0  0  0
  7 16  4  0  0  0  0
 11 17  4  0  0  0  0
 15 18  4  0  0  0  0
 16 19  4  0  0  0  0
  8 20  4  0  0  0  0
 10 21  4  0  0  0  0
 10 22  4  0  0  0  0
 13 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
 23 27  4  0  0  0  0
 26 28  4  0  0  0  0
  8 13  4  0  0  0  0
 24 27  4  0  0  0  0
 14 19  4  0  0  0  0
 25 28  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30174

>  <IDNUMBER>
BAS 00393757

>  <Activity>
0
$$$$
ASI21677
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -2.7032   -0.5457    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0466   -1.0361    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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  5 10  1  0  0  0  0
 11 12  4  0  0  0  0
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  2 13  2  0  0  0  0
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 10 15  4  0  0  0  0
 15 16  1  0  0  0  0
 10 17  4  0  0  0  0
 15 18  4  0  0  0  0
 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3  6  1  0  0  0  0
  5 11  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI21677

>  <IDNUMBER>
BAS 00330666

>  <Activity>
0
$$$$
ASI18195
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.6482   -0.3127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1004    0.3769    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 13 15  4  0  0  0  0
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 11 18  1  0  0  0  0
 17 19  4  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  5  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>
ASI18195

>  <IDNUMBER>
BAS 00312385

>  <Activity>
0
$$$$
ASI21156
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    1.6350    1.4492    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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  4 14  1  0  0  0  0
  5  6  4  0  0  0  0
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  9 11  1  0  0  0  0
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
  1 12  1  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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  5 17  4  0  0  0  0
 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
  4 15  1  0  0  0  0
  2  5  4  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI21156

>  <IDNUMBER>
BAS 00327259

>  <Activity>
0
$$$$
ASI24224
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.2722    0.6031    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
  4  5  4  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  2  0  0  0  0
  3  8  2  0  0  0  0
  6  9  1  0  0  0  0
  4 10  4  0  0  0  0
  5 11  4  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 16  4  0  0  0  0
 11 16  4  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3  4  1  0  0  0  0
 10 15  4  0  0  0  0
 17 19  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24224

>  <IDNUMBER>
BAS 00344582

>  <Activity>
0
$$$$
ASI11073
  Marvin  04201015132D          

 23 23  0  0  1  0            999 V2000
    1.8013    0.8397    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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  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  5 17  1  0  0  0  0
  6 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8 20  1  0  0  0  0
 10 21  1  0  0  0  0
 10 22  1  0  0  0  0
 21 23  1  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11073

>  <IDNUMBER>
BAS 00227819

>  <Activity>
0
$$$$
ASI14209
  Marvin  04201015132D          

 30 33  0  0  0  0            999 V2000
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   -3.1318    0.7122    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2 14  1  0  0  0  0
  3  7  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  2  0  0  0  0
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  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  3 10  2  0  0  0  0
  2 11  1  0  0  0  0
  5 12  4  0  0  0  0
  5 13  4  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 16 18  4  0  0  0  0
  6 17  1  0  0  0  0
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 11 20  1  0  0  0  0
 17 21  4  0  0  0  0
 17 22  4  0  0  0  0
 20 23  4  0  0  0  0
 20 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
  2 15  1  0  0  0  0
 16 19  4  0  0  0  0
 25 29  4  0  0  0  0
 27 30  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI14209

>  <IDNUMBER>
BAS 00274738

>  <Activity>
0
$$$$
ASI7488
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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   -0.3869    0.1500    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
  2  6  1  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  6  9  4  0  0  0  0
 10 12  4  0  0  0  0
  1 11  1  0  0  0  0
  9 12  4  0  0  0  0
  3 13  1  0  0  0  0
  8 14  1  0  0  0  0
  4 15  4  0  0  0  0
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 10 17  1  0  0  0  0
 14 18  1  0  0  0  0
 17 19  1  0  0  0  0
 15 20  4  0  0  0  0
 16 21  4  0  0  0  0
  3  5  4  0  0  0  0
 20 21  4  0  0  0  0
  8 10  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI7488

>  <IDNUMBER>
BAS 00154832

>  <Activity>
0
$$$$
ASI7028
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
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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
 19 22  1  0  0  0  0
 13 23  4  0  0  0  0
 16 24  4  0  0  0  0
  5  6  4  0  0  0  0
 23 24  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>
ASI7028

>  <IDNUMBER>
BAS 00141378

>  <Activity>
0
$$$$
ASI30188
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 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
  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>
ASI30188

>  <IDNUMBER>
BAS 00393825

>  <Activity>
0
$$$$
ASI24399
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
   -0.9374    0.0328    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9843    0.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1500   -0.1735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1969    1.1343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6593   -0.3750    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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  3  4  1  0  0  0  0
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  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
 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
  4  5  1  0  0  0  0
 16 17  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24399

>  <IDNUMBER>
BAS 00345407

>  <Activity>
0
$$$$
ASI16650
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.6137    0.9223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1171    1.2451    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
  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>
ASI16650

>  <IDNUMBER>
BAS 00292449

>  <Activity>
0
$$$$
ASI9394
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
    2.1030   -0.2767    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1030    0.5442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2137   -0.2952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2137    0.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9193   -1.5127    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
  2  4  1  0  0  0  0
  5  6  1  0  0  0  0
  2  6  1  0  0  0  0
  7 12  4  0  0  0  0
  7  8  1  0  0  0  0
  3  9  2  0  0  0  0
  3 10  1  0  0  0  0
 11 16  4  0  0  0  0
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  5 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  4  0  0  0  0
 14 16  4  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
  4 10  1  0  0  0  0
  7 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI9394

>  <IDNUMBER>
BAS 00194050

>  <Activity>
0
$$$$
ASI10832
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    1.2043    0.6178    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0294    0.6178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4400    1.3256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2630    0.6178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0195    1.3216    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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 12 15  1  0  0  0  0
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 13 15  1  0  0  0  0
 12 16  1  0  0  0  0
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 16 20  4  0  0  0  0
 16 21  4  0  0  0  0
 18 22  4  0  0  0  0
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 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
  4 11  1  0  0  0  0
 22 26  4  0  0  0  0
 24 27  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI10832

>  <IDNUMBER>
BAS 00226229

>  <Activity>
0
$$$$
ASI360
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
   -0.1882   -0.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6305    0.5238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5 11  1  0  0  0  0
 10 12  2  0  0  0  0
 13 15  4  0  0  0  0
 10 14  1  0  0  0  0
 11 15  4  0  0  0  0
  6 16  4  0  0  0  0
  9 17  4  0  0  0  0
 11 18  4  0  0  0  0
 13 19  4  0  0  0  0
 18 20  4  0  0  0  0
 16 21  4  0  0  0  0
 17 22  4  0  0  0  0
  6  9  4  0  0  0  0
  7  8  1  0  0  0  0
 21 22  4  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  2   4   1  14  -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>
ASI360

>  <IDNUMBER>
BAS 00012703

>  <Activity>
0
$$$$
ASI15367
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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 13 16  4  0  0  0  0
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 12 16  4  0  0  0  0
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 17 18  1  0  0  0  0
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 23 24  4  0  0  0  0
  3  4  1  0  0  0  0
 22 24  4  0  0  0  0
 10 13  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI15367

>  <IDNUMBER>
BAS 00285506

>  <Activity>
0
$$$$
ASI11152
  Marvin  04201015132D          

 25 26  0  0  1  0            999 V2000
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  5 10  1  0  0  0  0
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 10 12  4  0  0  0  0
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 12 15  4  0  0  0  0
 16 20  4  0  0  0  0
  9 17  2  0  0  0  0
 10 18  4  0  0  0  0
 11 19  2  0  0  0  0
 18 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  1  0  0  0  0
 16 25  1  0  0  0  0
  4  6  2  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11152

>  <IDNUMBER>
BAS 00228521

>  <Activity>
0
$$$$
ASI23570
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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  3 10  2  0  0  0  0
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 14 17  4  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
 13 19  4  0  0  0  0
 13 20  4  0  0  0  0
 14 21  1  0  0  0  0
 20 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 24  4  0  0  0  0
  3  5  1  0  0  0  0
 23 24  4  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI23570

>  <IDNUMBER>
BAS 00341274

>  <Activity>
0
$$$$
ASI13285
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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  2  5  1  0  0  0  0
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  1  4  1  0  0  0  0
  5  6  1  0  0  0  0
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  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  2 10  2  0  0  0  0
  4 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  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
 13 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
 22 25  4  0  0  0  0
 24 26  4  0  0  0  0
 11 12  1  0  0  0  0
  6  9  1  0  0  0  0
 21 25  4  0  0  0  0
 23 26  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI13285

>  <IDNUMBER>
BAS 00261048

>  <Activity>
0
$$$$
ASI6608
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.5874    0.1368    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.1870    0.7283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9836    0.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  8  1  0  0  0  0
  2  9  4  0  0  0  0
  4 10  4  0  0  0  0
 11 12  4  0  0  0  0
  9 12  4  0  0  0  0
  5 13  1  0  0  0  0
  8 14  1  0  0  0  0
  3 15  1  0  0  0  0
 15 16  1  0  0  0  0
 10 17  1  0  0  0  0
  9 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 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
 13 16  1  0  0  0  0
 10 11  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI6608

>  <IDNUMBER>
BAS 00139213

>  <Activity>
0
$$$$
1eve_E20
  Marvin  04201014582D          

 28 31  0  0  0  0            999 V2000
    5.8529   33.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
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M  END
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1

>  <PDB_ID>
1eve_E20

$$$$
ASI614
  Marvin  04201015132D          

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M  END
>  <NAME>
ASI614

>  <IDNUMBER>
BAS 00024158

>  <Activity>
0
$$$$
ASI23365
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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M  END
>  <NAME>
ASI23365

>  <IDNUMBER>
BAS 00340749

>  <Activity>
0
$$$$
ASI15812
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
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M  END
>  <NAME>
ASI15812

>  <IDNUMBER>
BAS 00287803

>  <Activity>
0
$$$$
ASI18196
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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M  END
>  <NAME>
ASI18196

>  <IDNUMBER>
BAS 00312386

>  <Activity>
0
$$$$
ASI28956
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
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  5  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
  6 14  1  0  0  0  0
  5 15  1  0  0  0  0
 16 23  1  0  0  0  0
 10 17  1  0  0  0  0
 18 19  1  0  0  0  0
 19 22  1  0  0  0  0
 13 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 17 25  4  0  0  0  0
 17 26  4  0  0  0  0
 26 27  4  0  0  0  0
 25 28  4  0  0  0  0
 28 29  4  0  0  0  0
  4  6  4  0  0  0  0
  8  9  4  0  0  0  0
 27 29  4  0  0  0  0
 16 24  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>
ASI28956

>  <IDNUMBER>
BAS 00387084

>  <Activity>
0
$$$$
ASI33356
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    0.6579   -0.8746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1671   -0.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6083   -0.4491    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
  2  5  1  0  0  0  0
  3  6  4  0  0  0  0
  1  7  1  0  0  0  0
  5  8  2  0  0  0  0
  4  9  4  0  0  0  0
  7 10  2  0  0  0  0
  6 11  4  0  0  0  0
  8 12  1  0  0  0  0
  9 13  4  0  0  0  0
  7 14  1  0  0  0  0
 11 15  4  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
 18 20  1  0  0  0  0
  4  6  4  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   5   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>
ASI33356

>  <IDNUMBER>
BAS 00411370

>  <Activity>
0
$$$$
ASI7999
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -2.5283    0.4434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7563    0.0512    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5283   -0.3752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0957   -0.3752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3794    0.8698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3369   -0.3582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7695    0.4605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2021   -0.3752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8928    0.8527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  4  0  0  0  0
  1  3  4  0  0  0  0
  1  4  4  0  0  0  0
  5 13  1  0  0  0  0
  3  6  4  0  0  0  0
  1  7  4  0  0  0  0
  7  8  4  0  0  0  0
  3  9  4  0  0  0  0
 10 12  1  0  0  0  0
  8 11  4  0  0  0  0
 12 17  4  0  0  0  0
  8 13  1  0  0  0  0
 10 14  2  0  0  0  0
  5 15  4  0  0  0  0
  5 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
 10 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  2  6  4  0  0  0  0
  9 11  4  0  0  0  0
 12 18  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI7999

>  <IDNUMBER>
BAS 00161862

>  <Activity>
0
$$$$
ASI22916
  Marvin  04201015132D          

 19 22  0  0  1  0            999 V2000
   -0.7491    0.5346    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3473   -0.8138    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1634   -0.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1747   -0.7185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0566    0.2724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1430   -1.6922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5016   -0.2826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9000   -0.4665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9398    0.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6207   -0.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5333    0.7525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7580    0.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2871   -1.5901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4073   -0.0783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8796    1.2497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3369    1.0862    0.0000 O   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  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
  5 10  1  0  0  0  0
  3 11  1  0  0  0  0
 11 12  4  0  0  0  0
 11 13  4  0  0  0  0
 14 17  4  0  0  0  0
  5 15  1  0  0  0  0
  4 16  1  0  0  0  0
 12 17  4  0  0  0  0
 13 18  4  0  0  0  0
 14 19  1  0  0  0  0
  4 10  1  0  0  0  0
  2  9  1  0  0  0  0
  2  8  1  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI22916

>  <IDNUMBER>
BAS 00337660

>  <Activity>
0
$$$$
ASI10844
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
   -1.7659    0.9620    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6033   -0.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3511    0.5736    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4788    1.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0317    2.0730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7813   -0.0406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4162   -0.9620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3097    1.5852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0090   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3529    1.5491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0142    0.1807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3774   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0142   -2.3440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2239   -2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7865   -0.0135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1343    1.3323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0033   -0.3929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7956    0.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  3  4  1  0  0  0  0
  4 12  1  0  0  0  0
  1  5  1  0  0  0  0
  6 18  1  0  0  0  0
  7 11  1  0  0  0  0
  7  8  2  0  0  0  0
  5  9  1  0  0  0  0
  2 10  4  0  0  0  0
  1 11  1  0  0  0  0
  9 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
 16 17  4  0  0  0  0
  3 17  4  0  0  0  0
 14 18  1  0  0  0  0
 13 19  1  0  0  0  0
  2 20  4  0  0  0  0
 16 21  4  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
  6 19  1  0  0  0  0
 10 21  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10844

>  <IDNUMBER>
BAS 00226266

>  <Activity>
0
$$$$
1n5r_PRM
  Marvin  04201014582D          

 31 34  0  0  0  0            999 V2000
   18.3101   11.8586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6838   12.5941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5076   12.6382    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   18.7280   13.8357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3315   12.6824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7051   13.4179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5290   13.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9026   14.1976    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   23.1766   13.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0004   13.5945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4505   12.9031    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   23.9239   15.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1001   14.9773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   22.5735   17.0955    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
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
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 10 25  4  0  0  0  0
 10 11  4  0  0  0  0
 11 17  4  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
 13 15  4  0  0  0  0
 15 16  4  0  0  0  0
 16 17  4  0  0  0  0
 17 18  4  0  0  0  0
 18 24  4  0  0  0  0
 18 19  4  0  0  0  0
 19 20  4  0  0  0  0
 20 21  4  0  0  0  0
 21 22  1  0  0  0  0
 21 23  4  0  0  0  0
 23 24  4  0  0  0  0
 24 25  4  0  0  0  0
 25 26  1  0  0  0  0
 26 31  4  0  0  0  0
 26 27  4  0  0  0  0
 27 28  4  0  0  0  0
 28 29  4  0  0  0  0
 29 30  4  0  0  0  0
 30 31  4  0  0  0  0
M  CHG  2   3   1  10   1
M  END
>  <Activity>
1

>  <PDB_ID>
1n5r_PRM

$$$$
ASI24574
  Marvin  04201015132D          

 29 32  0  0  1  0            999 V2000
    0.5459    1.0616    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1752   -0.1752    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  8  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
  2 10  1  0  0  0  0
 11 14  1  0  0  0  0
  2 12  2  0  0  0  0
  5 13  2  0  0  0  0
  6 14  1  0  0  0  0
  5 15  1  0  0  0  0
 16 20  1  0  0  0  0
  4 17  4  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 11 22  4  0  0  0  0
 15 23  1  0  0  0  0
 15 24  1  0  0  0  0
 17 25  4  0  0  0  0
 22 26  4  0  0  0  0
 23 27  1  0  0  0  0
 24 28  1  0  0  0  0
 27 29  1  0  0  0  0
  4 11  4  0  0  0  0
 25 26  4  0  0  0  0
 16 21  1  0  0  0  0
 28 29  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24574

>  <IDNUMBER>
BAS 00346380

>  <Activity>
0
$$$$
ASI11234
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    1.5374   -0.2028    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.9502    1.2331    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7919   -2.3541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8434    0.5178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2 20  1  0  0  0  0
  3  6  1  0  0  0  0
  4  5  1  0  0  0  0
  5 13  4  0  0  0  0
  6 15  4  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  2  9  4  0  0  0  0
  1 10  4  0  0  0  0
  1 11  4  0  0  0  0
  2 12  4  0  0  0  0
  9 13  4  0  0  0  0
 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
 12 16  4  0  0  0  0
  4 17  1  0  0  0  0
  3 18  1  0  0  0  0
 19 21  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  0  0  0  0
  6 14  4  0  0  0  0
  5 16  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI11234

>  <IDNUMBER>
BAS 00229961

>  <Activity>
0
$$$$
ASI13430
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -1.1673    0.1804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8892    0.9794    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1853    0.1804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0726    0.9794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1292   -0.8942    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
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  6 10  1  0  0  0  0
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 11 12  4  0  0  0  0
 12 13  1  0  0  0  0
 14 15  4  0  0  0  0
  9 15  4  0  0  0  0
 14 16  4  0  0  0  0
 10 17  4  0  0  0  0
 10 18  4  0  0  0  0
 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
 12 16  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI13430

>  <IDNUMBER>
BAS 00262590

>  <Activity>
0
$$$$
ASI21149
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
   -1.2357   -0.5964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0607   -0.5964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8250   -1.3035    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  5  4  0  0  0  0
  3  6  4  0  0  0  0
  7 14  1  0  0  0  0
  1  8  4  0  0  0  0
  6  9  4  0  0  0  0
 10 19  1  0  0  0  0
  8 11  1  0  0  0  0
 12 13  4  0  0  0  0
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 14 15  1  0  0  0  0
 15 18  1  0  0  0  0
  7 16  1  0  0  0  0
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 11 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  6 21  4  0  0  0  0
  9 22  4  0  0  0  0
 22 23  4  0  0  0  0
 21 24  4  0  0  0  0
  4  9  4  0  0  0  0
  5 12  4  0  0  0  0
 23 24  4  0  0  0  0
 10 20  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI21149

>  <IDNUMBER>
BAS 00327248

>  <Activity>
0
$$$$
ASI27124
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    0.7569    0.3132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0485   -0.1081    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
  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
  4  6  1  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI27124

>  <IDNUMBER>
BAS 00371608

>  <Activity>
0
$$$$
ASI22251
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
    0.4812   -0.0243    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  7  2  0  0  0  0
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 14 15  1  0  0  0  0
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 14 16  1  0  0  0  0
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 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
  8  9  1  0  0  0  0
 19 22  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI22251

>  <IDNUMBER>
BAS 00333754

>  <Activity>
0
$$$$
ASI27399
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
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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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  9 11  1  0  0  0  0
  5 10  1  0  0  0  0
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  3 14  1  0  0  0  0
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 10 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 14 19  1  0  0  0  0
 10 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
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
  3  5  4  0  0  0  0
 19 20  1  0  0  0  0
 22 25  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27399

>  <IDNUMBER>
BAS 00379914

>  <Activity>
0
$$$$
ASI10860
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
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  2  4  1  0  0  0  0
  1  5  4  0  0  0  0
  1  6  1  0  0  0  0
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  3  8  1  0  0  0  0
  3  9  2  0  0  0  0
  2 10  4  0  0  0  0
  5 11  4  0  0  0  0
 10 12  4  0  0  0  0
 13 23  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
 16 17  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
  7 20  1  0  0  0  0
  7 21  1  0  0  0  0
  5 22  4  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 11 25  4  0  0  0  0
 22 26  4  0  0  0  0
 26 27  4  0  0  0  0
 11 12  4  0  0  0  0
 13 24  1  0  0  0  0
 25 27  4  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10860

>  <IDNUMBER>
BAS 00226311

>  <Activity>
0
$$$$
ASI25870
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  1  3  1  0  0  0  0
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 11 14  4  0  0  0  0
 10 15  4  0  0  0  0
 13 16  1  0  0  0  0
 12 17  1  0  0  0  0
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  9 22  1  0  0  0  0
 20 23  4  0  0  0  0
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 18 25  4  0  0  0  0
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 25 27  4  0  0  0  0
 23 28  4  0  0  0  0
  8 16  1  0  0  0  0
  9 15  4  0  0  0  0
 24 27  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI25870

>  <IDNUMBER>
BAS 00364531

>  <Activity>
0
$$$$
ASI7024
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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 12 14  1  0  0  0  0
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 13 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
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>
ASI7024

>  <IDNUMBER>
BAS 00141372

>  <Activity>
0
$$$$
ASI30375
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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 14 16  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
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M  CHG  1  14   1
M  END
>  <NAME>
ASI30375

>  <IDNUMBER>
BAS 00394547

>  <Activity>
0
$$$$
ASI23399
  Marvin  04201015132D          

 25 28  0  0  1  0            999 V2000
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  2  4  4  0  0  0  0
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  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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  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>
ASI23399

>  <IDNUMBER>
BAS 00340845

>  <Activity>
0
$$$$
ASI7347
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.9936    0.3141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9076   -0.4030    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
  3 10  1  0  0  0  0
  4  8  1  0  0  0  0
  5  7  1  0  0  0  0
  2  6  4  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  2  0  0  0  0
  5 10  2  0  0  0  0
  3 11  4  0  0  0  0
 12 19  1  0  0  0  0
 13 15  4  0  0  0  0
  2 14  1  0  0  0  0
 11 15  4  0  0  0  0
 13 16  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 12 20  1  0  0  0  0
  6 13  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI7347

>  <IDNUMBER>
BAS 00149626

>  <Activity>
0
$$$$
ASI30193
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
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  2 11  1  0  0  0  0
  3  4  4  0  0  0  0
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  5  9  1  0  0  0  0
  2  6  4  0  0  0  0
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  6  8  4  0  0  0  0
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  5 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
 13 18  1  0  0  0  0
  6 19  4  0  0  0  0
  8 20  4  0  0  0  0
 18 21  4  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
 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
 26 27  4  0  0  0  0
  9 16  4  0  0  0  0
 25 27  4  0  0  0  0
  3  8  4  0  0  0  0
 20 24  4  0  0  0  0
M  CHG  1   1   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>
ASI30193

>  <IDNUMBER>
BAS 00393860

>  <Activity>
0
$$$$
ASI24258
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.0507    0.0084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7687    0.4252    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  4  0  0  0  0
  1  5  2  0  0  0  0
  2  6  4  0  0  0  0
  3  7  1  0  0  0  0
  4  8  4  0  0  0  0
  6  9  4  0  0  0  0
  9 10  4  0  0  0  0
  7 11  1  0  0  0  0
  5 12  1  0  0  0  0
 13 16  4  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
  7 18  1  0  0  0  0
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  9 20  1  0  0  0  0
 10 21  1  0  0  0  0
 13 22  1  0  0  0  0
  4 11  1  0  0  0  0
 13 17  4  0  0  0  0
  8 10  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24258

>  <IDNUMBER>
BAS 00345113

>  <Activity>
0
$$$$
ASI10563
  Marvin  04201015132D          

 20 23  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
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  4  0  0  0  0
  2  9  4  0  0  0  0
  4 10  4  0  0  0  0
  5 11  4  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  9 14  4  0  0  0  0
  8 15  4  0  0  0  0
 14 16  4  0  0  0  0
 15 17  4  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
  4  5  4  0  0  0  0
 11 17  4  0  0  0  0
 10 16  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI10563

>  <IDNUMBER>
BAS 00222461

>  <Activity>
0
$$$$
ASI7058
  Marvin  04201015132D          

 23 26  0  0  1  0            999 V2000
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   -2.2012   -1.6868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5074    0.4127    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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 13 23  1  0  0  0  0
 14 21  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 16 23  1  0  0  0  0
  8  9  4  0  0  0  0
 11 12  1  0  0  0  0
 14 20  1  0  0  0  0
 13 22  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI7058

>  <IDNUMBER>
BAS 00141588

>  <Activity>
0
$$$$
ASI17980
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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 12 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 18 21  1  0  0  0  0
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 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
  3  5  4  0  0  0  0
  8 13  4  0  0  0  0
 22 24  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI17980

>  <IDNUMBER>
BAS 00311436

>  <Activity>
0
$$$$
ASI17
  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
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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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  3  9  1  0  0  0  0
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 12 13  1  0  0  0  0
 10 13  1  0  0  0  0
  5 14  4  0  0  0  0
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 11 17  4  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  4  0  0  0  0
 19 21  1  0  0  0  0
  4  5  4  0  0  0  0
 17 20  4  0  0  0  0
 18 21  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI17

>  <IDNUMBER>
BAS 00002001

>  <Activity>
0
$$$$
ASI7039
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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 16 17  1  0  0  0  0
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 12 20  1  0  0  0  0
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 18 24  1  0  0  0  0
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 25 26  1  0  0  0  0
  5  6  4  0  0  0  0
 22 23  4  0  0  0  0
 24 26  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7039

>  <IDNUMBER>
BAS 00141392

>  <Activity>
0
$$$$
ASI14838
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
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   -2.7910    1.4615    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 21 23  4  0  0  0  0
 22 24  4  0  0  0  0
  2  5  4  0  0  0  0
 11 12  4  0  0  0  0
 15 19  4  0  0  0  0
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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>
ASI14838

>  <IDNUMBER>
BAS 00282196

>  <Activity>
0
$$$$
ASI12608
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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M  CHG  1  11   1
M  END
>  <NAME>
ASI12608

>  <IDNUMBER>
BAS 00253551

>  <Activity>
0
$$$$
ASI15944
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
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    1.4848    3.1853    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
  5 11  1  0  0  0  0
 12 15  1  0  0  0  0
  7 13  1  0  0  0  0
  9 14  2  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
 12 19  1  0  0  0  0
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 18 21  1  0  0  0  0
 17 22  1  0  0  0  0
 20 23  1  0  0  0  0
 19 24  1  0  0  0  0
 21 25  1  0  0  0  0
 24 26  1  0  0  0  0
  8  9  4  0  0  0  0
  4  5  4  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
M  CHG  1  12   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>
ASI15944

>  <IDNUMBER>
BAS 00288262

>  <Activity>
0
$$$$
ASI10868
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
   -0.8424    0.4929    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0964    0.1685    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8424    1.3103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0964    1.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2773    1.3103    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  6  1  0  0  0  0
  4  7  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
  8 12  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  3 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 16  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
  1 16  1  0  0  0  0
 14 17  4  0  0  0  0
 15 18  4  0  0  0  0
 13 19  2  0  0  0  0
 18 20  4  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
  3 10  1  0  0  0  0
  2  9  1  0  0  0  0
  2 11  1  0  0  0  0
 17 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10868

>  <IDNUMBER>
BAS 00226342

>  <Activity>
0
$$$$
ASI21152
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.8161    0.3701    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2927    1.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2927   -0.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0683    0.7807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0683   -0.0456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7780    1.2014    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
  6 12  4  0  0  0  0
  1  7  1  0  0  0  0
  3  8  2  0  0  0  0
  2  9  2  0  0  0  0
  7 10  4  0  0  0  0
  7 11  4  0  0  0  0
 10 12  4  0  0  0  0
 11 13  4  0  0  0  0
  6 14  1  0  0  0  0
  4 15  4  0  0  0  0
  5 16  4  0  0  0  0
 14 17  1  0  0  0  0
 18 19  1  0  0  0  0
 17 19  1  0  0  0  0
 15 20  4  0  0  0  0
 16 21  4  0  0  0  0
 18 22  1  0  0  0  0
  4  5  4  0  0  0  0
  6 13  4  0  0  0  0
 20 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI21152

>  <IDNUMBER>
BAS 00327252

>  <Activity>
0
$$$$
ASI27214
  Marvin  04201015132D          

 31 34  0  0  0  0            999 V2000
    1.4744    0.5465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8816   -0.2629    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
  7  9  4  0  0  0  0
  4  8  4  0  0  0  0
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  6 10  4  0  0  0  0
 11 13  1  0  0  0  0
  4 12  4  0  0  0  0
  7 13  1  0  0  0  0
  8 14  4  0  0  0  0
 10 15  4  0  0  0  0
 11 16  1  0  0  0  0
 11 17  2  0  0  0  0
 16 18  4  0  0  0  0
 16 19  4  0  0  0  0
 20 22  4  0  0  0  0
  3 21  1  0  0  0  0
 12 22  4  0  0  0  0
  8 23  1  0  0  0  0
 24 25  4  0  0  0  0
 19 25  4  0  0  0  0
 18 26  4  0  0  0  0
 20 27  1  0  0  0  0
 24 28  1  0  0  0  0
 23 29  1  0  0  0  0
 27 30  1  0  0  0  0
 28 31  1  0  0  0  0
  5  6  4  0  0  0  0
  7 15  4  0  0  0  0
 14 20  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI27214

>  <IDNUMBER>
BAS 00372050

>  <Activity>
0
$$$$
ASI3230
  Marvin  04201015132D          

 29 31  0  0  1  0            999 V2000
   -0.9151    0.7104    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3205   -1.1198    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2 11  1  0  0  0  0
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  4 14  1  0  0  0  0
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  1  6  1  0  0  0  0
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  6  8  1  0  0  0  0
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  1 10  1  0  0  0  0
 11 17  1  0  0  0  0
  2 12  1  0  0  0  0
  1 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
  5 16  1  0  0  0  0
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  3 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 20  4  0  0  0  0
  8 21  4  0  0  0  0
  9 22  4  0  0  0  0
  9 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
 23 27  4  0  0  0  0
 25 28  4  0  0  0  0
 27 29  4  0  0  0  0
 24 28  4  0  0  0  0
 12 16  1  0  0  0  0
 26 29  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI3230

>  <IDNUMBER>
BAS 00104355

>  <Activity>
0
$$$$
ASI17983
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.2488    0.7050    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
  4  5  4  0  0  0  0
  1  5  4  0  0  0  0
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  5  8  4  0  0  0  0
  9 10  4  0  0  0  0
  8 10  4  0  0  0  0
  2 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  2  0  0  0  0
 11 14  1  0  0  0  0
  9 15  1  0  0  0  0
  7 16  1  0  0  0  0
 10 17  1  0  0  0  0
 12 18  4  0  0  0  0
 12 19  4  0  0  0  0
 14 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
 22 23  1  0  0  0  0
 18 24  4  0  0  0  0
 19 25  4  0  0  0  0
 24 26  4  0  0  0  0
  3  4  4  0  0  0  0
  6  9  4  0  0  0  0
 25 26  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI17983

>  <IDNUMBER>
BAS 00311444

>  <Activity>
0
$$$$
ASI3680
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.1085    0.4684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7242    0.4684    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3599    1.2533    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9714    1.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0400   -0.2428    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
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  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
 11 14  4  0  0  0  0
 10 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
 17 19  1  0  0  0  0
  4  7  1  0  0  0  0
 16 19  1  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI3680

>  <IDNUMBER>
BAS 00109971

>  <Activity>
0
$$$$
ASI24213
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
    1.6901   -0.1190    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9998    0.2857    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8865    1.1427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3746   -0.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4285    1.1188    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.2616   -0.8153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1186    0.5713    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9998    1.1188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2857   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1427    1.5712    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
  5 17  1  0  0  0  0
  3  6  4  0  0  0  0
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  1  8  2  0  0  0  0
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  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  5 12  1  0  0  0  0
  3 13  4  0  0  0  0
  7 14  1  0  0  0  0
 15 16  4  0  0  0  0
 13 16  4  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
  4 19  4  0  0  0  0
  4 20  4  0  0  0  0
 20 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
 14 25  1  0  0  0  0
 14 26  1  0  0  0  0
 14 27  1  0  0  0  0
 23 28  1  0  0  0  0
  5 18  1  0  0  0  0
 21 23  4  0  0  0  0
  7 15  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24213

>  <IDNUMBER>
BAS 00344550

>  <Activity>
0
$$$$
ASI13601
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -2.8142    0.3964    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8964   -0.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6070   -0.8321    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0143    0.3964    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2249   -0.4393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1750   -0.8571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8892    0.3857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7357    0.8072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500    0.3857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1571    0.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500   -0.4429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1107    0.8072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6928    0.8072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5213    0.8072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.2249    0.3964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5213   -0.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6070   -1.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3107   -0.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  4  0  0  0  0
  2  3  1  0  0  0  0
  4 14  1  0  0  0  0
  5 17  1  0  0  0  0
  6 11  4  0  0  0  0
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  4  8  2  0  0  0  0
  8  9  1  0  0  0  0
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  9 11  4  0  0  0  0
  1 12  1  0  0  0  0
 12 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
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  3 19  1  0  0  0  0
  3 20  1  0  0  0  0
  5 18  1  0  0  0  0
  2  7  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI13601

>  <IDNUMBER>
BAS 00266400

>  <Activity>
0
$$$$
ASI19862
  Marvin  04201015132D          

 25 26  0  0  1  0            999 V2000
   -0.4192    0.0227    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2622    0.0227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6905   -0.6744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4536   -1.4718    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4055    0.0227    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5199   -0.6652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7841   -1.4399    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6723    0.7473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4192   -0.8019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4192    0.8566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8019    2.1553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4970    0.7701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9026    0.0227    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  4  0  0  0  0
  3  4  4  0  0  0  0
  1  5  1  0  0  0  0
  3  6  4  0  0  0  0
  4  7  4  0  0  0  0
  6  8  4  0  0  0  0
  9 15  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 14  1  0  0  0  0
  5 14  1  0  0  0  0
 15 20  1  0  0  0  0
 10 16  4  0  0  0  0
 16 17  4  0  0  0  0
 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
  5 21  1  0  0  0  0
 13 22  1  0  0  0  0
 13 23  1  0  0  0  0
 19 24  1  0  0  0  0
 19 25  1  0  0  0  0
  6 17  4  0  0  0  0
  7  8  4  0  0  0  0
M  CHG  1  19   1
M  END
>  <NAME>
ASI19862

>  <IDNUMBER>
BAS 00318965

>  <Activity>
0
$$$$
ASI6602
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.6297    0.3188    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
  4  5  4  0  0  0  0
  3  5  1  0  0  0  0
  6  7  3  0  0  0  0
  4  7  1  0  0  0  0
  2  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
  2 12  1  0  0  0  0
  1 13  1  0  0  0  0
 10 14  4  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
 20 21  4  0  0  0  0
 12 16  1  0  0  0  0
  9 11  4  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI6602

>  <IDNUMBER>
BAS 00139200

>  <Activity>
0
$$$$
ASI4037
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
   -2.3530    0.6329    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5031   -0.4381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5863    0.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2881   -0.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  8  1  0  0  0  0
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 11 12  1  0  0  0  0
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 10 14  1  0  0  0  0
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 13 16  1  0  0  0  0
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 20 22  1  0  0  0  0
  8 21  1  0  0  0  0
 19 22  1  0  0  0  0
  3 23  1  0  0  0  0
 21 24  4  0  0  0  0
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 27 28  4  0  0  0  0
  5  6  4  0  0  0  0
 26 28  4  0  0  0  0
 13 18  1  0  0  0  0
 12 17  1  0  0  0  0
 12 16  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI4037

>  <IDNUMBER>
BAS 00114084

>  <Activity>
0
$$$$
ASI17586
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    2.9630   -0.2393    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
  1  5  1  0  0  0  0
  2  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  4  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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  3 13  1  0  0  0  0
 10 14  1  0  0  0  0
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 17 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
 13 15  1  0  0  0  0
 10 11  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI17586

>  <IDNUMBER>
BAS 00297115

>  <Activity>
0
$$$$
ASI12370
  Marvin  04201015132D          

 21 24  0  0  1  0            999 V2000
   -0.8384   -0.1504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6176    1.1244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 15 16  1  0  0  0  0
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  7 12  1  0  0  0  0
  2 10  1  0  0  0  0
  2  9  1  0  0  0  0
 14 21  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI12370

>  <IDNUMBER>
BAS 00246869

>  <Activity>
0
$$$$
ASI30181
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
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 11 12  4  0  0  0  0
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 13 16  4  0  0  0  0
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 15 20  4  0  0  0  0
 20 21  4  0  0  0  0
 18 22  4  0  0  0  0
 19 23  4  0  0  0  0
 16 21  4  0  0  0  0
  2  3  4  0  0  0  0
  4  5  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30181

>  <IDNUMBER>
BAS 00393770

>  <Activity>
0
$$$$
ASI25328
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.6174    0.1974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  9 14  1  0  0  0  0
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 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
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  9 18  1  0  0  0  0
 16 19  4  0  0  0  0
 17 20  4  0  0  0  0
  5  6  4  0  0  0  0
 19 20  4  0  0  0  0
  9 15  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI25328

>  <IDNUMBER>
BAS 00355774

>  <Activity>
0
$$$$
ASI24471
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  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
  6 15  4  0  0  0  0
 11 16  4  0  0  0  0
 16 17  4  0  0  0  0
 16 18  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
 12 21  4  0  0  0  0
 12 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
 26 27  4  0  0  0  0
 24 28  1  0  0  0  0
  3  4  4  0  0  0  0
 15 17  4  0  0  0  0
 25 27  4  0  0  0  0
 23 28  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24471

>  <IDNUMBER>
BAS 00345563

>  <Activity>
0
$$$$
ASI29639
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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   -1.3048    0.7159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1320    0.7159    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3048    1.5435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5992   -0.5279    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -2.0157    1.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2492   -2.2086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7213    0.7159    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  4  0  0  0  0
  1  5  2  0  0  0  0
  2  6  4  0  0  0  0
  3  7  1  0  0  0  0
  4  8  4  0  0  0  0
  9 13  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
 13 16  4  0  0  0  0
  9 14  2  0  0  0  0
  5 15  1  0  0  0  0
 16 20  4  0  0  0  0
 17 19  4  0  0  0  0
  9 18  1  0  0  0  0
 15 19  4  0  0  0  0
 15 20  4  0  0  0  0
  7 21  1  0  0  0  0
  7 22  1  0  0  0  0
 10 23  1  0  0  0  0
 11 24  1  0  0  0  0
 18 25  1  0  0  0  0
 25 26  1  0  0  0  0
  4 12  1  0  0  0  0
 13 17  4  0  0  0  0
  8 11  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI29639

>  <IDNUMBER>
BAS 00391871

>  <Activity>
0
$$$$
ASI802
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.2258   -1.0515    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9597   -1.4396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4799   -1.4784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6110    1.4043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1891    2.2229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6110    2.2229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9089    2.6287    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  2  0  0  0  0
  2  6  1  0  0  0  0
  7 10  4  0  0  0  0
  7  8  1  0  0  0  0
  3  9  4  0  0  0  0
  4 10  4  0  0  0  0
  8 11  1  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
 11 14  4  0  0  0  0
 11 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
  7  9  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>
ASI802

>  <IDNUMBER>
BAS 00031104

>  <Activity>
0
$$$$
ASI18731
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
    0.7046   -0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7121    0.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1586    0.4324    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4428    0.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4354    0.8426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4428   -0.8388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1586   -0.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5940    0.3765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5977   -0.3729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  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
  4  6  4  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
  2  9  1  0  0  0  0
  1 10  1  0  0  0  0
  4 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  1  0  0  0  0
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 13 17  1  0  0  0  0
 14 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
 20 22  1  0  0  0  0
  2  6  4  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
M  CHG  2   7   1   8   1
M  END
>  <NAME>
ASI18731

>  <IDNUMBER>
BAS 00314644

>  <Activity>
0
$$$$
ASI20612
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.8187    0.1875    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4031    0.2062    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
  2  3  3  0  0  0  0
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  1  6  1  0  0  0  0
  7 16  1  0  0  0  0
  8 11  1  0  0  0  0
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  1 11  1  0  0  0  0
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  1 13  1  0  0  0  0
 14 15  4  0  0  0  0
  4 15  4  0  0  0  0
 13 16  1  0  0  0  0
 12 17  1  0  0  0  0
  5 18  4  0  0  0  0
 14 19  4  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
  7 17  1  0  0  0  0
 10 19  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI20612

>  <IDNUMBER>
BAS 00322546

>  <Activity>
0
$$$$
ASI30594
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
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   -0.0832   -0.5108    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
  4  5  4  0  0  0  0
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  2  0  0  0  0
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  7 10  1  0  0  0  0
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 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 12 16  4  0  0  0  0
 16 17  4  0  0  0  0
  2  5  4  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI30594

>  <IDNUMBER>
BAS 00395376

>  <Activity>
0
$$$$
ASI10939
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
    0.3722   -1.1274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0508    0.9595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7732    1.3755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2180   -1.5142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4737   -2.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  1  4  4  0  0  0  0
  2  5  1  0  0  0  0
  6  7  1  0  0  0  0
  7 10  1  0  0  0  0
  1  8  4  0  0  0  0
  1  9  1  0  0  0  0
  8 10  4  0  0  0  0
  2 11  2  0  0  0  0
  6 12  2  0  0  0  0
  4 13  4  0  0  0  0
  5 14  4  0  0  0  0
  5 15  4  0  0  0  0
  9 16  1  0  0  0  0
 10 17  4  0  0  0  0
 18 20  4  0  0  0  0
 14 19  4  0  0  0  0
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 18 21  1  0  0  0  0
  6 22  1  0  0  0  0
 16 23  1  0  0  0  0
 16 24  1  0  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 13 17  4  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1  16   1
M  END
>  <NAME>
ASI10939

>  <IDNUMBER>
BAS 00226781

>  <Activity>
0
$$$$
ASI10535
  Marvin  04201015132D          

 22 24  0  0  1  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
  1  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
  7 10  1  0  0  0  0
  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
  9 15  1  0  0  0  0
  9 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
  4  5  4  0  0  0  0
 13 17  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI10535

>  <IDNUMBER>
BAS 00221464

>  <Activity>
0
$$$$
ASI2129
  Marvin  04201015132D          

 27 30  0  0  1  0            999 V2000
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   -3.2884   -1.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  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
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  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
 10 14  4  0  0  0  0
 10 11  1  0  0  0  0
  7 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
 11 17  1  0  0  0  0
  8 18  4  0  0  0  0
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  8 21  4  0  0  0  0
 21 22  4  0  0  0  0
 18 23  4  0  0  0  0
 19 24  4  0  0  0  0
 20 25  4  0  0  0  0
 25 26  4  0  0  0  0
 23 27  4  0  0  0  0
  5  6  1  0  0  0  0
 22 27  4  0  0  0  0
 24 26  4  0  0  0  0
 10 15  4  0  0  0  0
M  CHG  2   1   1   2   1
M  END
>  <NAME>
ASI2129

>  <IDNUMBER>
BAS 00090308

>  <Activity>
0
$$$$
1q83_TZ5
  Marvin  04201014582D          

 50 57  0  0  0  0            999 V2000
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   18.1491   16.2691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3866   16.9836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   17.3241   19.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   17.3241   20.5559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 45 46  4  0  0  0  0
 46 47  4  0  0  0  0
 47 48  4  0  0  0  0
 49 50  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <Activity>
1

>  <PDB_ID>
1q83_TZ5

$$$$
ASI30171
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
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 17 22  4  0  0  0  0
  8 18  4  0  0  0  0
  8 19  4  0  0  0  0
  5 20  1  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
 10 23  4  0  0  0  0
 10 24  4  0  0  0  0
 20 25  1  0  0  0  0
 25 26  1  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
  7 15  4  0  0  0  0
 17 21  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30171

>  <IDNUMBER>
BAS 00393754

>  <Activity>
0
$$$$
ASI23021
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
   -0.5822   -0.0988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8232    0.6205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5822    1.3289    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1592    0.6205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4278   -0.0988    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
  3  4  4  0  0  0  0
  1  4  4  0  0  0  0
  1  5  4  0  0  0  0
  3  6  4  0  0  0  0
  2  7  1  0  0  0  0
  7  8  3  0  0  0  0
  1  9  1  0  0  0  0
  9 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
 10 13  1  0  0  0  0
  6 14  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
 10 17  1  0  0  0  0
 16 18  4  0  0  0  0
 16 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
 12 13  1  0  0  0  0
  2  6  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI23021

>  <IDNUMBER>
BAS 00338378

>  <Activity>
0
$$$$
ASI25852
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.0118   -0.3680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4364   -0.3680    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  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
  5  7  4  0  0  0  0
  8  9  4  0  0  0  0
  6  9  4  0  0  0  0
  3 10  1  0  0  0  0
  8 11  4  0  0  0  0
  7 12  4  0  0  0  0
 10 13  2  0  0  0  0
  2 14  1  0  0  0  0
 11 15  4  0  0  0  0
 12 16  4  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
  7  8  4  0  0  0  0
 15 16  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25852

>  <IDNUMBER>
BAS 00364246

>  <Activity>
0
$$$$
ASI10932
  Marvin  04201015132D          

 22 22  0  0  1  0            999 V2000
    1.6228   -0.0039    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.6228   -1.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0334   -0.7195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8641   -1.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4418   -0.7195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6814   -1.4312    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0509    0.0078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5261    2.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3511    2.8701    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
  1  6  1  0  0  0  0
  4  7  4  0  0  0  0
  4  8  4  0  0  0  0
  6  9  1  0  0  0  0
 10 12  4  0  0  0  0
  7 11  4  0  0  0  0
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 10 13  1  0  0  0  0
  9 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
 17 18  1  0  0  0  0
  9 18  1  0  0  0  0
 17 19  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
 10 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10932

>  <IDNUMBER>
BAS 00226757

>  <Activity>
0
$$$$
ASI21142
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.5049    0.5737    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9235    1.2932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9546    0.5737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5143    2.0128    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  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  3  6  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  4  0  0  0  0
  8  9  4  0  0  0  0
 10 14  4  0  0  0  0
 10 11  1  0  0  0  0
  2 12  1  0  0  0  0
  7 13  4  0  0  0  0
 13 14  4  0  0  0  0
  6 15  1  0  0  0  0
 11 16  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
  9 19  1  0  0  0  0
 20 25  4  0  0  0  0
 20 21  1  0  0  0  0
 16 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  6  2  0  0  0  0
  9 10  4  0  0  0  0
 20 24  4  0  0  0  0
M  CHG  2   3   1   5   1
M  END
>  <NAME>
ASI21142

>  <IDNUMBER>
BAS 00327200

>  <Activity>
0
$$$$
ASI610
  Marvin  04201015132D          

 32 37  0  0  1  0            999 V2000
   -0.1414    0.0386    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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  4  6  1  0  0  0  0
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 14 15  1  0  0  0  0
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 13 17  4  0  0  0  0
 12 18  1  0  0  0  0
  3 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 14 22  1  0  0  0  0
 14 23  1  0  0  0  0
 18 24  1  0  0  0  0
 18 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
 25 29  1  0  0  0  0
 29 30  1  0  0  0  0
 26 31  1  0  0  0  0
 27 32  1  0  0  0  0
  5  7  4  0  0  0  0
 19 21  1  0  0  0  0
 10 11  1  0  0  0  0
 12 17  4  0  0  0  0
 31 32  1  0  0  0  0
 28 30  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI610

>  <IDNUMBER>
BAS 00024140

>  <Activity>
0
$$$$
ASI16606
  Marvin  04201015132D          

 29 33  0  0  1  0            999 V2000
   -1.6014    0.9239    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2605    1.3981    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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  6 12  1  0  0  0  0
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  9 14  1  0  0  0  0
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 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 11 14  1  0  0  0  0
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 11 17  1  0  0  0  0
  3 18  4  0  0  0  0
  2 19  4  0  0  0  0
  4 20  4  0  0  0  0
  5 21  4  0  0  0  0
  7 22  4  0  0  0  0
 10 23  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
 19 26  4  0  0  0  0
 18 27  4  0  0  0  0
 22 28  4  0  0  0  0
 23 29  4  0  0  0  0
  4  5  4  0  0  0  0
 21 25  4  0  0  0  0
 20 24  4  0  0  0  0
  6 13  1  0  0  0  0
 28 29  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI16606

>  <IDNUMBER>
BAS 00291891

>  <Activity>
0
$$$$
ASI31900
  Marvin  04201015132D          

 29 30  0  0  0  0            999 V2000
    2.5041    0.8834    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0469    0.4138    0.0000 S   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  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
  2  8  2  0  0  0  0
  2  9  2  0  0  0  0
  4 10  1  0  0  0  0
 11 21  1  0  0  0  0
 12 13  1  0  0  0  0
 13 18  4  0  0  0  0
  4 14  2  0  0  0  0
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  5 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 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
 10 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 12 26  1  0  0  0  0
 12 27  1  0  0  0  0
 12 28  1  0  0  0  0
  6 29  1  0  0  0  0
 20 22  4  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI31900

>  <IDNUMBER>
BAS 00403981

>  <Activity>
0
$$$$
ASI27613
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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   -0.2851    0.2887    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
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  2  6  1  0  0  0  0
  7 13  4  0  0  0  0
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  1  9  1  0  0  0  0
  6 10  4  0  0  0  0
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 11 12  4  0  0  0  0
 10 13  4  0  0  0  0
  3 14  1  0  0  0  0
  4 15  4  0  0  0  0
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  8 18  1  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
  3  5  4  0  0  0  0
 19 20  4  0  0  0  0
  7 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI27613

>  <IDNUMBER>
BAS 00380649

>  <Activity>
0
$$$$
ASI11566
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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   -0.7898   -1.7117    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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 11 12  1  0  0  0  0
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 13 17  4  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  4  0  0  0  0
 19 21  1  0  0  0  0
  4  5  4  0  0  0  0
 17 20  4  0  0  0  0
 18 21  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI11566

>  <IDNUMBER>
BAS 00232857

>  <Activity>
0
$$$$
ASI30579
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    2.2022    0.7245    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 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
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 10 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 16 22  1  0  0  0  0
 17 23  1  0  0  0  0
 22 24  1  0  0  0  0
  3  5  1  0  0  0  0
 23 24  1  0  0  0  0
  9 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30579

>  <IDNUMBER>
BAS 00395354

>  <Activity>
0
$$$$
ASI10164
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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  8 11  4  0  0  0  0
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 10 11  4  0  0  0  0
 12 19  1  0  0  0  0
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 20 23  4  0  0  0  0
 21 24  4  0  0  0  0
 23 25  4  0  0  0  0
 12 18  1  0  0  0  0
 24 25  4  0  0  0  0
  7  8  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI10164

>  <IDNUMBER>
BAS 00217947

>  <Activity>
0
$$$$
ASI30194
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
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  1  4  1  0  0  0  0
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  6  7  1  0  0  0  0
  5  7  2  0  0  0  0
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  6 11  4  0  0  0  0
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  3 14  2  0  0  0  0
  1 15  4  0  0  0  0
  1 16  4  0  0  0  0
 11 17  4  0  0  0  0
  3 18  1  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
 18 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 20  4  0  0  0  0
 23 25  4  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30194

>  <IDNUMBER>
BAS 00393895

>  <Activity>
0
$$$$
ASI30176
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
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 10 14  4  0  0  0  0
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 15 18  4  0  0  0  0
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 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
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 10 22  1  0  0  0  0
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 25 26  4  0  0  0  0
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 23 27  4  0  0  0  0
 24 28  4  0  0  0  0
 28 29  4  0  0  0  0
  6 10  4  0  0  0  0
 21 25  4  0  0  0  0
 15 19  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30176

>  <IDNUMBER>
BAS 00393759

>  <Activity>
0
$$$$
ASI26004
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.2281   -0.9193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  7  2  0  0  0  0
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 10 15  4  0  0  0  0
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 15 20  4  0  0  0  0
 16 19  4  0  0  0  0
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 13 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
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 13 22  4  0  0  0  0
 17 23  1  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
 22 25  4  0  0  0  0
 10 16  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI26004

>  <IDNUMBER>
BAS 00365584

>  <Activity>
0
$$$$
ASI22019
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
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  6 10  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
 20 21  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  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>
ASI22019

>  <IDNUMBER>
BAS 00332354

>  <Activity>
0
$$$$
ASI27398
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.2998    0.4059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6 17  1  0  0  0  0
  8 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
  5  6  4  0  0  0  0
 11 12  4  0  0  0  0
 20 21  1  0  0  0  0
M  CHG  1  16   1
M  END
>  <NAME>
ASI27398

>  <IDNUMBER>
BAS 00379911

>  <Activity>
0
$$$$
ASI10936
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -0.1704    1.5123    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5485    1.9436    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  4  0  0  0  0
  4  5  1  0  0  0  0
  5  9  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  4  0  0  0  0
  7  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  7 12  1  0  0  0  0
 13 14  4  0  0  0  0
  4 14  4  0  0  0  0
  3 15  4  0  0  0  0
 13 16  4  0  0  0  0
  8 17  4  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
 15 20  4  0  0  0  0
 20 21  4  0  0  0  0
  8 16  4  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10936

>  <IDNUMBER>
BAS 00226771

>  <Activity>
0
$$$$
ASI27145
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
    0.8334   -0.0286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4608    1.6318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1956    0.3945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1956    1.2215    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
  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
  8 11  1  0  0  0  0
  2 12  1  0  0  0  0
 10 13  1  0  0  0  0
  4 14  4  0  0  0  0
  5 15  1  0  0  0  0
  7 16  4  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
 12 20  1  0  0  0  0
 14 21  4  0  0  0  0
 21 22  4  0  0  0  0
 19 23  1  0  0  0  0
 17 24  1  0  0  0  0
 18 25  1  0  0  0  0
 25 26  1  0  0  0  0
  3  7  4  0  0  0  0
 16 22  4  0  0  0  0
 24 26  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI27145

>  <IDNUMBER>
BAS 00371677

>  <Activity>
0
$$$$
ASI21619
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    1.0828    0.8368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2910    0.6209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1127    1.6556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1679    1.3107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7323    0.0450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6316    0.2309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4517    0.6779    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3359    1.9286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5237   -0.7468    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0047    1.3677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2885    0.7348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3605   -0.7049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3826   -0.5609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5662    0.0870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9466   -1.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7036   -1.9585    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9478   -0.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1487   -1.4816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7503   -0.9928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2129   -0.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3269   -1.3527    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 11  1  0  0  0  0
  1  6  1  0  0  0  0
  7 10  2  0  0  0  0
  3  8  4  0  0  0  0
  9 12  1  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  4  0  0  0  0
  5 14  2  0  0  0  0
 13 15  4  0  0  0  0
 15 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
  6 19  4  0  0  0  0
 19 20  4  0  0  0  0
 20 21  4  0  0  0  0
 17 22  1  0  0  0  0
 18 23  1  0  0  0  0
  4  8  4  0  0  0  0
 15 21  4  0  0  0  0
 22 23  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI21619

>  <IDNUMBER>
BAS 00330012

>  <Activity>
0
$$$$
1zgc_A2E
  Marvin  04201014582D          

 37 41  0  0  0  0            999 V2000
   47.4545   24.2167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   47.4545   25.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.7400   25.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   46.7400   26.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.4545   26.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.1690   26.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.1690   25.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.4545   27.5167    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   46.7400   27.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0255   27.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0255   26.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.1690   27.9292    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   48.8834   27.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   49.5979   27.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   50.3124   27.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   51.0268   27.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   51.7413   27.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   52.4558   27.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   58.8860   27.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   56.0281   29.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  7  4  0  0  0  0
  2  3  4  0  0  0  0
  3  4  4  0  0  0  0
  4 11  1  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  5  8  1  0  0  0  0
  6  7  4  0  0  0  0
  8  9  1  0  0  0  0
  8 12  1  6  0  0  0
  9 10  1  0  0  0  0
 10 11  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
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  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
 23 24  1  0  0  0  0
 24 29  4  0  0  0  0
 24 25  4  0  0  0  0
 25 37  1  0  0  0  0
 25 26  4  0  0  0  0
 26 27  4  0  0  0  0
 26 34  1  0  0  0  0
 27 28  4  0  0  0  0
 28 33  4  0  0  0  0
 28 29  4  0  0  0  0
 29 30  4  0  0  0  0
 30 31  4  0  0  0  0
 31 32  4  0  0  0  0
 32 33  4  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
M  CHG  1  12   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  27
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>
1zgc_A2E

$$$$
ASI11568
  Marvin  04201015132D          

 20 21  0  0  1  0            999 V2000
   -0.0187   -0.8303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1869   -1.6340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3483   -0.9585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0119   -1.6340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8277    0.3231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4044   -0.9745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6527    1.4765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9879    1.9731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8143    0.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3201   -2.3842    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
  3  5  4  0  0  0  0
  2  6  4  0  0  0  0
  4  7  1  0  0  0  0
  4  8  2  0  0  0  0
  9 13  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
  7 13  1  0  0  0  0
  5 14  4  0  0  0  0
  6 15  4  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  4  0  0  0  0
 15 20  4  0  0  0  0
  5  6  4  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI11568

>  <IDNUMBER>
BAS 00232860

>  <Activity>
0
$$$$
ASI4892
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.3026    0.4927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1689   -0.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1689    1.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9537    0.0809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9537    0.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1297    0.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5484   -0.2147    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6611    1.3232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1126   -0.9678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0986    1.9567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6611   -0.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3825    0.0704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3825    0.9150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1109   -0.3660    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.1297   -0.9255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3719   -0.2076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5344   -1.6434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7872   -0.9150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3790   -1.6329    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
  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
 11 12  4  0  0  0  0
  8 13  4  0  0  0  0
 12 14  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
  4  5  4  0  0  0  0
 12 13  4  0  0  0  0
 17 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI4892

>  <IDNUMBER>
BAS 00125384

>  <Activity>
0
$$$$
ASI31943
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    1.5069   -0.4022    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3186   -1.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7840   -0.0153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4887   -1.2829    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1629   -0.5040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2909   -0.1680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8814   -0.7484    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5956   -0.2596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8938   -1.8073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7077    0.8400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1033   -1.8480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7585    0.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2066   -0.7688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1833    0.2902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1586    0.2953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5273    0.8095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0059   -0.5244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9578    0.5752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1055    1.3950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7287   -1.5120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7164   -0.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3171   -1.0487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3499   -2.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8844    1.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0575    2.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8466    2.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4059    3.0189    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
  5  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
 11 22  1  0  0  0  0
  8 12  4  0  0  0  0
  8 13  4  0  0  0  0
  5 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
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
  7 20  1  0  0  0  0
  7 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  1  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
  4  5  1  0  0  0  0
 11 23  1  0  0  0  0
 15 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI31943

>  <IDNUMBER>
BAS 00404236

>  <Activity>
0
$$$$
ASI15873
  Marvin  04201015132D          

 22 25  0  0  0  0            999 V2000
    0.1668   -0.1668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6267    0.0961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1068   -0.5407    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6267   -1.2180    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7732    0.3841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1668   -0.9754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5616    0.1617    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8036    0.8794    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5913    1.1574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1182   -0.2678    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1668    1.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8952   -0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1378    0.7278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7436   -0.6267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9362    0.5054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5320   -0.8541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9016   -0.4649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0974    0.5054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5269   -0.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9262    0.7935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3710   -0.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5377    0.2375    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  6  4  0  0  0  0
  1  5  4  0  0  0  0
  1  6  4  0  0  0  0
  5  7  1  0  0  0  0
  2  8  4  0  0  0  0
  5  9  4  0  0  0  0
 10 15  1  0  0  0  0
  9 11  4  0  0  0  0
  3 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 10 17  1  0  0  0  0
 12 18  4  0  0  0  0
 12 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  4  0  0  0  0
  8 11  4  0  0  0  0
 10 16  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15873

>  <IDNUMBER>
BAS 00288070

>  <Activity>
0
$$$$
ASI16523
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.8319    0.1917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6928   -0.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8768   -0.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4688    0.2122    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4762    0.2122    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0159    0.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1131    0.2122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1131   -1.2199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2399   -0.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2399    0.9261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6079   -0.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6079    0.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9332    0.2122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6487    0.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0681   -0.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0681    0.9261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9332   -1.2199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2448    0.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2448   -0.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3371   -0.4937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3371   -1.9298    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.6725    0.9261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2963    0.2122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5244    0.8976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7083    0.9261    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
  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
 24 25  1  0  0  0  0
 23 25  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>
ASI16523

>  <IDNUMBER>
BAS 00291273

>  <Activity>
0
$$$$
ASI22223
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
   -0.9288   -0.1858    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2858   -0.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5354   -0.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9341   -0.6265    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1129   -0.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5970   -0.1202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4679    0.4553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2129   -0.9470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1218    0.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5298    0.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2950   -1.2967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5898   -0.4662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0252   -1.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3166    0.2987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3838   -0.3497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3348    0.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8739    0.9507    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3275   -1.8941    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.4699    1.1729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3060    0.8924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6301    1.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  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
  4  6  1  0  0  0  0
  1  7  4  0  0  0  0
  1  8  4  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3 11  2  0  0  0  0
 12 13  4  0  0  0  0
  8 13  4  0  0  0  0
  7 14  4  0  0  0  0
  6 15  2  0  0  0  0
 10 16  1  0  0  0  0
 14 17  1  0  0  0  0
 13 18  1  0  0  0  0
  9 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 12 14  4  0  0  0  0
  6 16  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22223

>  <IDNUMBER>
BAS 00333701

>  <Activity>
0
$$$$
ASI12599
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.7286    0.7777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0519    1.2607    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3520    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6058    0.7859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4748   -0.0136    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5226    1.0397    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9032   -0.6112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1366    0.5021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7082   -0.4421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4272    1.0642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2840   -1.0478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9811   -0.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2088   -0.5621    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0548   -1.8419    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9701    0.3411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9225    0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0780   -0.8732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5951   -0.8514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5365    0.2101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7751    0.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3809   -0.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3454   -0.0873    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
  7  9  1  0  0  0  0
  4 10  2  0  0  0  0
  9 11  4  0  0  0  0
  8 12  4  0  0  0  0
 12 13  1  0  0  0  0
 11 14  1  0  0  0  0
  9 15  4  0  0  0  0
  8 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
 15 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
  3  4  1  0  0  0  0
 18 21  4  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI12599

>  <IDNUMBER>
BAS 00253522

>  <Activity>
0
$$$$
ASI3699
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
    0.1539   -0.8626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1539   -0.0378    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5725   -1.2863    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2712   -0.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5725    0.3733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2712   -0.8752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9976   -1.2863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5725    1.1955    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5966   -0.8475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5966   -0.0151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3003    0.3960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1086   -0.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3003    1.2258    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    3.0141   -0.0277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3420    0.6760    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
  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
 10 11  4  0  0  0  0
 11 12  4  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  4  0  0  0  0
 10 17  4  0  0  0  0
 16 18  4  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
  4  6  1  0  0  0  0
 12 18  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI3699

>  <IDNUMBER>
BAS 00110610

>  <Activity>
0
$$$$
ASI26551
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    0.9422    0.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5116    1.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9422   -1.1469    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5116   -0.4306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3241    1.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7609    0.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7334    1.7353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7334    0.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9210    1.7353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9613    1.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5520    0.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5520    1.7353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8012    1.0190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7780   -1.1469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5329   -1.8632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1702   -0.4306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1702    1.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2106    0.3027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4385   -0.4093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9593   -2.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1873   -1.8632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2571   -0.4093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9888    1.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7780   -2.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3981    0.2857    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
 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
 21 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>
ASI26551

>  <IDNUMBER>
BAS 00367512

>  <Activity>
0
$$$$
ASI7023
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.2586    0.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9686    0.4351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2586   -0.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9686   -1.2190    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6828    0.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6828   -0.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4802    0.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4802   -1.2190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4844    1.2683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9686    1.2560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1821    0.0369    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3165    0.4310    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3970    0.4351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8921    0.4351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3970   -1.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981    0.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3165    1.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0265    0.0123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1153    0.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1153   -0.8004    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
 15 20  4  0  0  0  0
  5  6  4  0  0  0  0
 19 20  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>
ASI7023

>  <IDNUMBER>
BAS 00141371

>  <Activity>
0
$$$$
ASI17671
  Marvin  04201015132D          

 20 23  0  0  0  0            999 V2000
   -1.0401   -0.0395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3247   -0.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3994   -0.0219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2864    0.3818    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0401    0.8031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3994    0.8031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8124   -0.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3247    1.2244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0840   -0.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8124    1.0751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0840    1.2244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3247   -1.2507    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8037   -0.0395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8037    0.8031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6418    1.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7818   -1.6852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5059   -1.2726    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  7  1  0  0  0  0
  1  5  4  0  0  0  0
  6  8  4  0  0  0  0
  1  7  1  0  0  0  0
  5  8  4  0  0  0  0
  3  9  4  0  0  0  0
  5 10  1  0  0  0  0
  6 11  4  0  0  0  0
  2 12  1  0  0  0  0
  9 13  4  0  0  0  0
 11 14  4  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  9 17  4  0  0  0  0
 13 18  4  0  0  0  0
 17 19  4  0  0  0  0
 19 20  4  0  0  0  0
  4 10  1  0  0  0  0
  3  6  4  0  0  0  0
 13 14  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI17671

>  <IDNUMBER>
BAS 00297664

>  <Activity>
0
$$$$
ASI9727
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
    1.9673    0.6628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9673    1.4702    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6800    0.2472    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8469   -1.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2598    0.2472    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8469   -1.8305    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8732    0.6628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3250   -1.0021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3876    1.4702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3876    0.6628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0562   -0.5839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7873   -1.0178    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
 16 17  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>
ASI9727

>  <IDNUMBER>
BAS 00208206

>  <Activity>
0
$$$$
ASI1287
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
    0.2427    0.4005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0559    0.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1984    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2458   -1.0195    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1669   -0.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3107    1.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0559   -1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4655   -0.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6402    1.6627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9921   -0.3186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4564   -1.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4048   -1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2998   -1.7871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0073   -2.4516    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.2301   -1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0662    1.5443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4048    0.3883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6366   -1.7325    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2452    0.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6427   -0.3307    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
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  4  0  0  0  0
  4  7  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  4  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
 10 12  4  0  0  0  0
 11 13  2  0  0  0  0
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 12 15  4  0  0  0  0
  6 16  4  0  0  0  0
 10 17  4  0  0  0  0
 15 18  1  0  0  0  0
  9 19  4  0  0  0  0
 17 20  4  0  0  0  0
 20 21  4  0  0  0  0
 18 22  1  0  0  0  0
 16 23  4  0  0  0  0
 19 24  4  0  0  0  0
  6  9  4  0  0  0  0
  7  8  1  0  0  0  0
 23 24  4  0  0  0  0
 15 21  4  0  0  0  0
M  CHG  2   4   1  14  -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>
ASI1287

>  <IDNUMBER>
BAS 00069600

>  <Activity>
0
$$$$
ASI27171
  Marvin  04201015132D          

 31 35  0  0  1  0            999 V2000
    1.1401   -0.9743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1401   -0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4491    0.2764    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  4  4  0  0  0  0
  1  5  1  0  0  0  0
  6  7  4  0  0  0  0
  4  7  4  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
 11 14  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  9 14  1  0  0  0  0
  9 15  2  0  0  0  0
 13 16  1  0  0  0  0
  6 17  4  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
  7 20  4  0  0  0  0
 16 21  4  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
 18 24  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  4  0  0  0  0
 22 27  4  0  0  0  0
 21 28  4  0  0  0  0
 28 29  4  0  0  0  0
 24 30  1  0  0  0  0
 25 31  1  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
 30 31  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI27171

>  <IDNUMBER>
BAS 00371746

>  <Activity>
0
$$$$
ASI31169
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
    1.4633   -0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4305   -0.7526    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0518   -0.7526    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0190   -0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0190   -1.4679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1964   -0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2859   -0.0281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0565    0.6872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7993   -2.2532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4773    1.4024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1776    1.4024    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
  4  8  1  0  0  0  0
  5  7  1  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  2  0  0  0  0
  1 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
 10 15  4  0  0  0  0
 10 16  4  0  0  0  0
 15 17  4  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  0  0  0  0
 17 19  4  0  0  0  0
  2  5  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI31169

>  <IDNUMBER>
BAS 00398908

>  <Activity>
0
$$$$
ASI30381
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
    0.3661    0.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3707   -0.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7888    0.3337    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0752   -0.0556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0798    0.3198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981   -0.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3661    1.1864    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3707   -0.9268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981   -0.9268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0798   -1.3486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4978   -0.0556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7888    1.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0752   -0.9037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5072    0.3198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5072   -1.3486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2069    0.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2162   -0.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2162   -0.9268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2069    1.1864    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  4  0  0  0  0
  5  6  4  0  0  0  0
  1  7  2  0  0  0  0
  2  8  4  0  0  0  0
  9 10  4  0  0  0  0
  8 10  4  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  6 14  4  0  0  0  0
  9 15  4  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  4  0  0  0  0
 15 19  4  0  0  0  0
 17 20  1  0  0  0  0
  6  9  4  0  0  0  0
 16 20  1  0  0  0  0
 18 19  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI30381

>  <IDNUMBER>
BAS 00394554

>  <Activity>
0
$$$$
ASI29387
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.4580   -0.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9779   -0.8678    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2581   -0.4445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3484    0.7539    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1265    1.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1849    0.1103    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0029    0.2383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2838    0.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7176    1.2518    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0369   -0.1991    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
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  3  6  4  0  0  0  0
  7  9  1  0  0  0  0
  4  8  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
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 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
  4 15  2  0  0  0  0
  3 16  1  0  0  0  0
  6 17  1  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
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
  5  6  4  0  0  0  0
 17 18  1  0  0  0  0
  7 10  1  0  0  0  0
M  CHG  1   7   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>
ASI29387

>  <IDNUMBER>
BAS 00389968

>  <Activity>
0
$$$$
ASI24678
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
    0.2679   -0.1551    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
  2  5  4  0  0  0  0
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  6  7  4  0  0  0  0
  1  8  1  0  0  0  0
  9 13  1  0  0  0  0
  6 10  1  0  0  0  0
  4 11  4  0  0  0  0
  5 12  4  0  0  0  0
 13 16  1  0  0  0  0
  8 14  1  0  0  0  0
 10 15  1  0  0  0  0
 16 17  1  0  0  0  0
 14 17  1  0  0  0  0
 12 18  4  0  0  0  0
 13 19  1  0  0  0  0
  4  7  4  0  0  0  0
 11 18  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24678

>  <IDNUMBER>
BAS 00347621

>  <Activity>
0
$$$$
ASI11420
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    1.2170   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2170   -0.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2063   -0.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5105   -1.3098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2063   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9282   -1.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9441    0.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6450   -0.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9282    0.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3722   -1.3098    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
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  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
  8 10  1  0  0  0  0
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  2 12  1  0  0  0  0
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 11 14  4  0  0  0  0
 15 21  1  0  0  0  0
  3 16  1  0  0  0  0
 10 17  1  0  0  0  0
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 19 24  1  0  0  0  0
  4  6  4  0  0  0  0
 15 22  1  0  0  0  0
  9 14  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI11420

>  <IDNUMBER>
BAS 00231878

>  <Activity>
0
$$$$
ASI713
  Marvin  04201015132D          

 18 20  0  0  1  0            999 V2000
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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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  2  6  1  0  0  0  0
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  6  8  1  0  0  0  0
  4  9  4  0  0  0  0
  7 10  4  0  0  0  0
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 17 18  1  0  0  0  0
  6 12  1  0  0  0  0
 10 11  4  0  0  0  0
 16 18  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI713

>  <IDNUMBER>
BAS 00028762

>  <Activity>
0
$$$$
ASI14622
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
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 22 24  4  0  0  0  0
  3  4  4  0  0  0  0
 13 19  1  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI14622

>  <IDNUMBER>
BAS 00280475

>  <Activity>
0
$$$$
ASI9815
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
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  1  2  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
 20 22  1  0  0  0  0
  4  5  4  0  0  0  0
 19 22  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI9815

>  <IDNUMBER>
BAS 00209899

>  <Activity>
0
$$$$
ASI3344
  Marvin  04201015132D          

 22 25  0  0  1  0            999 V2000
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 10 15  1  0  0  0  0
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M  CHG  1   7   1
M  END
>  <NAME>
ASI3344

>  <IDNUMBER>
BAS 00107350

>  <Activity>
0
$$$$
ASI200
  Marvin  04201015132D          

 16 17  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  5  7  4  0  0  0  0
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  1 10  1  0  0  0  0
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 11 14  1  0  0  0  0
 13 15  1  0  0  0  0
 10 16  1  0  0  0  0
  4  5  4  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI200

>  <IDNUMBER>
BAS 00009472

>  <Activity>
0
$$$$
ASI24194
  Marvin  04201015132D          

 30 32  0  0  0  0            999 V2000
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  2  9  1  0  0  0  0
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  1  5  4  0  0  0  0
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  3  9  1  0  0  0  0
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 15 18  4  0  0  0  0
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  4 19  1  0  0  0  0
 20 22  1  0  0  0  0
 19 21  1  0  0  0  0
  4 22  1  0  0  0  0
 12 23  1  0  0  0  0
 11 24  1  0  0  0  0
 13 25  1  0  0  0  0
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 14 28  1  0  0  0  0
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 14 30  1  0  0  0  0
  7 16  4  0  0  0  0
  3 20  1  0  0  0  0
  8 15  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24194

>  <IDNUMBER>
BAS 00344491

>  <Activity>
0
$$$$
1dx4_760
  Marvin  04201014582D          

 22 25  0  0  0  0            999 V2000
   22.7370   37.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7370   36.1940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0225   35.7815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3081   36.1940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3081   37.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.8791   37.0190    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
  1  2  1  0  0  0  0
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  3  4  1  0  0  0  0
  4 14  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  1  0  0  0  0
  5  7  4  0  0  0  0
  7  8  4  0  0  0  0
  8 13  4  0  0  0  0
  8  9  4  0  0  0  0
  9 10  4  0  0  0  0
 10 11  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  1  0  0  0  0
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 16 17  1  0  0  0  0
 17 22  4  0  0  0  0
 17 18  4  0  0  0  0
 18 19  4  0  0  0  0
 19 20  4  0  0  0  0
 20 21  4  0  0  0  0
 21 22  4  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
1dx4_760

$$$$
ASI24650
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
    2.2936   -0.3709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4494   -0.3514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4543    0.3563    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 10  1  0  0  0  0
  3  5  4  0  0  0  0
  2  6  1  0  0  0  0
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  1  8  4  0  0  0  0
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 10 16  4  0  0  0  0
  8 11  4  0  0  0  0
  2 12  2  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
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 16 24  4  0  0  0  0
 17 23  4  0  0  0  0
 14 18  1  0  0  0  0
 13 19  1  0  0  0  0
  5 20  1  0  0  0  0
  3 21  1  0  0  0  0
 11 22  1  0  0  0  0
 15 23  4  0  0  0  0
 15 24  4  0  0  0  0
  9 25  1  0  0  0  0
 25 26  1  0  0  0  0
  5  7  4  0  0  0  0
 10 17  4  0  0  0  0
  9 19  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24650

>  <IDNUMBER>
BAS 00347494

>  <Activity>
0
$$$$
ASI5044
  Marvin  04201015132D          

 15 16  0  0  1  0            999 V2000
    0.8064   -0.2118    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4828    0.2899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2260   -0.5389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5831   -1.0703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9952   -0.8176    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
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  2  0  0  0  0
  7  9  4  0  0  0  0
  7 10  4  0  0  0  0
  5 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  6  1  0  0  0  0
 12 13  4  0  0  0  0
M  CHG  2   1   1  11  -1
M  END
>  <NAME>
ASI5044

>  <IDNUMBER>
BAS 00126162

>  <Activity>
0
$$$$
ASI948
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    1.0617    0.3326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0617   -0.4861    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
  1  5  4  0  0  0  0
  4  6  4  0  0  0  0
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  2  8  4  0  0  0  0
  5  9  4  0  0  0  0
  6 10  4  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
  3 13  1  0  0  0  0
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 12 16  1  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
  3  7  4  0  0  0  0
  8 10  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI948

>  <IDNUMBER>
BAS 00047789

>  <Activity>
0
$$$$
ASI1120
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
    1.0404    0.0043    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0404    0.8229    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  4  0  0  0  0
  4 11  1  0  0  0  0
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  4  6  2  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10 13  1  0  0  0  0
  3 11  1  0  0  0  0
  8 12  1  0  0  0  0
  5 13  1  0  0  0  0
  2 14  4  0  0  0  0
  3 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
 18 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
 15 19  4  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI1120

>  <IDNUMBER>
BAS 00065018

>  <Activity>
0
$$$$
ASI22619
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
    0.9095   -0.3078    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  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
  9 12  4  0  0  0  0
  9 10  4  0  0  0  0
 11 13  4  0  0  0  0
  8 12  4  0  0  0  0
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  6 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
  4 17  2  0  0  0  0
 16 18  1  0  0  0  0
 14 19  4  0  0  0  0
 12 20  1  0  0  0  0
 19 21  1  0  0  0  0
 14 22  4  0  0  0  0
 19 23  4  0  0  0  0
 22 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
 15 18  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI22619

>  <IDNUMBER>
BAS 00336194

>  <Activity>
0
$$$$
ASI10788
  Marvin  04201015132D          

 27 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
  1  4  4  0  0  0  0
  2  5  4  0  0  0  0
  2  6  4  0  0  0  0
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
  5  9  4  0  0  0  0
  8 10  4  0  0  0  0
  9 11  4  0  0  0  0
  6 12  4  0  0  0  0
  3 13  4  0  0  0  0
 13 14  4  0  0  0  0
  7 15  1  0  0  0  0
 16 18  1  0  0  0  0
  4 17  1  0  0  0  0
 15 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 20  1  0  0  0  0
 11 21  1  0  0  0  0
 16 22  1  0  0  0  0
 16 23  1  0  0  0  0
 17 24  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
  7 10  4  0  0  0  0
  6 14  4  0  0  0  0
 11 12  4  0  0  0  0
M  CHG  1  16   1
M  END
>  <NAME>
ASI10788

>  <IDNUMBER>
BAS 00225281

>  <Activity>
0
$$$$
ASI15046
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.9950    0.2867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6588    0.2867    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  4  0  0  0  0
  4  9  4  0  0  0  0
 10 16  4  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
 14 21  4  0  0  0  0
  9 15  4  0  0  0  0
  8 16  4  0  0  0  0
 14 17  1  0  0  0  0
 13 18  4  0  0  0  0
 13 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
  2 22  1  0  0  0  0
 22 23  1  0  0  0  0
  2 11  1  0  0  0  0
 10 15  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI15046

>  <IDNUMBER>
BAS 00283341

>  <Activity>
0
$$$$
ASI18733
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.2672   -0.0985    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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  3  7  2  0  0  0  0
  8  9  3  0  0  0  0
  9 12  1  0  0  0  0
  4 10  2  0  0  0  0
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 12 16  4  0  0  0  0
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 11 14  4  0  0  0  0
 11 15  4  0  0  0  0
 14 16  4  0  0  0  0
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 13 18  4  0  0  0  0
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 18 20  4  0  0  0  0
 19 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
 12 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18733

>  <IDNUMBER>
BAS 00314647

>  <Activity>
0
$$$$
ASI27163
  Marvin  04201015132D          

 28 32  0  0  0  0            999 V2000
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 12 14  1  0  0  0  0
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 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
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 21 26  4  0  0  0  0
 20 27  4  0  0  0  0
 26 28  4  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
 27 28  4  0  0  0  0
 23 24  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI27163

>  <IDNUMBER>
BAS 00371729

>  <Activity>
0
$$$$
ASI24193
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
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 13 16  4  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  9 21  1  0  0  0  0
 10 22  1  0  0  0  0
 12 23  1  0  0  0  0
 11 24  1  0  0  0  0
 21 25  1  0  0  0  0
 21 26  1  0  0  0  0
 22 27  1  0  0  0  0
 22 28  1  0  0  0  0
  9 13  4  0  0  0  0
  3 19  1  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24193

>  <IDNUMBER>
BAS 00344490

>  <Activity>
0
$$$$
ASI10863
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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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
  5  7  1  0  0  0  0
  1  6  4  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  3  9  4  0  0  0  0
  4 10  2  0  0  0  0
  6 11  4  0  0  0  0
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 13 24  1  0  0  0  0
  8 14  4  0  0  0  0
  8 15  4  0  0  0  0
 16 18  4  0  0  0  0
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 14 18  4  0  0  0  0
  5 19  1  0  0  0  0
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 16 21  1  0  0  0  0
  5 22  1  0  0  0  0
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 20 24  1  0  0  0  0
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 23 27  4  0  0  0  0
 27 28  4  0  0  0  0
 11 12  4  0  0  0  0
 26 28  4  0  0  0  0
 16 17  4  0  0  0  0
 13 25  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI10863

>  <IDNUMBER>
BAS 00226325

>  <Activity>
0
$$$$
ASI3700
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
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 10 13  1  0  0  0  0
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 14 20  4  0  0  0  0
 15 21  4  0  0  0  0
 21 22  4  0  0  0  0
  4  5  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI3700

>  <IDNUMBER>
BAS 00110612

>  <Activity>
0
$$$$
ASI275
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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    0.2750   -0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 12 17  1  0  0  0  0
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 15 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  5  1  0  0  0  0
 16 21  4  0  0  0  0
  8 13  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI275

>  <IDNUMBER>
BAS 00010434

>  <Activity>
0
$$$$
ASI11151
  Marvin  04201015132D          

 24 25  0  0  1  0            999 V2000
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 11 15  2  0  0  0  0
 10 16  4  0  0  0  0
 10 17  4  0  0  0  0
  1 18  1  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
 19 22  1  0  0  0  0
  9 23  1  0  0  0  0
 11 24  1  0  0  0  0
  4  6  2  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11151

>  <IDNUMBER>
BAS 00228517

>  <Activity>
0
$$$$
ASI10851
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
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 26 28  4  0  0  0  0
  2  9  1  0  0  0  0
 24 27  4  0  0  0  0
 25 28  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10851

>  <IDNUMBER>
BAS 00226279

>  <Activity>
0
$$$$
ASI15831
  Marvin  04201015132D          

 19 22  0  0  0  0            999 V2000
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  2  4  4  0  0  0  0
  3  5  4  0  0  0  0
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  7 14  1  0  0  0  0
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  2  9  4  0  0  0  0
  5 10  4  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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 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
  4  5  1  0  0  0  0
  7 15  1  0  0  0  0
 10 18  4  0  0  0  0
 11 19  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI15831

>  <IDNUMBER>
BAS 00287898

>  <Activity>
0
$$$$
ASI23250
  Marvin  04201015132D          

 36 42  0  0  1  0            999 V2000
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  1  6  4  0  0  0  0
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 11 16  1  0  0  0  0
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 13 17  1  0  0  0  0
 12 14  1  0  0  0  0
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 14 22  1  0  0  0  0
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  8 25  4  0  0  0  0
  7 26  4  0  0  0  0
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 10 28  4  0  0  0  0
 21 29  4  0  0  0  0
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 29 31  4  0  0  0  0
 23 32  4  0  0  0  0
 30 33  4  0  0  0  0
 24 34  4  0  0  0  0
 32 35  4  0  0  0  0
 34 36  4  0  0  0  0
  9 10  4  0  0  0  0
 28 36  4  0  0  0  0
 27 35  4  0  0  0  0
 11 15  1  0  0  0  0
  7  8  1  0  0  0  0
 26 33  4  0  0  0  0
 25 31  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI23250

>  <IDNUMBER>
BAS 00340157

>  <Activity>
0
$$$$
ASI23383
  Marvin  04201015132D          

 35 40  0  0  0  0            999 V2000
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 31 33  4  0  0  0  0
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 32 33  4  0  0  0  0
 29 35  4  0  0  0  0
 27 34  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI23383

>  <IDNUMBER>
BAS 00340787

>  <Activity>
0
$$$$
ASI10927
  Marvin  04201015132D          

 18 18  0  0  0  0            999 V2000
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  2  4  1  0  0  0  0
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  3 10  1  0  0  0  0
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 13 14  4  0  0  0  0
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 13 15  4  0  0  0  0
 12 16  1  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
  8 15  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10927

>  <IDNUMBER>
BAS 00226746

>  <Activity>
0
$$$$
ASI13287
  Marvin  04201015132D          

 26 27  0  0  1  0            999 V2000
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  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 14  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
  8 14  1  0  0  0  0
  5 15  4  0  0  0  0
  5 16  4  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
 15 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
 21 25  4  0  0  0  0
 23 26  1  0  0  0  0
 24 26  1  0  0  0  0
 22 25  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI13287

>  <IDNUMBER>
BAS 00261079

>  <Activity>
0
$$$$
ASI6558
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
    0.8394    0.4924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1045   -0.7611    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
  4  7  4  0  0  0  0
  1  5  2  0  0  0  0
  4  6  4  0  0  0  0
  3  7  4  0  0  0  0
  2  8  1  0  0  0  0
  3  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
  4 13  1  0  0  0  0
 14 16  4  0  0  0  0
  8 15  4  0  0  0  0
 15 16  4  0  0  0  0
 12 17  1  0  0  0  0
  2 18  1  0  0  0  0
  1 19  1  0  0  0  0
 14 20  1  0  0  0  0
  9 21  4  0  0  0  0
 19 22  1  0  0  0  0
 10 23  4  0  0  0  0
 13 24  1  0  0  0  0
 13 25  1  0  0  0  0
 21 26  4  0  0  0  0
 26 27  4  0  0  0  0
 18 22  1  0  0  0  0
  6 10  4  0  0  0  0
 12 14  4  0  0  0  0
 23 27  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI6558

>  <IDNUMBER>
BAS 00138308

>  <Activity>
0
$$$$
ASI25563
  Marvin  04201015132D          

 19 19  0  0  0  0            999 V2000
   -0.3962   -0.7504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5356    1.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2492   -0.7504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8992   -0.7504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2817    0.6805    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.4983   -1.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4983   -0.0373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7382   -0.7504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.1437   -0.0373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 14  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  2  0  0  0  0
  3  6  4  0  0  0  0
  3  7  4  0  0  0  0
  1  8  1  0  0  0  0
  9 12  4  0  0  0  0
 10 16  1  0  0  0  0
  6 11  4  0  0  0  0
  7 12  4  0  0  0  0
  2 13  1  0  0  0  0
 10 14  1  0  0  0  0
  9 15  1  0  0  0  0
  8 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI25563

>  <IDNUMBER>
BAS 00363660

>  <Activity>
0
$$$$
ASI218
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.4904    1.0505    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5762    0.2706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8254    1.0505    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1420    1.5248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6539   -0.4475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2837    1.3212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1072    2.3503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2270    2.4146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9433   -1.1148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5352   -0.6807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3181   -1.4766    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
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  1  8  1  0  0  0  0
  5  9  1  0  0  0  0
 10 15  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
  7 14  4  0  0  0  0
  8 15  1  0  0  0  0
 14 16  4  0  0  0  0
 11 17  4  0  0  0  0
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 13 19  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  4  0  0  0  0
  2  4  4  0  0  0  0
 19 20  4  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI218

>  <IDNUMBER>
BAS 00009508

>  <Activity>
0
$$$$
ASI23402
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
    0.7769    0.0824    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0772    0.0824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4939    0.7974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3582    0.7974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7769    1.5228    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
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 10  1  0  0  0  0
  2 11  4  0  0  0  0
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  5 13  4  0  0  0  0
  4 14  4  0  0  0  0
 15 19  1  0  0  0  0
 16 20  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
 21 23  4  0  0  0  0
 11 22  4  0  0  0  0
 12 23  4  0  0  0  0
 22 24  4  0  0  0  0
  4  5  4  0  0  0  0
 13 21  4  0  0  0  0
 14 24  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI23402

>  <IDNUMBER>
BAS 00340850

>  <Activity>
0
$$$$
ASI25553
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
    0.1496   -0.7357    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
  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
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  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
 21 22  1  0  0  0  0
 19 23  4  0  0  0  0
 18 24  4  0  0  0  0
 24 25  4  0  0  0  0
 10 12  4  0  0  0  0
  7 17  1  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25553

>  <IDNUMBER>
BAS 00363534

>  <Activity>
0
$$$$
ASI25432
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.2322    0.3436    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 15  4  0  0  0  0
  9 14  4  0  0  0  0
 10 15  4  0  0  0  0
 13 16  1  0  0  0  0
  8 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
 13 14  4  0  0  0  0
  3 11  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI25432

>  <IDNUMBER>
BAS 00356711

>  <Activity>
0
$$$$
ASI10843
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
    2.1644    0.0784    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4533   -0.3137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0913    0.1412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8127   -0.2771    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  4  0  0  0  0
  4  5  1  0  0  0  0
  5 12  1  0  0  0  0
  1  6  1  0  0  0  0
  7 15  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  4  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
 14 17  4  0  0  0  0
 11 15  1  0  0  0  0
 10 16  1  0  0  0  0
  4 17  4  0  0  0  0
  3 18  4  0  0  0  0
 14 19  4  0  0  0  0
  6 20  1  0  0  0  0
  6 21  1  0  0  0  0
  9 22  4  0  0  0  0
 18 23  4  0  0  0  0
 23 24  4  0  0  0  0
  7 16  1  0  0  0  0
  9 19  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10843

>  <IDNUMBER>
BAS 00226265

>  <Activity>
0
$$$$
ASI12611
  Marvin  04201015132D          

 18 20  0  0  0  0            999 V2000
   -1.6610    1.0636    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3273    0.5850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2481   -0.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9947    0.5912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833   -0.2127    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4639   -1.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7267   -0.2784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1699    0.3284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6444   -1.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3566    0.1595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1249    0.8383    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.4836    0.0751    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1815    0.8727    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3941   -2.0144    0.0000 Br  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
  3  6  2  0  0  0  0
  6  7  1  0  0  0  0
  8 11  4  0  0  0  0
  8  9  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
  2 13  2  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
  4 16  2  0  0  0  0
 15 17  1  0  0  0  0
 11 18  1  0  0  0  0
  3  5  1  0  0  0  0
  9 10  4  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI12611

>  <IDNUMBER>
BAS 00253564

>  <Activity>
0
$$$$
ASI21227
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
   -0.0452    0.5729    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4072    1.2741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4072   -0.1244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5719    0.5729    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.8330    0.5729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1761    1.2741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3360   -0.7841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0188   -0.8481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0188    1.9564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7357   -0.0603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3135    0.6634    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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  1  5  1  0  0  0  0
  3  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8 12  4  0  0  0  0
  3  9  2  0  0  0  0
  2 10  2  0  0  0  0
 11 13  4  0  0  0  0
 12 15  4  0  0  0  0
 13 17  4  0  0  0  0
  4 14  1  0  0  0  0
 15 16  1  0  0  0  0
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 15 17  4  0  0  0  0
  8 18  1  0  0  0  0
 14 19  1  0  0  0  0
 11 20  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
 20 23  1  0  0  0  0
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 21 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
  4  7  1  0  0  0  0
  8 11  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI21227

>  <IDNUMBER>
BAS 00327463

>  <Activity>
0
$$$$
ASI10888
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -0.8551    0.0681    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.3821   -0.6016    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
  4  5  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  7 10  2  0  0  0  0
  9 11  4  0  0  0  0
  3 12  1  0  0  0  0
 11 13  1  0  0  0  0
  4 14  4  0  0  0  0
  5 15  4  0  0  0  0
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 11 17  4  0  0  0  0
 18 19  4  0  0  0  0
 14 19  4  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
  3  5  4  0  0  0  0
 15 18  4  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10888

>  <IDNUMBER>
BAS 00226479

>  <Activity>
0
$$$$
ASI12925
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.8479    1.5518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1280    1.1359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3065   -1.3545    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  6  4  0  0  0  0
  3  7  4  0  0  0  0
  2  8  1  0  0  0  0
  9 11  1  0  0  0  0
  2 10  2  0  0  0  0
  8 11  1  0  0  0  0
 12 14  4  0  0  0  0
  3 13  1  0  0  0  0
  6 14  4  0  0  0  0
 12 15  1  0  0  0  0
 16 18  1  0  0  0  0
  4 17  1  0  0  0  0
 18 19  1  0  0  0  0
  9 19  1  0  0  0  0
  5 20  1  0  0  0  0
 21 22  1  0  0  0  0
 20 22  1  0  0  0  0
  7 12  4  0  0  0  0
  4 16  1  0  0  0  0
 17 21  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI12925

>  <IDNUMBER>
BAS 00255775

>  <Activity>
0
$$$$
ASI7036
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -0.6915    0.0640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6915   -0.7794    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 18  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 21  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  4  0  0  0  0
  6 16  4  0  0  0  0
 12 17  1  0  0  0  0
 17 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 14 23  1  0  0  0  0
 15 24  4  0  0  0  0
 16 25  4  0  0  0  0
  5  6  4  0  0  0  0
 24 25  4  0  0  0  0
 13 22  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7036

>  <IDNUMBER>
BAS 00141389

>  <Activity>
0
$$$$
ASI16306
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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   -2.6656   -0.5067    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2 12  1  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  2  8  1  0  0  0  0
  4  9  4  0  0  0  0
  4 10  4  0  0  0  0
 11 16  4  0  0  0  0
  6 12  1  0  0  0  0
  5 13  1  0  0  0  0
  7 14  1  0  0  0  0
  9 15  4  0  0  0  0
 10 16  4  0  0  0  0
 17 21  4  0  0  0  0
  8 18  1  0  0  0  0
 14 19  4  0  0  0  0
 14 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 17 23  1  0  0  0  0
 18 24  4  0  0  0  0
 18 25  4  0  0  0  0
 25 26  4  0  0  0  0
 24 27  4  0  0  0  0
 27 28  4  0  0  0  0
  2 13  1  0  0  0  0
 11 15  4  0  0  0  0
 26 28  4  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI16306

>  <IDNUMBER>
BAS 00289710

>  <Activity>
0
$$$$
ASI69
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
    0.7477   -0.9461    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9177   -0.1346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3969   -0.2764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3039   -1.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7078   -0.8610    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
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  3  8  1  0  0  0  0
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  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 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>
ASI69

>  <IDNUMBER>
BAS 00004300

>  <Activity>
0
$$$$
ASI26544
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
    0.9807   -0.4043    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
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 19 22  1  0  0  0  0
 16 23  4  0  0  0  0
 17 24  4  0  0  0  0
 23 25  4  0  0  0  0
 20 21  1  0  0  0  0
 10 12  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26544

>  <IDNUMBER>
BAS 00367496

>  <Activity>
0
$$$$
ASI707
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.0608    0.4272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  9  1  0  0  0  0
  4 10  1  0  0  0  0
  3 11  1  0  0  0  0
  6 12  4  0  0  0  0
  6 13  4  0  0  0  0
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 11 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
 15 21  4  0  0  0  0
 19 22  4  0  0  0  0
 21 23  4  0  0  0  0
  4  5  4  0  0  0  0
 18 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  2   6   1   7   1
M  END
>  <NAME>
ASI707

>  <IDNUMBER>
BAS 00028638

>  <Activity>
0
$$$$
ASI18189
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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   -4.0682    0.5392    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
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  3  7  2  0  0  0  0
  5  8  1  0  0  0  0
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  8 10  1  0  0  0  0
 11 20  4  0  0  0  0
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 11 13  1  0  0  0  0
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 10 17  4  0  0  0  0
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 16 20  4  0  0  0  0
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 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>
ASI18189

>  <IDNUMBER>
BAS 00312374

>  <Activity>
0
$$$$
ASI11247
  Marvin  04201015132D          

 19 19  0  0  0  0            999 V2000
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  1  4  4  0  0  0  0
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  4  7  4  0  0  0  0
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 11 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  7 11  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI11247

>  <IDNUMBER>
BAS 00230438

>  <Activity>
0
$$$$
ASI21140
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.4969   -0.6728    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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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 16 22  4  0  0  0  0
 17 23  4  0  0  0  0
  4  8  4  0  0  0  0
  5 10  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI21140

>  <IDNUMBER>
BAS 00327188

>  <Activity>
0
$$$$
ASI30574
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    1.6401    0.2298    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 13 20  1  0  0  0  0
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  7 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  3  4  1  0  0  0  0
 13 21  1  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30574

>  <IDNUMBER>
BAS 00395329

>  <Activity>
0
$$$$
ASI22374
  Marvin  04201015132D          

 21 24  0  0  1  0            999 V2000
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 13 18  1  0  0  0  0
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  6 10  1  0  0  0  0
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 13 20  4  0  0  0  0
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M  CHG  1   4   1
M  END
>  <NAME>
ASI22374

>  <IDNUMBER>
BAS 00334593

>  <Activity>
0
$$$$
ASI61
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
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 10 18  1  0  0  0  0
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 18 19  1  0  0  0  0
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 20 22  1  0  0  0  0
 10 21  1  0  0  0  0
 15 22  1  0  0  0  0
 17 23  1  0  0  0  0
  4  5  4  0  0  0  0
  9 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI61

>  <IDNUMBER>
BAS 00004280

>  <Activity>
0
$$$$
ASI15357
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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  6  9  1  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
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 12 13  1  0  0  0  0
  8 14  1  0  0  0  0
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 20 23  1  0  0  0  0
  4  5  1  0  0  0  0
 19 23  1  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15357

>  <IDNUMBER>
BAS 00285492

>  <Activity>
0
$$$$
ASI18184
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
    0.8406   -0.7779    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
  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 16  4  0  0  0  0
 11 12  1  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
  9 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
 20 21  4  0  0  0  0
  3  5  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>
ASI18184

>  <IDNUMBER>
BAS 00312366

>  <Activity>
0
$$$$
ASI18441
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
    2.5395    0.4439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7709   -2.4127    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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  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 25  4  0  0  0  0
 10 18  4  0  0  0  0
 10 19  4  0  0  0  0
  8 20  1  0  0  0  0
 15 21  4  0  0  0  0
 15 22  4  0  0  0  0
 22 23  4  0  0  0  0
 19 24  4  0  0  0  0
 18 25  4  0  0  0  0
 21 26  4  0  0  0  0
 20 27  1  0  0  0  0
 16 28  1  0  0  0  0
 17 29  1  0  0  0  0
 17 24  4  0  0  0  0
  4 11  1  0  0  0  0
 16 23  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI18441

>  <IDNUMBER>
BAS 00313354

>  <Activity>
0
$$$$
ASI23376
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
    0.2764    0.2046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5207    0.7023    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0727   -0.0110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2433    1.0230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0839   -0.1715    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6765    0.2267    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -0.0719   -1.1834    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8756    0.1437    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
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  1  6  4  0  0  0  0
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  3  9  4  0  0  0  0
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 11 12  1  0  0  0  0
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 11 13  4  0  0  0  0
 10 14  4  0  0  0  0
 13 15  4  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 11 20  4  0  0  0  0
  8 21  1  0  0  0  0
 22 24  4  0  0  0  0
 13 23  1  0  0  0  0
 20 24  4  0  0  0  0
 22 25  1  0  0  0  0
 21 26  1  0  0  0  0
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 27 28  1  0  0  0  0
 26 29  1  0  0  0  0
 29 30  1  0  0  0  0
  2  5  4  0  0  0  0
  9 14  4  0  0  0  0
  8 19  1  0  0  0  0
 15 22  4  0  0  0  0
 28 30  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI23376

>  <IDNUMBER>
BAS 00340774

>  <Activity>
0
$$$$
ASI10924
  Marvin  04201015132D          

 14 14  0  0  1  0            999 V2000
   -0.6770    0.7745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5632    0.0433    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7515    0.0270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  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
  2  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  4  0  0  0  0
  6  9  1  0  0  0  0
  8 10  4  0  0  0  0
 11 13  1  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
  8 14  1  0  0  0  0
  5 10  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI10924

>  <IDNUMBER>
BAS 00226719

>  <Activity>
0
$$$$
ASI3352
  Marvin  04201015132D          

 26 29  0  0  1  0            999 V2000
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 11 18  1  0  0  0  0
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 12 13  1  0  0  0  0
 13 14  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  4  0  0  0  0
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 22 23  4  0  0  0  0
 20 24  4  0  0  0  0
 21 25  4  0  0  0  0
 25 26  4  0  0  0  0
  8 10  4  0  0  0  0
  4  5  4  0  0  0  0
 17 23  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3352

>  <IDNUMBER>
BAS 00107451

>  <Activity>
0
$$$$
ASI14358
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.0899   -0.4565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8175    0.2760    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1947   -0.4884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0086   -0.6795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4671    0.9555    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4646   -1.2740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3483    0.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9868    0.3221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3002    0.6795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6875    1.0546    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
  9 10  1  0  0  0  0
  8 10  4  0  0  0  0
  4 11  2  0  0  0  0
  9 12  2  0  0  0  0
  7 13  1  0  0  0  0
  9 14  1  0  0  0  0
  8 15  4  0  0  0  0
 10 16  4  0  0  0  0
 13 17  4  0  0  0  0
 13 18  4  0  0  0  0
 15 19  4  0  0  0  0
 19 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
  3  4  1  0  0  0  0
 21 23  4  0  0  0  0
 16 20  4  0  0  0  0
M  CHG  2   7   1  14  -1
M  END
>  <NAME>
ASI14358

>  <IDNUMBER>
BAS 00276468

>  <Activity>
0
$$$$
ASI30421
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
   -0.9113    0.4163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6475    1.1935    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    1.4432   -1.1796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9983    1.6699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3654    1.0547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2758   -1.2212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9041   -1.3461    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  6  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  4  0  0  0  0
  2  8  1  0  0  0  0
  5  9  2  0  0  0  0
  8 10  1  0  0  0  0
  3 11  2  0  0  0  0
  9 12  1  0  0  0  0
  1 13  1  0  0  0  0
  4 14  4  0  0  0  0
  7 15  4  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
 12 19  4  0  0  0  0
 12 20  4  0  0  0  0
 14 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 10  1  0  0  0  0
 15 22  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI30421

>  <IDNUMBER>
BAS 00394663

>  <Activity>
0
$$$$
ASI7034
  Marvin  04201015132D          

 26 27  0  0  0  0            999 V2000
   -0.6563    0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6563   -0.5782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3713    0.6563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3713   -0.9923    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0823    0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0703    0.6641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9144    0.6641    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0703    1.4924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3713    1.4845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7735    0.2501    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1607   -0.0547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5121   -0.5782    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
  4  6  4  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 19  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
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
  5 16  4  0  0  0  0
  6 17  4  0  0  0  0
 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
  9 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
 20 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>
ASI7034

>  <IDNUMBER>
BAS 00141387

>  <Activity>
0
$$$$
ASI29649
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.8861    0.3972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1528    0.8097    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8861   -0.4379    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.5990    0.8097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1528    1.6399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5990    1.6399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9760   -2.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8861    2.0524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9760   -2.9588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1782   -0.8556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7093   -1.7111    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  2  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  9  1  0  0  0  0
  5  8  1  0  0  0  0
  9 12  4  0  0  0  0
  7 10  2  0  0  0  0
  3 11  1  0  0  0  0
 12 16  4  0  0  0  0
 13 15  4  0  0  0  0
  7 14  1  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
  6 17  4  0  0  0  0
  4 18  4  0  0  0  0
  5 19  1  0  0  0  0
  5 20  1  0  0  0  0
 14 21  1  0  0  0  0
 22 24  4  0  0  0  0
 21 23  1  0  0  0  0
 18 24  4  0  0  0  0
  6  8  1  0  0  0  0
  9 13  4  0  0  0  0
 17 22  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI29649

>  <IDNUMBER>
BAS 00391916

>  <Activity>
0
$$$$
ASI19857
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.7219    0.7949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.3609    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7219    1.6199    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  4  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  3  6  4  0  0  0  0
  6  7  4  0  0  0  0
  1  8  4  0  0  0  0
  2  9  2  0  0  0  0
  2 10  2  0  0  0  0
  2 11  1  0  0  0  0
 12 16  1  0  0  0  0
  8 13  4  0  0  0  0
 13 14  4  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  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
  6 14  4  0  0  0  0
  5  7  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI19857

>  <IDNUMBER>
BAS 00318955

>  <Activity>
0
$$$$
ASI16179
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.9121    0.4069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0450    1.6254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9270    1.2489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5238   -2.0371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2175   -2.4556    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
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8  9  1  0  0  0  0
  3  9  1  0  0  0  0
  7 10  1  0  0  0  0
  5 11  1  0  0  0  0
  4 12  1  0  0  0  0
  6 13  2  0  0  0  0
  8 14  2  0  0  0  0
  8 15  1  0  0  0  0
 15 16  1  0  0  0  0
  4 17  1  0  0  0  0
 12 18  4  0  0  0  0
 12 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 11  1  0  0  0  0
  3 10  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI16179

>  <IDNUMBER>
BAS 00288944

>  <Activity>
0
$$$$
ASI28782
  Marvin  04201015132D          

 25 26  0  0  1  0            999 V2000
   -1.1847   -0.6670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3597   -0.6670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0615   -1.3516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1847   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0615    0.0701    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5274    1.4832    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2989    0.7723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1414    0.7723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9040    0.0701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8956   -1.8867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1847   -3.1155    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
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 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
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 12 20  4  0  0  0  0
 13 21  4  0  0  0  0
 16 22  1  0  0  0  0
 17 23  1  0  0  0  0
 23 24  1  0  0  0  0
 21 25  4  0  0  0  0
 22 24  1  0  0  0  0
 20 25  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI28782

>  <IDNUMBER>
BAS 00386095

>  <Activity>
0
$$$$
ASI16298
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -2.2374   -0.2177    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3335    0.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5085    0.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0934   -0.2177    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8875   -0.1771    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4072   -0.2177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7435    1.1693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6474   -0.9060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6474    0.5112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9719    0.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9719   -0.9466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5737    1.1693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2682   -0.2177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1468   -0.9466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9837   -0.9466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7126   -0.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.1276    0.5112    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
  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
 13 20  4  0  0  0  0
  7 21  1  0  0  0  0
 17 22  1  0  0  0  0
  5 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  5 15  1  0  0  0  0
 14 19  4  0  0  0  0
 17 20  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI16298

>  <IDNUMBER>
BAS 00289676

>  <Activity>
0
$$$$
ASI24221
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
    0.2799    0.7439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419   -0.5045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419   -1.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2799   -0.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9870    1.9814    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9870    1.1564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419    1.1564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1527   -0.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419   -2.1507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1527    0.7439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9870    3.6201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419    1.9814    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3940   -1.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2668   -1.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7198    2.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2652    2.3827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7198    3.2188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1490   -2.5705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2799   -3.3771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1343   -3.3881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4272   -3.8080    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
  8 10  4  0  0  0  0
  3  9  1  0  0  0  0
  7 10  4  0  0  0  0
 11 17  1  0  0  0  0
  7 12  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  9 19  4  0  0  0  0
  9 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
  2  8  4  0  0  0  0
 11 18  1  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24221

>  <IDNUMBER>
BAS 00344564

>  <Activity>
0
$$$$
ASI14366
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -1.2727   -0.8096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0040   -0.0813    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0070   -0.8449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2333   -0.0848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6116   -1.3009    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0894   -1.0464    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8167   -1.0323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6939   -0.4703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9100    1.1348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1076    1.3294    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2757    0.5975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4964   -0.6930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4864    1.7146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3894   -0.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525    0.7495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7191   -1.4778    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
  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
  9 10  1  0  0  0  0
 10 15  1  0  0  0  0
  4 11  2  0  0  0  0
  8 12  4  0  0  0  0
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  7 14  1  0  0  0  0
 15 20  4  0  0  0  0
 12 16  1  0  0  0  0
 14 17  4  0  0  0  0
 14 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
  8 21  4  0  0  0  0
  9 22  1  0  0  0  0
 12 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
 15 19  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI14366

>  <IDNUMBER>
BAS 00276506

>  <Activity>
0
$$$$
ASI29693
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -1.1038   -0.3119    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.7790    0.1645    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6992    0.9564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1262    0.6273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.0894   -0.6992    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
  3  5  1  0  0  0  0
  2  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
  7 16  4  0  0  0  0
  7 17  4  0  0  0  0
 15 18  1  0  0  0  0
 17 19  4  0  0  0  0
 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
  5  6  1  0  0  0  0
 19 21  4  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI29693

>  <IDNUMBER>
BAS 00392131

>  <Activity>
0
$$$$
ASI23404
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
    0.5930    0.0773    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -0.6394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097    0.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  4  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
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
 15 23  1  0  0  0  0
 15 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
 13 17  4  0  0  0  0
 10 14  4  0  0  0  0
M  CHG  1  15   1
M  END
>  <NAME>
ASI23404

>  <IDNUMBER>
BAS 00340852

>  <Activity>
0
$$$$
ASI23569
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
   -0.3361   -1.7301    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
  8  9  1  0  0  0  0
  3 10  2  0  0  0  0
  8 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  4  0  0  0  0
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 13 16  4  0  0  0  0
 13 17  4  0  0  0  0
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 17 21  4  0  0  0  0
 18 22  4  0  0  0  0
 21 23  4  0  0  0  0
  3  5  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI23569

>  <IDNUMBER>
BAS 00341273

>  <Activity>
0
$$$$
ASI11483
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
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 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 10 20  1  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
  2  5  4  0  0  0  0
 19 22  4  0  0  0  0
  9 16  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI11483

>  <IDNUMBER>
BAS 00232168

>  <Activity>
0
$$$$
ASI24684
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
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 13 17  1  0  0  0  0
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 12 15  4  0  0  0  0
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 16 20  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
 14 16  4  0  0  0  0
 21 22  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24684

>  <IDNUMBER>
BAS 00347685

>  <Activity>
0
$$$$
ASI22270
  Marvin  04201015132D          

 22 23  0  0  1  0            999 V2000
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  1  9  4  0  0  0  0
  1 10  4  0  0  0  0
  4 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
 15 16  1  0  0  0  0
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  2 18  1  0  0  0  0
  8 19  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
 13 15  4  0  0  0  0
  4  8  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22270

>  <IDNUMBER>
BAS 00333798

>  <Activity>
0
$$$$
ASI10204
  Marvin  04201015132D          

 21 23  0  0  1  0            999 V2000
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 18 21  4  0  0  0  0
 19 20  4  0  0  0  0
  9 20  4  0  0  0  0
  9 21  4  0  0  0  0
  5  6  1  0  0  0  0
 11 16  4  0  0  0  0
 10 19  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10204

>  <IDNUMBER>
BAS 00218479

>  <Activity>
0
$$$$
ASI6190
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
   -0.1021    1.1916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6050   -0.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1021   -0.4519    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6050    0.7871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8127   -0.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1021    2.0116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8127    0.7871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5233   -1.2682    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3156   -0.4519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2266    2.4015    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
  3  5  4  0  0  0  0
  1  4  4  0  0  0  0
  5  8  4  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  1  8  4  0  0  0  0
  9 11  1  0  0  0  0
  2 10  1  0  0  0  0
  5 11  1  0  0  0  0
 10 12  4  0  0  0  0
 10 13  4  0  0  0  0
  4 14  1  0  0  0  0
 15 17  4  0  0  0  0
 13 16  4  0  0  0  0
 12 17  4  0  0  0  0
 15 18  1  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  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
 21 26  1  0  0  0  0
 22 27  1  0  0  0  0
 25 28  1  0  0  0  0
 27 29  1  0  0  0  0
  2  3  4  0  0  0  0
 24 28  1  0  0  0  0
 15 16  4  0  0  0  0
 26 29  1  0  0  0  0
M  CHG  2   7   1   9   1
M  END
>  <NAME>
ASI6190

>  <IDNUMBER>
BAS 00135186

>  <Activity>
0
$$$$
ASI26550
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
    0.6580    0.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2256    0.9919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6769   -1.1611    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2538   -0.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5829    0.9919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948    0.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9871    1.7157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0153    0.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0460    0.9919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2281    0.9919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6346    1.7157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8239    1.7157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8239    0.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2773   -1.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948   -1.1611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4549    0.2914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0460   -0.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9178   -1.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7075    0.9919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1165    0.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5089   -2.5854    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
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  9 16  1  0  0  0  0
  6 17  4  0  0  0  0
  6 18  4  0  0  0  0
 16 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
 14 22  1  0  0  0  0
 18 23  4  0  0  0  0
 17 24  4  0  0  0  0
 23 25  4  0  0  0  0
 21 26  1  0  0  0  0
 10 12  4  0  0  0  0
 24 25  4  0  0  0  0
 22 26  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26550

>  <IDNUMBER>
BAS 00367510

>  <Activity>
0
$$$$
ASI30595
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
    0.9828   -0.4798    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2786   -0.9287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1703   -0.2476    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0061   -1.2847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2399   -1.5736    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1144   -0.9287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6535    0.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5529    0.8668    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7154   -1.7413    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5168   -0.2218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3595    2.4893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5168   -1.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1041    0.5082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7790    1.1918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2107    1.3543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6914    2.0121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3526   -0.2218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7551   -0.9287    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  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
 11 16  1  0  0  0  0
  6 12  4  0  0  0  0
 10 13  1  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  1  0  0  0  0
 12 20  4  0  0  0  0
 20 21  4  0  0  0  0
  2  5  4  0  0  0  0
 11 17  1  0  0  0  0
 18 21  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI30595

>  <IDNUMBER>
BAS 00395378

>  <Activity>
0
$$$$
ASI15797
  Marvin  04201015132D          

 26 29  0  0  0  0            999 V2000
    1.9881   -0.2706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4026    0.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7833   -0.0276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2085   -0.7400    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.6074    0.1270    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8003   -1.0713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6457    1.1210    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9931    0.7677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6783   -1.3806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3581    0.0110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9609   -0.3092    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1759    0.8062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4409    1.3198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7557    1.3641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.1915    1.6789    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
  2  5  1  0  0  0  0
  1  6  4  0  0  0  0
  2  7  4  0  0  0  0
  3  8  4  0  0  0  0
  6  9  4  0  0  0  0
 10 15  1  0  0  0  0
 11 20  1  0  0  0  0
 10 12  4  0  0  0  0
  8 13  4  0  0  0  0
 12 14  4  0  0  0  0
 11 15  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
 10 18  4  0  0  0  0
 19 23  4  0  0  0  0
 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
 12 22  1  0  0  0  0
 18 23  4  0  0  0  0
 19 24  1  0  0  0  0
  9 25  1  0  0  0  0
 25 26  1  0  0  0  0
  4  9  4  0  0  0  0
  7 13  4  0  0  0  0
 11 21  1  0  0  0  0
 14 19  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI15797

>  <IDNUMBER>
BAS 00287770

>  <Activity>
0
$$$$
ASI21317
  Marvin  04201015132D          

 20 20  0  0  0  0            999 V2000
    3.8790   -0.1311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2942    0.3037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1596   -0.5108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6383   -0.4417    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6454    0.8007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0534    0.5970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0457   -0.5763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8083   -0.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7444    0.6798    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2302   -0.6591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4003   -1.1043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4537   -0.3589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1845    1.4115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4787    0.3658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5926    1.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3 12  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  6  2  0  0  0  0
  2  7  1  0  0  0  0
  8  9  2  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
  8 12  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
 11 15  1  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
 18 20  4  0  0  0  0
 19 20  4  0  0  0  0
M  CHG  2   3   1   5   1
M  END
>  <NAME>
ASI21317

>  <IDNUMBER>
BAS 00328164

>  <Activity>
0
$$$$
ASI27381
  Marvin  04201015132D          

 27 28  0  0  0  0            999 V2000
   -2.8260    0.7437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4621    0.7437    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2164    1.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.0468    1.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7228    0.0309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8924    0.0309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4931   -0.7065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1382    0.7437    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2204   -1.3944    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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    4.6418   -0.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6109   -2.1072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4413   -2.1072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  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
  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
 10 16  4  0  0  0  0
  3 11  1  0  0  0  0
  7 12  2  0  0  0  0
  6 13  2  0  0  0  0
  9 14  2  0  0  0  0
  8 15  1  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
  9 18  1  0  0  0  0
 19 23  1  0  0  0  0
 15 20  4  0  0  0  0
 15 21  4  0  0  0  0
 18 22  1  0  0  0  0
 22 23  1  0  0  0  0
 19 24  1  0  0  0  0
 19 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
  2  6  4  0  0  0  0
 10 17  4  0  0  0  0
M  CHG  1  19   1
M  STY  2   1 DAT   2 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  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>
ASI27381

>  <IDNUMBER>
BAS 00379768

>  <Activity>
0
$$$$
ASI15380
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.9401   -0.9073    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8153   -1.7291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2236   -0.5260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3420   -1.1242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0264   -1.8541    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1637   -0.8678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7291   -0.5523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8343    0.2959    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3938   -0.0525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4135   -2.2879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1314    0.2959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1827    0.1644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9592    1.9723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5510    0.6377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5510   -1.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8277    1.5582    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
  4  6  2  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  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
 13 18  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
  9 17  4  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 12 20  4  0  0  0  0
 14 21  1  0  0  0  0
 17 22  4  0  0  0  0
 22 23  4  0  0  0  0
  4  5  1  0  0  0  0
 13 19  1  0  0  0  0
 20 23  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15380

>  <IDNUMBER>
BAS 00285540

>  <Activity>
0
$$$$
ASI30214
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
   -2.6996    0.4537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2696    0.4537    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9846    0.8616    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1250    0.4537    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.6996   -0.3713    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4146    0.8616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5546    0.8616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2963   -0.7884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5904   -0.3713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1604    0.4537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0112   -0.3713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8754   -0.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7262   -0.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8446    1.6912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.1563   -1.6087    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  7  1  0  0  0  0
  1  5  2  0  0  0  0
  4  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  2  0  0  0  0
  9 10  1  0  0  0  0
 10 13  4  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 11 15  4  0  0  0  0
 11 16  4  0  0  0  0
 12 17  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  6 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
 24 25  4  0  0  0  0
 10 14  4  0  0  0  0
 23 25  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI30214

>  <IDNUMBER>
BAS 00394007

>  <Activity>
0
$$$$
ASI20025
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.6207    0.0316    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8995   -0.7285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2026    0.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4434   -0.7855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2534   -1.2415    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0767    0.7347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2035   -0.9627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8938    0.5827    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.7418   -0.9375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7157    0.6715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5280    0.2344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1797   -0.0254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9650   -0.2406    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2557    1.0197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9579    0.7665    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 20  1  0  0  0  0
 11 13  4  0  0  0  0
 13 14  4  0  0  0  0
 14 15  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
 18 19  4  0  0  0  0
 11 19  4  0  0  0  0
 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
 18 22  4  0  0  0  0
  4  5  1  0  0  0  0
 12 21  1  0  0  0  0
 14 22  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI20025

>  <IDNUMBER>
BAS 00319435

>  <Activity>
0
$$$$
ASI27123
  Marvin  04201015132D          

 23 24  0  0  1  0            999 V2000
    0.7947    0.0573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6571    0.0573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0764    1.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6571    0.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3754   -0.3553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9475    1.6619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5015   -1.1996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1882    0.2560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8425    2.7049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  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
  3  8  2  0  0  0  0
  2  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  6 12  1  0  0  0  0
 13 18  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
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 12 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
  3  6  1  0  0  0  0
 13 17  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI27123

>  <IDNUMBER>
BAS 00371605

>  <Activity>
0
$$$$
ASI29694
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -1.3103   -0.2613    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.9913    0.2171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1583    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1617   -0.1252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5717    0.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1605    0.9165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7630   -0.4564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9004   -0.8834    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
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  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  8 12  4  0  0  0  0
  4  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 14  4  0  0  0  0
 12 15  4  0  0  0  0
  9 13  1  0  0  0  0
 13 14  4  0  0  0  0
 13 15  4  0  0  0  0
 10 16  1  0  0  0  0
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 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
  5  6  1  0  0  0  0
 21 22  4  0  0  0  0
  8 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI29694

>  <IDNUMBER>
BAS 00392132

>  <Activity>
0
$$$$
ASI26549
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
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  1  2  1  0  0  0  0
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  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
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 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 19 22  1  0  0  0  0
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 17 24  4  0  0  0  0
 23 25  4  0  0  0  0
 21 26  1  0  0  0  0
 10 12  4  0  0  0  0
 24 25  4  0  0  0  0
 20 26  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26549

>  <IDNUMBER>
BAS 00367508

>  <Activity>
0
$$$$
ASI6199
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
    0.4125   -0.2707    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4  5  4  0  0  0  0
  1  5  1  0  0  0  0
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  3  7  1  0  0  0  0
  6  8  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  1  0  0  0  0
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 12 18  1  0  0  0  0
 11 13  2  0  0  0  0
  4 14  4  0  0  0  0
  5 15  4  0  0  0  0
  8 16  1  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 11 20  1  0  0  0  0
 21 22  4  0  0  0  0
 15 22  4  0  0  0  0
  3  4  1  0  0  0  0
 12 19  1  0  0  0  0
 14 21  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI6199

>  <IDNUMBER>
BAS 00135376

>  <Activity>
0
$$$$
ASI22037
  Marvin  04201015132D          

 25 27  0  0  1  0            999 V2000
    2.6266    0.6016    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 11 16  1  0  0  0  0
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  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
 16 20  1  0  0  0  0
 14 17  1  0  0  0  0
  3 18  1  0  0  0  0
  9 19  1  0  0  0  0
  8 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 19 23  1  0  0  0  0
 15 24  1  0  0  0  0
 24 25  1  0  0  0  0
 18 25  1  0  0  0  0
  8 21  1  0  0  0  0
 10 12  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22037

>  <IDNUMBER>
BAS 00332449

>  <Activity>
0
$$$$
ASI13462
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
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 10 13  4  0  0  0  0
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 12 13  4  0  0  0  0
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  8 16  1  0  0  0  0
 13 17  1  0  0  0  0
  3  5  1  0  0  0  0
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M  CHG  1  11   1
M  END
>  <NAME>
ASI13462

>  <IDNUMBER>
BAS 00262651

>  <Activity>
0
$$$$
ASI366
  Marvin  04201015132D          

 17 19  0  0  0  0            999 V2000
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  4 10  1  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
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 14 15  4  0  0  0  0
M  CHG  1   2   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>
ASI366

>  <IDNUMBER>
BAS 00012763

>  <Activity>
0
$$$$
ASI14625
  Marvin  04201015132D          

 32 35  0  0  0  0            999 V2000
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  2 12  1  0  0  0  0
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 15 22  1  0  0  0  0
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 17 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
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 28 31  4  0  0  0  0
 30 32  4  0  0  0  0
  9 15  4  0  0  0  0
  2 13  1  0  0  0  0
 27 31  4  0  0  0  0
 29 32  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI14625

>  <IDNUMBER>
BAS 00280482

>  <Activity>
0
$$$$
ASI10847
  Marvin  04201015132D          

 30 32  0  0  1  0            999 V2000
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  1  7  1  0  0  0  0
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  8 10  1  0  0  0  0
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  3 12  1  0  0  0  0
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 13 15  4  0  0  0  0
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 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 15 19  4  0  0  0  0
 16 20  4  0  0  0  0
 11 21  1  0  0  0  0
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 23 25  4  0  0  0  0
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 13 25  4  0  0  0  0
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 20 30  1  0  0  0  0
  2  9  1  0  0  0  0
 19 27  4  0  0  0  0
 20 28  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10847

>  <IDNUMBER>
BAS 00226271

>  <Activity>
0
$$$$
ASI27144
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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 18 24  1  0  0  0  0
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 22 26  1  0  0  0  0
  3  7  4  0  0  0  0
 17 23  4  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27144

>  <IDNUMBER>
BAS 00371676

>  <Activity>
0
$$$$
ASI53
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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 10 17  1  0  0  0  0
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 13 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>
ASI53

>  <IDNUMBER>
BAS 00004263

>  <Activity>
0
$$$$
ASI31261
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
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 20 22  4  0  0  0  0
 22 23  4  0  0  0  0
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 21 23  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI31261

>  <IDNUMBER>
BAS 00399701

>  <Activity>
0
$$$$
ASI11763
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
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  3  9  2  0  0  0  0
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 11 19  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 18  1  0  0  0  0
  5 15  4  0  0  0  0
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 12 18  1  0  0  0  0
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 15 22  4  0  0  0  0
 22 23  4  0  0  0  0
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 21 23  4  0  0  0  0
 11 20  1  0  0  0  0
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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>
ASI11763

>  <IDNUMBER>
BAS 00234533

>  <Activity>
0
$$$$
ASI12254
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
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 14 16  4  0  0  0  0
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 18 24  1  0  0  0  0
 21 25  1  0  0  0  0
 20 26  1  0  0  0  0
  4  6  4  0  0  0  0
 23 24  1  0  0  0  0
 14 17  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI12254

>  <IDNUMBER>
BAS 00245543

>  <Activity>
0
$$$$
1qon_I40|ligand_xray|mol2|1|dock1
  Marvin  04201014582D          

 23 26  0  0  0  0            999 V2000
   18.6123   31.7610    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   19.3268   32.1735    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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  6 23  4  0  0  0  0
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 10 15  4  0  0  0  0
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 17 22  4  0  0  0  0
 17 18  4  0  0  0  0
 18 19  4  0  0  0  0
 19 20  4  0  0  0  0
 20 21  4  0  0  0  0
 21 22  4  0  0  0  0
M  END
>  <Activity>
1

>  <PDB_ID>
1qon_I40|ligand_xray|mol2|1|dock1

$$$$
ASI7040
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
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 13 17  1  0  0  0  0
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 11 16  1  0  0  0  0
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 15 22  4  0  0  0  0
 18 23  1  0  0  0  0
 19 24  1  0  0  0  0
  5  6  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI7040

>  <IDNUMBER>
BAS 00141393

>  <Activity>
0
$$$$
ASI13596
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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 10 12  4  0  0  0  0
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 16 18  1  0  0  0  0
 11 17  1  0  0  0  0
 14 18  1  0  0  0  0
  7  9  4  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI13596

>  <IDNUMBER>
BAS 00266240

>  <Activity>
0
$$$$
ASI30166
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 13 15  4  0  0  0  0
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 18 21  4  0  0  0  0
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 19 20  4  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30166

>  <IDNUMBER>
BAS 00393744

>  <Activity>
0
$$$$
ASI2885
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
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  2 16  1  0  0  0  0
  3  7  1  0  0  0  0
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  1  7  1  0  0  0  0
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  1 10  1  0  0  0  0
  3 11  2  0  0  0  0
  3 12  1  0  0  0  0
  6 13  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
 16 18  1  0  0  0  0
 17 23  1  0  0  0  0
 18 19  1  0  0  0  0
 12 19  1  0  0  0  0
 18 20  1  0  0  0  0
  2 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 15  1  0  0  0  0
  5 14  1  0  0  0  0
  5 13  1  0  0  0  0
 17 24  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI2885

>  <IDNUMBER>
BAS 00100456

>  <Activity>
0
$$$$
ASI30175
  Marvin  04201015132D          

 29 32  0  0  0  0            999 V2000
    2.1484   -0.6962    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  1  6  4  0  0  0  0
  7 15  1  0  0  0  0
  4  8  4  0  0  0  0
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 10 11  4  0  0  0  0
  2 12  2  0  0  0  0
  2 13  1  0  0  0  0
  5 14  2  0  0  0  0
 15 19  4  0  0  0  0
  9 16  4  0  0  0  0
  9 17  4  0  0  0  0
 10 18  1  0  0  0  0
 16 19  4  0  0  0  0
 17 20  4  0  0  0  0
  4 21  4  0  0  0  0
  8 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
 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
  8 11  4  0  0  0  0
 22 25  4  0  0  0  0
 15 20  4  0  0  0  0
 27 29  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30175

>  <IDNUMBER>
BAS 00393758

>  <Activity>
0
$$$$
ASI27327
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
   -0.0052    0.0052    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8329    0.0052    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
  1  4  2  0  0  0  0
  1  5  2  0  0  0  0
  6  9  1  0  0  0  0
  2  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
  3 11  4  0  0  0  0
  3 12  4  0  0  0  0
 13 15  4  0  0  0  0
 12 14  4  0  0  0  0
 11 15  4  0  0  0  0
 13 16  1  0  0  0  0
  6 17  1  0  0  0  0
  6 10  1  0  0  0  0
 13 14  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI27327

>  <IDNUMBER>
BAS 00378108

>  <Activity>
0
$$$$
ASI15400
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
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  1 10  2  0  0  0  0
 11 13  4  0  0  0  0
  7 12  1  0  0  0  0
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 14 15  4  0  0  0  0
 12 15  4  0  0  0  0
  4 16  2  0  0  0  0
 17 19  4  0  0  0  0
 12 18  4  0  0  0  0
 18 19  4  0  0  0  0
 10 20  1  0  0  0  0
 14 21  1  0  0  0  0
 17 22  1  0  0  0  0
 20 23  4  0  0  0  0
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 23 26  4  0  0  0  0
 24 27  4  0  0  0  0
 27 28  4  0  0  0  0
  3  4  1  0  0  0  0
 26 28  4  0  0  0  0
  7 11  4  0  0  0  0
 14 17  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15400

>  <IDNUMBER>
BAS 00285639

>  <Activity>
0
$$$$
ASI11476
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
    1.4970   -1.1695    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  5  1  0  0  0  0
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  4  7  4  0  0  0  0
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
  9 12  2  0  0  0  0
  9 13  1  0  0  0  0
 13 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  4  0  0  0  0
  7 17  4  0  0  0  0
 14 18  1  0  0  0  0
 14 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 16 24  4  0  0  0  0
 17 25  4  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  4  0  0  0  0
 24 25  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI11476

>  <IDNUMBER>
BAS 00232122

>  <Activity>
0
$$$$
ASI10534
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
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M  END
>  <NAME>
ASI10534

>  <IDNUMBER>
BAS 00221462

>  <Activity>
0
$$$$
ASI21815
  Marvin  04201015132D          

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M  END
>  <NAME>
ASI21815

>  <IDNUMBER>
BAS 00331494

>  <Activity>
0
$$$$
ASI56
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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M  END
>  <NAME>
ASI56

>  <IDNUMBER>
BAS 00004268

>  <Activity>
0
$$$$
1u65_CP0
  Marvin  04201014582D          

 43 49  0  0  0  0            999 V2000
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M  END
>  <Activity>
1

>  <PDB_ID>
1u65_CP0

$$$$
ASI15042
  Marvin  04201015132D          

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M  END
>  <NAME>
ASI15042

>  <IDNUMBER>
BAS 00283321

>  <Activity>
0
$$$$
ASI622
  Marvin  04201015132D          

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 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
  3  4  4  0  0  0  0
 17 20  1  0  0  0  0
 22 25  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI622

>  <IDNUMBER>
BAS 00024356

>  <Activity>
0
$$$$
ASI10866
  Marvin  04201015132D          

 19 19  0  0  0  0            999 V2000
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  1  4  2  0  0  0  0
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  2  7  1  0  0  0  0
  8 13  4  0  0  0  0
  3  9  1  0  0  0  0
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 10 12  4  0  0  0  0
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  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
  8 12  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10866

>  <IDNUMBER>
BAS 00226335

>  <Activity>
0
$$$$
ASI10526
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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 12 27  1  0  0  0  0
  4 12  1  0  0  0  0
 14 18  4  0  0  0  0
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M  CHG  1   5   1
M  END
>  <NAME>
ASI10526

>  <IDNUMBER>
BAS 00221394

>  <Activity>
0
$$$$
ASI10887
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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  1  4  4  0  0  0  0
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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
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 13 17  1  0  0  0  0
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 16 19  4  0  0  0  0
 19 20  4  0  0  0  0
  3  5  4  0  0  0  0
 18 20  4  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10887

>  <IDNUMBER>
BAS 00226477

>  <Activity>
0
$$$$
ASI6092
  Marvin  04201015132D          

 27 31  0  0  1  0            999 V2000
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 18 23  1  0  0  0  0
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  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 19 21  4  0  0  0  0
 14 27  1  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI6092

>  <IDNUMBER>
BAS 00134215

>  <Activity>
0
$$$$
1j07_DCU
  Marvin  04201014582D          

 36 39  0  0  0  0            999 V2000
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 34 35  4  0  0  0  0
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M  CHG  1   2   1
M  END
>  <Activity>
1

>  <PDB_ID>
1j07_DCU

$$$$
ASI5559
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
   -0.3661   -0.2631    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0810   -0.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3661    0.5720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0810    0.9838    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7902   -0.2631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7902    0.5720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.9551    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3775    1.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0810   -1.5157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3432   -0.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5051   -0.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5957    0.2460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6472    1.6414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5051    0.9838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3432   -1.4985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0638   -0.2631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2257   -0.2631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4193    0.2173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7787   -0.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7787   -1.4985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8596    0.8865    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  8  1  0  0  0  0
  3  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
  7 12  4  0  0  0  0
  7 13  4  0  0  0  0
  6 14  4  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
 12 18  4  0  0  0  0
 13 19  4  0  0  0  0
 14 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  4  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  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI5559

>  <IDNUMBER>
BAS 00129540

>  <Activity>
0
$$$$
ASI22380
  Marvin  04201015132D          

 20 23  0  0  1  0            999 V2000
    0.2019   -0.0959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3354   -0.9172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5749    0.9856    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4450    0.4894    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0959    2.1525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2978   -1.4681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1053   -1.2046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2560   -2.0157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0959    2.9533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6399   -2.5701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0848   -1.2046    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0362   -2.2826    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
  1  4  1  0  0  0  0
  5  9  1  0  0  0  0
  6  8  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  3 10  1  0  0  0  0
  2 11  4  0  0  0  0
  2 12  4  0  0  0  0
  6 13  1  0  0  0  0
 11 14  4  0  0  0  0
 12 15  4  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
 15 18  4  0  0  0  0
 11 19  1  0  0  0  0
 15 20  1  0  0  0  0
  6  7  1  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
 14 18  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI22380

>  <IDNUMBER>
BAS 00334606

>  <Activity>
0
$$$$
ASI31962
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
   -1.1034    0.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5108    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3256    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8657   -0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3225    0.9166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7330    0.7017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0128    0.4583    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.9495    0.3452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1034   -0.8770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5108    1.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3256    1.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3425    0.0227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7005   -0.4413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4063    1.0015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8857   -0.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6141    0.8148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2207    0.2943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7869    0.5432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7129    1.9012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0849    1.7202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5560   -0.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3780    0.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9763   -0.8148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8899   -1.1203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6183   -2.5519    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
  6 11  1  0  0  0  0
  7 17  1  0  0  0  0
  8 13  4  0  0  0  0
  4  9  1  0  0  0  0
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 21  1  0  0  0  0
 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 12 15  4  0  0  0  0
 12 16  4  0  0  0  0
  5 17  1  0  0  0  0
  8 18  1  0  0  0  0
 19 20  1  0  0  0  0
  5 20  1  0  0  0  0
  7 21  1  0  0  0  0
  3 22  1  0  0  0  0
  3 23  1  0  0  0  0
  9 24  4  0  0  0  0
  9 25  4  0  0  0  0
 24 26  4  0  0  0  0
 25 27  4  0  0  0  0
 26 28  4  0  0  0  0
  3  6  1  0  0  0  0
 27 28  4  0  0  0  0
  8 14  4  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI31962

>  <IDNUMBER>
BAS 00404321

>  <Activity>
0
$$$$
ASI33399
  Marvin  04201015132D          

 17 19  0  0  0  0            999 V2000
   -0.0869    0.4605    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0869   -0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8034   -0.7573    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5094    0.4605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6600    0.8903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5094   -0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4070    0.4605    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6702   -0.7829    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2206    0.8698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2206   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4070   -0.3991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1335    0.9005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9369    0.4605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1848   -0.8187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9112    0.4860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9369   -0.3530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9112   -0.3889    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
  4  9  4  0  0  0  0
  6 10  4  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 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
 15 17  1  0  0  0  0
  3  6  4  0  0  0  0
 10 16  4  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI33399

>  <IDNUMBER>
BAS 00411553

>  <Activity>
0
$$$$
ASI15025
  Marvin  04201015132D          

 29 31  0  0  0  0            999 V2000
    0.9508    0.0534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7258    0.3283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2876    0.9011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7950   -0.6339    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1462    0.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6461    1.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3673   -0.1986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8671    1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3185   -1.2639    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0314   -0.3131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8133   -0.7865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4365   -0.1145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8981   -1.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3860   -0.8171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9130    0.4964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4850    0.2940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2154   -0.4506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6656   -1.7641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7763   -0.4314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5586    2.5010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6388   -1.2447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7084   -1.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  6  4  0  0  0  0
  4 11  1  0  0  0  0
  5  8  4  0  0  0  0
  6  9  4  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
 10 18  1  0  0  0  0
 11 15  4  0  0  0  0
  1 12  2  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
 15 23  4  0  0  0  0
 16 24  4  0  0  0  0
  7 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
  3 20  1  0  0  0  0
  6 21  1  0  0  0  0
  5 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
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 25 29  1  0  0  0  0
  3  5  4  0  0  0  0
 11 16  4  0  0  0  0
 10 19  1  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI15025

>  <IDNUMBER>
BAS 00283172

>  <Activity>
0
$$$$
ASI7048
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -0.7856   -0.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7856   -0.8819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5031    0.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5031   -1.2867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2126   -0.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0481    0.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0481   -1.3228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8058    0.3928    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0601    1.2346    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5031    1.1985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6573    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2447    1.1985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5071   -2.1003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9261    0.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9261   -1.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3828    0.4009    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 18  1  0  0  0  0
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 13 21  1  0  0  0  0
  4 14  1  0  0  0  0
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 12 17  1  0  0  0  0
 17 18  1  0  0  0  0
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 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 15 23  4  0  0  0  0
 16 24  4  0  0  0  0
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 23 24  4  0  0  0  0
 13 22  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7048

>  <IDNUMBER>
BAS 00141401

>  <Activity>
0
$$$$
ASI22665
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
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  3  7  2  0  0  0  0
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  2 11  2  0  0  0  0
 10 12  4  0  0  0  0
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  4 14  2  0  0  0  0
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 17 18  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>
ASI22665

>  <IDNUMBER>
BAS 00336309

>  <Activity>
0
$$$$
ASI18149
  Marvin  04201015132D          

 20 23  0  0  0  0            999 V2000
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 18 20  4  0  0  0  0
  3  4  4  0  0  0  0
  9 10  1  0  0  0  0
 17 20  4  0  0  0  0
 16 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18149

>  <IDNUMBER>
BAS 00312120

>  <Activity>
0
$$$$
ASI33397
  Marvin  04201015132D          

 16 17  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  2  0  0  0  0
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  4  9  4  0  0  0  0
  5 10  4  0  0  0  0
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 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  4  0  0  0  0
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 10 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI33397

>  <IDNUMBER>
BAS 00411551

>  <Activity>
0
$$$$
ASI1063
  Marvin  04201015132D          

 26 28  0  0  1  0            999 V2000
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 17 18  4  0  0  0  0
 14 18  4  0  0  0  0
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 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
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 21 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
  4  5  1  0  0  0  0
 17 19  4  0  0  0  0
 24 26  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI1063

>  <IDNUMBER>
BAS 00063083

>  <Activity>
0
$$$$
ASI25864
  Marvin  04201015132D          

 17 18  0  0  0  0            999 V2000
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 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
  9 10  4  0  0  0  0
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M  CHG  1   2   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>
ASI25864

>  <IDNUMBER>
BAS 00364498

>  <Activity>
0
$$$$
ASI11144
  Marvin  04201015132D          

 25 26  0  0  1  0            999 V2000
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 11 18  4  0  0  0  0
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 18 21  4  0  0  0  0
 17 22  4  0  0  0  0
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  8 24  1  0  0  0  0
 12 25  1  0  0  0  0
  3  4  1  0  0  0  0
 20 22  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI11144

>  <IDNUMBER>
BAS 00228482

>  <Activity>
0
$$$$
ASI10859
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
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  2  5  1  0  0  0  0
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  2  7  2  0  0  0  0
  3  8  2  0  0  0  0
  9 22  1  0  0  0  0
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 11 12  1  0  0  0  0
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 16 18  4  0  0  0  0
 17 19  4  0  0  0  0
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  3 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
  9 21  1  0  0  0  0
 10 16  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10859

>  <IDNUMBER>
BAS 00226308

>  <Activity>
0
$$$$
ASI23363
  Marvin  04201015132D          

 22 24  0  0  1  0            999 V2000
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  2  4  4  0  0  0  0
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  1  4  4  0  0  0  0
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  3  9  4  0  0  0  0
  2 10  4  0  0  0  0
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 11 12  1  0  0  0  0
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 12 15  1  0  0  0  0
  7 16  4  0  0  0  0
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 11 20  1  0  0  0  0
 15 21  1  0  0  0  0
 15 22  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>
ASI23363

>  <IDNUMBER>
BAS 00340746

>  <Activity>
0
$$$$
ASI10928
  Marvin  04201015132D          

 26 27  0  0  1  0            999 V2000
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  1  5  1  0  0  0  0
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 13 14  1  0  0  0  0
 10 14  1  0  0  0  0
 15 16  4  0  0  0  0
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 14 19  1  0  0  0  0
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 22 24  4  0  0  0  0
  8 23  4  0  0  0  0
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  8 25  1  0  0  0  0
  9 26  1  0  0  0  0
 15 17  4  0  0  0  0
 22 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10928

>  <IDNUMBER>
BAS 00226749

>  <Activity>
0
$$$$
ASI23380
  Marvin  04201015132D          

 34 40  0  0  0  0            999 V2000
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   -2.3269    0.3279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 20  1  0  0  0  0
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 17 26  4  0  0  0  0
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 28 30  4  0  0  0  0
 29 31  4  0  0  0  0
 26 32  4  0  0  0  0
 27 33  4  0  0  0  0
 33 34  4  0  0  0  0
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 15 16  4  0  0  0  0
 13 21  1  0  0  0  0
 32 34  4  0  0  0  0
  9 10  1  0  0  0  0
 24 30  4  0  0  0  0
 25 31  4  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI23380

>  <IDNUMBER>
BAS 00340780

>  <Activity>
0
$$$$
ASI18434
  Marvin  04201015132D          

 30 32  0  0  0  0            999 V2000
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 13 16  1  0  0  0  0
 14 15  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
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 18 22  4  0  0  0  0
 12 19  4  0  0  0  0
 12 20  4  0  0  0  0
 11 21  1  0  0  0  0
 19 22  4  0  0  0  0
 20 23  4  0  0  0  0
 21 24  1  0  0  0  0
  5 25  4  0  0  0  0
  9 26  4  0  0  0  0
 18 27  1  0  0  0  0
 25 28  4  0  0  0  0
 27 29  1  0  0  0  0
 28 30  4  0  0  0  0
 18 23  4  0  0  0  0
  4 13  1  0  0  0  0
 26 30  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI18434

>  <IDNUMBER>
BAS 00313346

>  <Activity>
0
$$$$
ASI15379
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.6955   -0.3164    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4056    0.1787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.1981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2778    1.0192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6955   -1.1762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2318    1.6567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4273   -1.6181    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2291   -0.0821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8332   -0.0555    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0433    1.5384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9247   -2.5166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5747    2.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3549    0.7777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3861    2.0529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4777    1.1472    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7796    0.3816    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
 11 14  4  0  0  0  0
 11 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
  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
 18 23  1  0  0  0  0
  4  5  1  0  0  0  0
 12 21  1  0  0  0  0
 13 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15379

>  <IDNUMBER>
BAS 00285539

>  <Activity>
0
$$$$
ASI19999
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.7531   -0.6973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4575    0.0391    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1479   -0.2956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1576   -1.2998    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5216    1.0879    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
  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
 13 16  4  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
  8 18  4  0  0  0  0
 10 19  4  0  0  0  0
 13 20  1  0  0  0  0
 18 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
 13 17  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI19999

>  <IDNUMBER>
BAS 00319392

>  <Activity>
0
$$$$
ASI11038
  Marvin  04201015132D          

 35 37  0  0  1  0            999 V2000
    3.3790    0.4186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0288    0.0085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6831   -0.5126    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6357   -0.8373    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -3.5414    0.6493    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2171    0.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6613    0.8287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3021   -0.7689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  0  0  0  0
  3 18  1  0  0  0  0
  4  7  1  0  0  0  0
  1  5  1  0  0  0  0
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  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 21  1  0  0  0  0
 12 24  1  0  0  0  0
 13 22  1  0  0  0  0
  5 14  1  0  0  0  0
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 18 20  1  0  0  0  0
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 11 20  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
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 24 25  1  0  0  0  0
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 27 30  4  0  0  0  0
 26 31  4  0  0  0  0
 28 32  4  0  0  0  0
 29 33  4  0  0  0  0
 31 34  4  0  0  0  0
 33 35  4  0  0  0  0
 30 34  4  0  0  0  0
 19 23  1  0  0  0  0
 32 35  4  0  0  0  0
M  CHG  2   3   1   4   1
M  END
>  <NAME>
ASI11038

>  <IDNUMBER>
BAS 00227516

>  <Activity>
0
$$$$
ASI24220
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
    1.4408   -0.3647    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7414    0.0478    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1522    0.9086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6934    0.8788    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.8696    1.3391    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 11  1  0  0  0  0
  1  4  1  0  0  0  0
  5 13  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
 10 13  1  0  0  0  0
  9 14  1  0  0  0  0
  4 15  4  0  0  0  0
  4 16  4  0  0  0  0
  6 17  1  0  0  0  0
 15 18  4  0  0  0  0
 16 19  4  0  0  0  0
 18 20  4  0  0  0  0
  3 21  4  0  0  0  0
 21 22  4  0  0  0  0
 22 23  4  0  0  0  0
 12 24  1  0  0  0  0
 20 25  1  0  0  0  0
  5 14  1  0  0  0  0
 19 20  4  0  0  0  0
 12 23  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24220

>  <IDNUMBER>
BAS 00344560

>  <Activity>
0
$$$$
ASI14634
  Marvin  04201015132D          

 23 26  0  0  0  0            999 V2000
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 13 16  1  0  0  0  0
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 10 20  4  0  0  0  0
 13 21  1  0  0  0  0
 19 22  4  0  0  0  0
 22 23  4  0  0  0  0
  5 10  4  0  0  0  0
  4  7  4  0  0  0  0
 20 23  4  0  0  0  0
 13 17  1  0  0  0  0
M  CHG  1  13   1
M  END
>  <NAME>
ASI14634

>  <IDNUMBER>
BAS 00280564

>  <Activity>
0
$$$$
ASI12383
  Marvin  04201015132D          

 32 36  0  0  1  0            999 V2000
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 13 32  1  0  0  0  0
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 15 25  1  0  0  0  0
 11 23  1  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI12383

>  <IDNUMBER>
BAS 00247228

>  <Activity>
0
$$$$
ASI27153
  Marvin  04201015132D          

 27 29  0  0  0  0            999 V2000
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  1  2  4  0  0  0  0
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  4  7  4  0  0  0  0
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  9 10  1  0  0  0  0
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  4 13  4  0  0  0  0
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 12 18  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
 23 27  1  0  0  0  0
  3  7  4  0  0  0  0
 17 24  4  0  0  0  0
 22 27  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI27153

>  <IDNUMBER>
BAS 00371691

>  <Activity>
0
$$$$
ASI30159
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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 20 23  4  0  0  0  0
 22 24  4  0  0  0  0
  8 14  4  0  0  0  0
 19 23  4  0  0  0  0
 21 24  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30159

>  <IDNUMBER>
BAS 00393724

>  <Activity>
0
$$$$
ASI126
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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 18 19  4  0  0  0  0
  4  6  4  0  0  0  0
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M  CHG  1   8   1
M  END
>  <NAME>
ASI126

>  <IDNUMBER>
BAS 00005713

>  <Activity>
0
$$$$
ASI9154
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
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 11 12  4  0  0  0  0
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 11 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
  4  8  1  0  0  0  0
 11 13  4  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI9154

>  <IDNUMBER>
BAS 00190107

>  <Activity>
0
$$$$
ASI11567
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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  7 12  1  0  0  0  0
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 12 13  1  0  0  0  0
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 14 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
  9 19  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI11567

>  <IDNUMBER>
BAS 00232858

>  <Activity>
0
$$$$
ASI26654
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
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  5  7  1  0  0  0  0
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 10 17  1  0  0  0  0
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 18 20  4  0  0  0  0
 18 21  4  0  0  0  0
 20 22  4  0  0  0  0
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 19 24  1  0  0  0  0
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 27 28  1  0  0  0  0
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 26 30  4  0  0  0  0
 29 31  4  0  0  0  0
  3  4  4  0  0  0  0
  8 11  4  0  0  0  0
 10 16  1  0  0  0  0
 30 31  4  0  0  0  0
 19 23  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI26654

>  <IDNUMBER>
BAS 00367895

>  <Activity>
0
$$$$
ASI33355
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
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    0.3083   -0.2300    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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 11 15  4  0  0  0  0
 13 16  1  0  0  0  0
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 14 19  1  0  0  0  0
 16 20  1  0  0  0  0
 19 21  1  0  0  0  0
  4  6  4  0  0  0  0
 13 15  4  0  0  0  0
M  CHG  1   5   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>
ASI33355

>  <IDNUMBER>
BAS 00411368

>  <Activity>
0
$$$$
ASI30195
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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  5 12  4  0  0  0  0
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 14 18  4  0  0  0  0
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 16 18  4  0  0  0  0
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 20 21  4  0  0  0  0
 17 21  4  0  0  0  0
  2 20  4  0  0  0  0
  5  7  4  0  0  0  0
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M  CHG  1   1   1
M  END
>  <NAME>
ASI30195

>  <IDNUMBER>
BAS 00393910

>  <Activity>
0
$$$$
ASI28873
  Marvin  04201015132D          

 24 28  0  0  1  0            999 V2000
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 12 14  4  0  0  0  0
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 11 16  1  0  0  0  0
 14 17  1  0  0  0  0
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 18 19  1  0  0  0  0
 16 20  4  0  0  0  0
 16 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
  3  4  4  0  0  0  0
  6  7  1  0  0  0  0
 14 15  4  0  0  0  0
 13 19  1  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI28873

>  <IDNUMBER>
BAS 00386713

>  <Activity>
0
$$$$
ASI10931
  Marvin  04201015132D          

 20 20  0  0  1  0            999 V2000
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 19 20  4  0  0  0  0
 15 20  4  0  0  0  0
 16 19  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10931

>  <IDNUMBER>
BAS 00226755

>  <Activity>
0
$$$$
ASI33489
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
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  2  6  1  0  0  0  0
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  1 10  1  0  0  0  0
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  9 15  1  0  0  0  0
 10 16  1  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
 18 20  4  0  0  0  0
 15 19  1  0  0  0  0
 17 20  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI33489

>  <IDNUMBER>
BAS 00412864

>  <Activity>
0
$$$$
ASI9835
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
    1.4813   -1.1128    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0156    2.0561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2933    1.6139    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
  1  4  4  0  0  0  0
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  6  9  1  0  0  0  0
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 11 27  1  0  0  0  0
 12 20  4  0  0  0  0
 12 13  4  0  0  0  0
  2 14  1  0  0  0  0
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 16 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  6 20  4  0  0  0  0
 11 21  2  0  0  0  0
 19 22  1  0  0  0  0
 17 23  1  0  0  0  0
 17 24  1  0  0  0  0
  7 25  1  0  0  0  0
 10 26  1  0  0  0  0
 27 28  1  0  0  0  0
 26 28  1  0  0  0  0
  3 29  1  0  0  0  0
 13 30  1  0  0  0  0
  8 10  4  0  0  0  0
  5 13  4  0  0  0  0
 19 24  1  0  0  0  0
 18 23  1  0  0  0  0
 18 22  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI9835

>  <IDNUMBER>
BAS 00211161

>  <Activity>
0
$$$$
ASI3311
  Marvin  04201015132D          

 27 29  0  0  1  0            999 V2000
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   -0.1480   -0.0670    0.0000 S   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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  3  4  1  0  0  0  0
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  4  8  1  0  0  0  0
  9 13  1  0  0  0  0
  2 10  2  0  0  0  0
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 15 16  1  0  0  0  0
 17 20  4  0  0  0  0
 17 18  1  0  0  0  0
 19 21  4  0  0  0  0
 20 22  4  0  0  0  0
 16 21  4  0  0  0  0
 16 22  4  0  0  0  0
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 14 24  1  0  0  0  0
 14 25  4  0  0  0  0
 23 26  4  0  0  0  0
 26 27  4  0  0  0  0
  4  5  1  0  0  0  0
 25 27  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI3311

>  <IDNUMBER>
BAS 00105044

>  <Activity>
0
$$$$
ASI30164
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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    0.0063   -0.0032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  4  0  0  0  0
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 11 14  1  0  0  0  0
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 15 17  4  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
 10 17  4  0  0  0  0
 18 20  4  0  0  0  0
 11 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30164

>  <IDNUMBER>
BAS 00393741

>  <Activity>
0
$$$$
ASI8661
  Marvin  04201015132D          

 18 18  0  0  1  0            999 V2000
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  1 10  1  0  0  0  0
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 10 14  1  0  0  0  0
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 11 16  4  0  0  0  0
 12 17  4  0  0  0  0
 17 18  4  0  0  0  0
 16 18  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI8661

>  <IDNUMBER>
BAS 00170234

>  <Activity>
0
$$$$
ASI23035
  Marvin  04201015132D          

 19 19  0  0  0  0            999 V2000
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  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  4  9  1  0  0  0  0
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  5 11  1  0  0  0  0
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 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
 18 19  4  0  0  0  0
 17 19  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI23035

>  <IDNUMBER>
BAS 00338419

>  <Activity>
0
$$$$
ASI133
  Marvin  04201015132D          

 22 24  0  0  0  0            999 V2000
   -0.8645   -0.3062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0867   -1.1527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1612    0.2521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0626    0.5763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0016    0.1740    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
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  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>
ASI133

>  <IDNUMBER>
BAS 00006050

>  <Activity>
0
$$$$
ASI24209
  Marvin  04201015132D          

 28 30  0  0  0  0            999 V2000
   -1.0736   -1.8925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0736    0.5964    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
  4 11  1  0  0  0  0
  5 14  1  0  0  0  0
  6  9  4  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  2  9  4  0  0  0  0
  3 10  4  0  0  0  0
 11 16  1  0  0  0  0
 12 15  1  0  0  0  0
  4 13  1  0  0  0  0
  6 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  1 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  7 23  1  0  0  0  0
 13 24  4  0  0  0  0
 13 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
  6 10  4  0  0  0  0
  4 12  1  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI24209

>  <IDNUMBER>
BAS 00344540

>  <Activity>
0
$$$$
ASI27213
  Marvin  04201015132D          

 27 30  0  0  0  0            999 V2000
    1.5315    0.1547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0007    0.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5315    1.4696    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0464   -0.0309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0464    1.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3665   -0.7941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3510    0.0257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8361    0.9384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445    1.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0936   -1.2066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445   -1.2118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7742   -0.7941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5013   -2.0110    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
  6  7  4  0  0  0  0
  4  7  4  0  0  0  0
  5  8  4  0  0  0  0
  9 10  1  0  0  0  0
  6 10  1  0  0  0  0
  2 11  1  0  0  0  0
  6 12  4  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 13 15  4  0  0  0  0
 13 16  4  0  0  0  0
  3 17  1  0  0  0  0
 18 19  4  0  0  0  0
 16 19  4  0  0  0  0
 15 20  4  0  0  0  0
 18 21  1  0  0  0  0
 11 22  4  0  0  0  0
 11 23  4  0  0  0  0
 21 24  1  0  0  0  0
 22 25  4  0  0  0  0
 23 26  4  0  0  0  0
 25 27  4  0  0  0  0
  3  5  4  0  0  0  0
  8 12  4  0  0  0  0
 26 27  4  0  0  0  0
 18 20  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI27213

>  <IDNUMBER>
BAS 00372049

>  <Activity>
0
$$$$
ASI10934
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
   -1.3086    0.9274    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1907   -0.5226    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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   -1.7330    1.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4680   -2.6644    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.4795   -0.5070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2 10  1  0  0  0  0
  3  4  1  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  3  7  4  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
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  2 13  1  0  0  0  0
  2 14  1  0  0  0  0
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  8 17  4  0  0  0  0
  8 18  4  0  0  0  0
  9 19  4  0  0  0  0
  9 20  4  0  0  0  0
 15 21  4  0  0  0  0
 17 22  4  0  0  0  0
 18 23  4  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
 25 27  4  0  0  0  0
 23 28  4  0  0  0  0
 24 27  4  0  0  0  0
 22 28  4  0  0  0  0
 16 26  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI10934

>  <IDNUMBER>
BAS 00226761

>  <Activity>
0
$$$$
ASI14629
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
   -0.9251    0.9704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1049    0.9704    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1049   -0.4625    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
  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 15  1  0  0  0  0
  5  8  4  0  0  0  0
  4  9  4  0  0  0  0
  3 10  1  0  0  0  0
  3 11  2  0  0  0  0
  9 12  4  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  7 17  1  0  0  0  0
  5 18  1  0  0  0  0
  4 19  1  0  0  0  0
 12 20  1  0  0  0  0
  8 12  4  0  0  0  0
  7 16  1  0  0  0  0
M  CHG  1   7   1
M  END
>  <NAME>
ASI14629

>  <IDNUMBER>
BAS 00280549

>  <Activity>
0
$$$$
ASI14833
  Marvin  04201015132D          

 25 27  0  0  0  0            999 V2000
   -2.4336   -0.3780    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  4  0  0  0  0
  4  9  4  0  0  0  0
 10 16  4  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
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 14 19  4  0  0  0  0
  9 15  4  0  0  0  0
  8 16  4  0  0  0  0
 13 17  4  0  0  0  0
 13 18  4  0  0  0  0
 17 19  4  0  0  0  0
 18 20  4  0  0  0  0
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 21 23  1  0  0  0  0
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 23 25  1  0  0  0  0
  2 11  1  0  0  0  0
 10 15  4  0  0  0  0
 14 20  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI14833

>  <IDNUMBER>
BAS 00282127

>  <Activity>
0
$$$$
ASI24404
  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  4  1  0  0  0  0
  2  5  1  0  0  0  0
  1  6  1  0  0  0  0
  7  8  1  0  0  0  0
  4  8  1  0  0  0  0
  7  9  2  0  0  0  0
  6 10  4  0  0  0  0
  2 11  2  0  0  0  0
  3 12  2  0  0  0  0
  7 13  1  0  0  0  0
 10 14  4  0  0  0  0
  9 15  1  0  0  0  0
  6 16  4  0  0  0  0
 14 17  1  0  0  0  0
 16 18  4  0  0  0  0
 18 19  4  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
 14 19  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI24404

>  <IDNUMBER>
BAS 00345426

>  <Activity>
0
$$$$
ASI8005
  Marvin  04201015132D          

 20 22  0  0  1  0            999 V2000
   -0.6639    0.0743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0054   -0.4143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1806    1.2215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0729   -1.2004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7595   -0.0797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9932    2.3900    0.0000 O   0  5  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
  4  7  1  0  0  0  0
  1  5  4  0  0  0  0
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  6  7  1  0  0  0  0
  5  8  4  0  0  0  0
  2  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  5 13  4  0  0  0  0
  8 14  4  0  0  0  0
  9 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 13 18  4  0  0  0  0
 18 19  4  0  0  0  0
 17 20  1  0  0  0  0
  3  8  4  0  0  0  0
  4  9  1  0  0  0  0
 14 19  4  0  0  0  0
M  CHG  2   4   1  12  -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>
ASI8005

>  <IDNUMBER>
BAS 00161891

>  <Activity>
0
$$$$
ASI6607
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.6048    0.0721    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2002    0.2963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2015    0.6568    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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  5  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  5 10  4  0  0  0  0
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 11 12  4  0  0  0  0
  4 13  1  0  0  0  0
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  2 15  1  0  0  0  0
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 15 17  1  0  0  0  0
 12 18  1  0  0  0  0
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 14 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
 13 17  1  0  0  0  0
 10 12  4  0  0  0  0
 21 23  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI6607

>  <IDNUMBER>
BAS 00139212

>  <Activity>
0
$$$$
ASI17907
  Marvin  04201015132D          

 31 35  0  0  1  0            999 V2000
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  2  3  1  0  0  0  0
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 16 27  1  0  0  0  0
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 14 18  4  0  0  0  0
 19 21  4  0  0  0  0
 18 20  4  0  0  0  0
 17 21  4  0  0  0  0
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 13 23  1  0  0  0  0
 13 24  1  0  0  0  0
 10 25  4  0  0  0  0
 11 26  4  0  0  0  0
 23 27  1  0  0  0  0
 24 28  1  0  0  0  0
 22 29  1  0  0  0  0
 26 30  4  0  0  0  0
 25 31  4  0  0  0  0
  8  9  1  0  0  0  0
 10 11  4  0  0  0  0
 16 28  1  0  0  0  0
 19 20  4  0  0  0  0
 30 31  4  0  0  0  0
M  CHG  1  13   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>
ASI17907

>  <IDNUMBER>
BAS 00308607

>  <Activity>
0
$$$$
ASI11317
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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   -0.0198   -0.7427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0286    0.2859    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9729    1.2033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0412    1.2708    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
  3  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 15  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  1  0  0  0  0
 12 18  1  0  0  0  0
 17 19  1  0  0  0  0
  4  6  4  0  0  0  0
 12 16  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI11317

>  <IDNUMBER>
BAS 00231330

>  <Activity>
0
$$$$
ASI26552
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
    0.9542    0.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5218    1.1422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5500   -0.2961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2868    1.1422    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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  2 10  1  0  0  0  0
 11 13  4  0  0  0  0
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  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
  6 19  4  0  0  0  0
  6 20  4  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
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 19 26  4  0  0  0  0
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 27 28  4  0  0  0  0
  7 18  1  0  0  0  0
 11 12  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI26552

>  <IDNUMBER>
BAS 00367517

>  <Activity>
0
$$$$
ASI7744
  Marvin  04201015132D          

 20 21  0  0  0  0            999 V2000
    1.6500    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5084    0.5404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5084    1.3654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3791   -1.1192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3735   -1.1064    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 10  4  0  0  0  0
  4  5  1  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
  2  8  2  0  0  0  0
  6  9  2  0  0  0  0
 10 12  4  0  0  0  0
 11 13  4  0  0  0  0
  7 12  4  0  0  0  0
  7 13  4  0  0  0  0
  6 14  1  0  0  0  0
  3 15  1  0  0  0  0
  1 16  4  0  0  0  0
  5 17  4  0  0  0  0
 14 18  1  0  0  0  0
 16 19  4  0  0  0  0
 19 20  4  0  0  0  0
 17 20  4  0  0  0  0
  3 11  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI7744

>  <IDNUMBER>
BAS 00158679

>  <Activity>
0
$$$$
ASI19864
  Marvin  04201015132D          

 25 26  0  0  0  0            999 V2000
    1.5137    0.3199    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3459   -1.3459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14 15  4  0  0  0  0
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 11 17  1  0  0  0  0
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 21 22  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
  9 16  4  0  0  0  0
  8 18  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI19864

>  <IDNUMBER>
BAS 00318967

>  <Activity>
0
$$$$
ASI30173
  Marvin  04201015132D          

 33 36  0  0  0  0            999 V2000
    1.2368   -0.9620    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.3760   -0.5497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9116   -0.5497    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
 10 16  4  0  0  0  0
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  1 19  4  0  0  0  0
 16 20  4  0  0  0  0
 17 21  4  0  0  0  0
 22 23  4  0  0  0  0
 19 23  4  0  0  0  0
 13 24  4  0  0  0  0
 13 25  4  0  0  0  0
 18 26  4  0  0  0  0
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 24 28  4  0  0  0  0
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 26 31  4  0  0  0  0
 31 32  4  0  0  0  0
 29 33  4  0  0  0  0
  3 22  4  0  0  0  0
 15 21  4  0  0  0  0
 30 32  4  0  0  0  0
 28 33  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI30173

>  <IDNUMBER>
BAS 00393756

>  <Activity>
0
$$$$
ASI22274
  Marvin  04201015132D          

 24 25  0  0  1  0            999 V2000
    1.7003    0.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 14  1  0  0  0  0
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 17 18  1  0  0  0  0
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 15 20  4  0  0  0  0
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 16 22  1  0  0  0  0
 14 23  1  0  0  0  0
 22 24  1  0  0  0  0
  3  4  1  0  0  0  0
 17 21  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI22274

>  <IDNUMBER>
BAS 00333809

>  <Activity>
0
$$$$
ASI27167
  Marvin  04201015132D          

 31 35  0  0  0  0            999 V2000
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  3  7  1  0  0  0  0
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 14 22  1  0  0  0  0
  8 23  4  0  0  0  0
 20 24  4  0  0  0  0
 24 25  4  0  0  0  0
 19 26  4  0  0  0  0
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 27 30  1  0  0  0  0
 28 31  1  0  0  0  0
 10 11  1  0  0  0  0
  4  6  4  0  0  0  0
 26 29  4  0  0  0  0
 17 25  4  0  0  0  0
 30 31  1  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI27167

>  <IDNUMBER>
BAS 00371739

>  <Activity>
0
$$$$
ASI29642
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
   -0.2793   -0.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2793   -0.8696    0.0000 N   0  3  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
  4  6  4  0  0  0  0
  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  4  0  0  0  0
  6 10  4  0  0  0  0
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  5 13  1  0  0  0  0
  7 14  4  0  0  0  0
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 17 18  4  0  0  0  0
 11 18  4  0  0  0  0
 14 19  4  0  0  0  0
 19 20  4  0  0  0  0
  6  8  1  0  0  0  0
 10 17  4  0  0  0  0
 16 20  4  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI29642

>  <IDNUMBER>
BAS 00391886

>  <Activity>
0
$$$$
ASI24400
  Marvin  04201015132D          

 21 22  0  0  1  0            999 V2000
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   -0.8054    0.5261    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 13  1  0  0  0  0
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  8 13  1  0  0  0  0
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 11 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 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
  4  6  1  0  0  0  0
 14 19  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI24400

>  <IDNUMBER>
BAS 00345411

>  <Activity>
0
$$$$
ASI23379
  Marvin  04201015132D          

 30 34  0  0  0  0            999 V2000
    1.4464    0.1675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2506   -0.0335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5022    0.2513    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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 10 17  1  0  0  0  0
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 13 19  1  0  0  0  0
  7 14  1  0  0  0  0
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 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
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 16 20  1  0  0  0  0
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 20 23  4  0  0  0  0
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 21 25  4  0  0  0  0
 22 26  4  0  0  0  0
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 25 29  4  0  0  0  0
 28 30  4  0  0  0  0
  3  4  4  0  0  0  0
  8 11  4  0  0  0  0
 10 18  1  0  0  0  0
 26 29  4  0  0  0  0
 27 30  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI23379

>  <IDNUMBER>
BAS 00340778

>  <Activity>
0
$$$$
ASI30580
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
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 10 15  4  0  0  0  0
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 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>
ASI30580

>  <IDNUMBER>
BAS 00395358

>  <Activity>
0
$$$$
ASI31923
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -0.6643    0.3494    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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  4  5  1  0  0  0  0
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  3  7  1  0  0  0  0
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  3  9  4  0  0  0  0
  6 10  4  0  0  0  0
 11 17  1  0  0  0  0
  8 12  1  0  0  0  0
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  4 15  1  0  0  0  0
 15 16  1  0  0  0  0
 14 17  1  0  0  0  0
  7 18  1  0  0  0  0
 13 19  1  0  0  0  0
  9 10  4  0  0  0  0
 11 16  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI31923

>  <IDNUMBER>
BAS 00404080

>  <Activity>
0
$$$$
ASI17602
  Marvin  04201015132D          

 18 19  0  0  0  0            999 V2000
   -1.8358    0.9671    0.0000 N   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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  1  6  4  0  0  0  0
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 10 11  4  0  0  0  0
 11 12  1  0  0  0  0
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 13 16  4  0  0  0  0
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 11 16  4  0  0  0  0
  9 17  1  0  0  0  0
 17 18  1  0  0  0  0
  2  3  4  0  0  0  0
  8  9  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI17602

>  <IDNUMBER>
BAS 00297169

>  <Activity>
0
$$$$
ASI67
  Marvin  04201015132D          

 24 25  0  0  0  0            999 V2000
    1.4669   -0.2229    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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  5  9  4  0  0  0  0
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 11 13  2  0  0  0  0
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 11 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
 15 22  1  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
  4  5  4  0  0  0  0
  6  9  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI67

>  <IDNUMBER>
BAS 00004295

>  <Activity>
0
$$$$
ASI10848
  Marvin  04201015132D          

 28 30  0  0  1  0            999 V2000
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 10 19  1  0  0  0  0
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 12 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 16 21  4  0  0  0  0
 10 17  1  0  0  0  0
 17 18  4  0  0  0  0
 15 19  1  0  0  0  0
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 16 22  1  0  0  0  0
 18 23  4  0  0  0  0
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 25 26  4  0  0  0  0
 17 26  4  0  0  0  0
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 23 28  1  0  0  0  0
  3 14  1  0  0  0  0
 16 20  4  0  0  0  0
 23 27  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI10848

>  <IDNUMBER>
BAS 00226272

>  <Activity>
0
$$$$
ASI5496
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
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 13 19  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
  4  5  4  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI5496

>  <IDNUMBER>
BAS 00128146

>  <Activity>
0
$$$$
ASI15848
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
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 16 20  4  0  0  0  0
 20 21  4  0  0  0  0
  5 10  1  0  0  0  0
 17 18  4  0  0  0  0
 19 21  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI15848

>  <IDNUMBER>
BAS 00287951

>  <Activity>
0
$$$$
ASI3224
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -1.4263   -1.7648    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8048    1.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 10  1  0  0  0  0
 11 20  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 10 14  1  0  0  0  0
  9 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7 17  1  0  0  0  0
  3 18  4  0  0  0  0
  2 19  4  0  0  0  0
  8 20  1  0  0  0  0
 19 21  4  0  0  0  0
 18 22  4  0  0  0  0
  2  3  4  0  0  0  0
 21 22  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI3224

>  <IDNUMBER>
BAS 00104333

>  <Activity>
0
$$$$
ASI21719
  Marvin  04201015132D          

 31 34  0  0  1  0            999 V2000
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    0.8439   -1.3392    0.0000 O   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  1  0  0  0  0
  4  5  1  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
  6  9  1  0  0  0  0
  5 10  1  0  0  0  0
  3 11  2  0  0  0  0
  4 12  2  0  0  0  0
 13 26  1  0  0  0  0
 14 28  1  0  0  0  0
 10 15  4  0  0  0  0
 10 16  4  0  0  0  0
  5 17  1  0  0  0  0
 18 19  4  0  0  0  0
 16 19  4  0  0  0  0
 15 20  4  0  0  0  0
 18 21  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
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 24 26  1  0  0  0  0
 22 27  1  0  0  0  0
 23 28  1  0  0  0  0
 25 29  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
  2  5  1  0  0  0  0
 14 27  1  0  0  0  0
 18 20  4  0  0  0  0
 13 29  1  0  0  0  0
M  CHG  2   8   1   9   1
M  END
>  <NAME>
ASI21719

>  <IDNUMBER>
BAS 00331055

>  <Activity>
0
$$$$
ASI15434
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
    0.1242   -1.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5990   -0.7138    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  5  4  0  0  0  0
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  3  9  1  0  0  0  0
  7 10  1  0  0  0  0
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 12 15  4  0  0  0  0
 10 13  4  0  0  0  0
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 13 15  4  0  0  0  0
 14 16  4  0  0  0  0
 17 18  1  0  0  0  0
 11 18  1  0  0  0  0
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 17 20  4  0  0  0  0
 17 21  4  0  0  0  0
 21 22  4  0  0  0  0
 20 23  4  0  0  0  0
 23 24  4  0  0  0  0
  4  6  4  0  0  0  0
 12 16  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI15434

>  <IDNUMBER>
BAS 00285735

>  <Activity>
0
$$$$
ASI27403
  Marvin  04201015132D          

 30 32  0  0  1  0            999 V2000
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  5 10  4  0  0  0  0
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 12 17  1  0  0  0  0
  6 13  4  0  0  0  0
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 10 15  4  0  0  0  0
 11 16  2  0  0  0  0
 17 19  1  0  0  0  0
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 18 19  1  0  0  0  0
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 13 21  1  0  0  0  0
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 24 28  1  0  0  0  0
 26 29  1  0  0  0  0
 28 30  1  0  0  0  0
  3  5  4  0  0  0  0
 13 15  4  0  0  0  0
 27 30  1  0  0  0  0
M  CHG  1  12   1
M  END
>  <NAME>
ASI27403

>  <IDNUMBER>
BAS 00379921

>  <Activity>
0
$$$$
ASI30177
  Marvin  04201015132D          

 35 39  0  0  0  0            999 V2000
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    5.6572    1.2597    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
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  1  8  1  0  0  0  0
  9 17  1  0  0  0  0
 10 14  1  0  0  0  0
 10 11  1  0  0  0  0
  3 12  2  0  0  0  0
  2 13  2  0  0  0  0
 14 22  4  0  0  0  0
  6 15  4  0  0  0  0
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 15 17  4  0  0  0  0
  7 18  1  0  0  0  0
 10 19  2  0  0  0  0
  8 20  4  0  0  0  0
  8 21  4  0  0  0  0
 20 22  4  0  0  0  0
 21 23  4  0  0  0  0
  6 24  4  0  0  0  0
  4 25  4  0  0  0  0
  5 26  4  0  0  0  0
 24 27  4  0  0  0  0
 27 28  4  0  0  0  0
 18 29  4  0  0  0  0
 18 30  4  0  0  0  0
 26 31  4  0  0  0  0
 25 32  4  0  0  0  0
 29 33  4  0  0  0  0
 30 34  4  0  0  0  0
 34 35  4  0  0  0  0
  4  5  4  0  0  0  0
 14 23  4  0  0  0  0
 31 32  4  0  0  0  0
 17 28  4  0  0  0  0
 33 35  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI30177

>  <IDNUMBER>
BAS 00393762

>  <Activity>
0
$$$$
ASI19907
  Marvin  04201015132D          

 21 23  0  0  0  0            999 V2000
   -1.0297    0.1907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0106   -0.6341    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3861    0.3956    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7828    0.5815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9153    1.7066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8840   -1.7781    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
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  7  8  1  0  0  0  0
  5  8  1  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  4  0  0  0  0
  9 13  4  0  0  0  0
 14 15  4  0  0  0  0
 13 15  4  0  0  0  0
 12 16  4  0  0  0  0
 14 17  1  0  0  0  0
  4 18  4  0  0  0  0
  6 19  4  0  0  0  0
 18 20  4  0  0  0  0
 19 21  4  0  0  0  0
  4  6  4  0  0  0  0
 20 21  4  0  0  0  0
 14 16  4  0  0  0  0
M  CHG  1   5   1
M  END
>  <NAME>
ASI19907

>  <IDNUMBER>
BAS 00319099

>  <Activity>
0
$$$$
ASI10731
  Marvin  04201015132D          

 30 34  0  0  1  0            999 V2000
   -0.2557   -0.5077    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3340    1.4208    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
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  2  5  4  0  0  0  0
  1  6  1  0  0  0  0
  2  7  4  0  0  0  0
  4  8  2  0  0  0  0
  3  9  1  0  0  0  0
  5 10  4  0  0  0  0
  7 11  4  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
  8 14  1  0  0  0  0
  6 15  2  0  0  0  0
 14 16  4  0  0  0  0
 14 17  4  0  0  0  0
 18 19  4  0  0  0  0
 17 19  4  0  0  0  0
 16 20  4  0  0  0  0
 18 21  1  0  0  0  0
 13 22  1  0  0  0  0
 13 23  1  0  0  0  0
 10 24  4  0  0  0  0
 11 25  4  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 25 28  4  0  0  0  0
 24 29  4  0  0  0  0
 27 30  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
 26 30  1  0  0  0  0
 28 29  4  0  0  0  0
M  CHG  1  13   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>
ASI10731

>  <IDNUMBER>
BAS 00225119

>  <Activity>
0
$$$$
ASI21471
  Marvin  04201015132D          

 24 26  0  0  1  0            999 V2000
   -0.6311    0.4904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1023    0.9253    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6311   -0.3283    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3474    1.7439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8186   -0.3283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6311    2.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1023   -1.5776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8186    0.4904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5349   -0.7376    0.0000 O   0  5  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
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  8 11  2  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
  7 14  4  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
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 13 18  4  0  0  0  0
 13 19  4  0  0  0  0
 20 21  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
 23 24  4  0  0  0  0
  7  9  1  0  0  0  0
 14 20  4  0  0  0  0
 22 24  4  0  0  0  0
M  CHG  2   2   1  12  -1
M  END
>  <NAME>
ASI21471

>  <IDNUMBER>
BAS 00329354

>  <Activity>
0
$$$$
ASI26656
  Marvin  04201015132D          

 26 31  0  0  0  0            999 V2000
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  2  5  1  0  0  0  0
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  1  4  4  0  0  0  0
  5 17  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  4  0  0  0  0
  6  8  1  0  0  0  0
  2  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
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
  9 15  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
 14 18  1  0  0  0  0
 14 19  1  0  0  0  0
 13 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  7 23  4  0  0  0  0
 12 24  4  0  0  0  0
 23 25  4  0  0  0  0
 25 26  4  0  0  0  0
  3 12  4  0  0  0  0
 24 26  4  0  0  0  0
  5 16  1  0  0  0  0
 13 19  1  0  0  0  0
 15 18  1  0  0  0  0
 15 20  1  0  0  0  0
M  CHG  1   8   1
M  END
>  <NAME>
ASI26656

>  <IDNUMBER>
BAS 00367962

>  <Activity>
0
$$$$
ASI17605
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
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 11 14  4  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
 12 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  2  7  1  0  0  0  0
 12 13  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI17605

>  <IDNUMBER>
BAS 00297181

>  <Activity>
0
$$$$
ASI21231
  Marvin  04201015132D          

 19 21  0  0  0  0            999 V2000
   -0.4154   -1.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2982    1.7893    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2982   -0.6975    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4154   -1.9491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8532   -1.9171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7254    2.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  7  1  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  1  0  0  0  0
  7  8  1  0  0  0  0
  6  8  1  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
 11 14  4  0  0  0  0
  3 12  4  0  0  0  0
  4 13  4  0  0  0  0
  5 14  4  0  0  0  0
  5 15  4  0  0  0  0
 12 16  4  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 18 19  1  0  0  0  0
 11 13  4  0  0  0  0
 15 16  4  0  0  0  0
 17 19  1  0  0  0  0
M  CHG  1   2   1
M  END
>  <NAME>
ASI21231

>  <IDNUMBER>
BAS 00327476

>  <Activity>
0
$$$$
ASI10944
  Marvin  04201015132D          

 24 27  0  0  0  0            999 V2000
   -0.2899    0.3885    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7083   -0.3198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5511   -1.7453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2056    1.8081    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  1  0  0  0  0
  4  5  1  0  0  0  0
  3  6  4  0  0  0  0
  2  7  4  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
 10 11  4  0  0  0  0
  7 11  4  0  0  0  0
  8 12  4  0  0  0  0
  8 13  4  0  0  0  0
  1 14  4  0  0  0  0
 15 16  4  0  0  0  0
 13 16  4  0  0  0  0
 12 17  4  0  0  0  0
 15 18  1  0  0  0  0
 19 20  4  0  0  0  0
 14 20  4  0  0  0  0
  6 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
  3 19  4  0  0  0  0
  6 10  4  0  0  0  0
 15 17  4  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI10944

>  <IDNUMBER>
BAS 00226816

>  <Activity>
0
$$$$
ASI18075
  Marvin  04201015132D          

 19 20  0  0  0  0            999 V2000
   -1.3130   -0.4165    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5931    0.0046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7924    0.8286    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1177   -0.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3130   -1.2406    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6118    0.8965    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2852    1.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5116    1.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8376   -0.0136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0549    1.0233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8519    1.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8467   -2.4721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0737    2.0013    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
  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 10  4  0  0  0  0
  3  9  1  0  0  0  0
  5 10  4  0  0  0  0
  9 11  1  0  0  0  0
  4 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
  8 15  1  0  0  0  0
 10 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
  3  7  4  0  0  0  0
  4  8  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18075

>  <IDNUMBER>
BAS 00311844

>  <Activity>
0
$$$$
ASI16319
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
   -2.0801   -0.4048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9000    0.9869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2450   -0.4048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7351   -0.3644    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.2602   -0.4048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7199    0.9869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8199   -1.1336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4200   -0.4048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.9700    0.3340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  4  0  0  0  0
  3  5  1  0  0  0  0
  4 13  1  0  0  0  0
  4  5  2  0  0  0  0
  6 14  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2 10  4  0  0  0  0
  7 11  4  0  0  0  0
  7 12  4  0  0  0  0
 13 18  4  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
  2 16  1  0  0  0  0
 11 17  4  0  0  0  0
 12 18  4  0  0  0  0
  6 19  1  0  0  0  0
  3 20  4  0  0  0  0
 20 21  4  0  0  0  0
 21 22  4  0  0  0  0
 10 23  1  0  0  0  0
 19 24  1  0  0  0  0
  6 15  1  0  0  0  0
 13 17  4  0  0  0  0
 10 22  4  0  0  0  0
M  CHG  1   6   1
M  END
>  <NAME>
ASI16319

>  <IDNUMBER>
BAS 00289776

>  <Activity>
0
$$$$
ASI7037
  Marvin  04201015132D          

 26 28  0  0  0  0            999 V2000
   -0.9638    0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9638   -0.4473    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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  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
 13 22  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  4  0  0  0  0
  6 16  4  0  0  0  0
 17 18  1  0  0  0  0
 18 21  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 12 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  4  0  0  0  0
 16 26  4  0  0  0  0
  5  6  4  0  0  0  0
 25 26  4  0  0  0  0
 13 23  1  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI7037

>  <IDNUMBER>
BAS 00141390

>  <Activity>
0
$$$$
ASI19881
  Marvin  04201015132D          

 20 22  0  0  0  0            999 V2000
    0.3348   -0.0502    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3180    0.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7198    1.8523    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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  3  4  4  0  0  0  0
  1  5  1  0  0  0  0
  2  6  4  0  0  0  0
  3  7  4  0  0  0  0
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  4  9  4  0  0  0  0
 10 11  4  0  0  0  0
  6 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
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 10 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 18  1  0  0  0  0
  4 10  4  0  0  0  0
  8  9  4  0  0  0  0
M  CHG  1  14   1
M  END
>  <NAME>
ASI19881

>  <IDNUMBER>
BAS 00319002

>  <Activity>
0
$$$$
ASI11397
  Marvin  04201015132D          

 25 28  0  0  0  0            999 V2000
    1.4061    0.0519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4061   -0.7679    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
  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
  8  9  1  0  0  0  0
  7  9  4  0  0  0  0
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
  6 12  4  0  0  0  0
  2 13  1  0  0  0  0
 12 14  4  0  0  0  0
 15 21  1  0  0  0  0
  3 16  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 18 23  1  0  0  0  0
 17 24  1  0  0  0  0
 23 25  1  0  0  0  0
  4  6  4  0  0  0  0
 15 22  1  0  0  0  0
  9 14  4  0  0  0  0
 24 25  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <NAME>
ASI11397

>  <IDNUMBER>
BAS 00231792

>  <Activity>
0
$$$$
ASI17975
  Marvin  04201015132D          

 23 24  0  0  0  0            999 V2000
   -0.2846    0.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7905    0.8642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5587    1.6495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2819   -0.6535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2819    1.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2687   -1.9867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7812   -0.5428    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
  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 21  1  0  0  0  0
  3 14  1  0  0  0  0
 13 15  2  0  0  0  0
  7 16  1  0  0  0  0
 17 18  1  0  0  0  0
  9 18  1  0  0  0  0
  8 19  1  0  0  0  0
 14 20  1  0  0  0  0
 17 21  1  0  0  0  0
 16 22  1  0  0  0  0
 22 23  1  0  0  0  0
  3  4  4  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1  17   1
M  END
>  <NAME>
ASI17975

>  <IDNUMBER>
BAS 00311420

>  <Activity>
0
$$$$
ASI22256
  Marvin  04201015132D          

 19 20  0  0  1  0            999 V2000
   -0.5191    0.4096    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9216   -1.2642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2154   -0.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1017   -2.0693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2253    1.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2154   -0.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5085   -1.2642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9174    2.9062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4837    2.8850    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2494   -1.4054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2253   -0.0070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9322   -0.4731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9598    0.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  9  1  0  0  0  0
  2  4  1  0  0  0  0
  5  8  4  0  0  0  0
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  1  8  4  0  0  0  0
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  3 10  2  0  0  0  0
  2 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  6 14  1  0  0  0  0
 11 15  1  0  0  0  0
  1 16  4  0  0  0  0
 17 19  4  0  0  0  0
  2 18  1  0  0  0  0
 16 19  4  0  0  0  0
  5 17  4  0  0  0  0
  7 15  1  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI22256

>  <IDNUMBER>
BAS 00333767

>  <Activity>
0
$$$$
ASI24488
  Marvin  04201015132D          

 30 33  0  0  0  0            999 V2000
   -0.5680   -1.4751    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5680   -0.1657    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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  7 10  1  0  0  0  0
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  3 13  2  0  0  0  0
  9 14  1  0  0  0  0
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 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
 17 22  4  0  0  0  0
 18 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
 10 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 25 30  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>
ASI24488

>  <IDNUMBER>
BAS 00345627

>  <Activity>
0
$$$$
ASI11589
  Marvin  04201015132D          

 23 25  0  0  1  0            999 V2000
   -0.4762    0.2414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8871   -0.4740    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
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  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  8 15  1  0  0  0  0
  6  9  1  0  0  0  0
  4 10  1  0  0  0  0
 11 12  1  0  0  0  0
  1 12  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  7 17  4  0  0  0  0
  7 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
 17 22  4  0  0  0  0
 22 23  4  0  0  0  0
  4  5  1  0  0  0  0
 21 23  4  0  0  0  0
  8 16  1  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI11589

>  <IDNUMBER>
BAS 00232983

>  <Activity>
0
$$$$
ASI27126
  Marvin  04201015132D          

 24 26  0  0  0  0            999 V2000
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   -1.5610   -1.3948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4574    1.5135    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.0182    0.2730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8725   -2.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0182    1.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7304    1.5135    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
  4  5  4  0  0  0  0
  3  5  1  0  0  0  0
  6  7  3  0  0  0  0
  4  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  4  0  0  0  0
  5 10  4  0  0  0  0
  8 11  4  0  0  0  0
  8 12  4  0  0  0  0
 13 17  4  0  0  0  0
  2 14  1  0  0  0  0
  1 15  1  0  0  0  0
 16 19  4  0  0  0  0
 10 17  4  0  0  0  0
 11 18  4  0  0  0  0
 12 19  4  0  0  0  0
 13 20  1  0  0  0  0
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 14 22  1  0  0  0  0
 16 18  4  0  0  0  0
  9 13  4  0  0  0  0
M  CHG  1   3   1
M  END
>  <NAME>
ASI27126

>  <IDNUMBER>
BAS 00371623

>  <Activity>
0
$$$$
ASI24691
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -0.3751   -0.0250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3438   -0.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3751    0.7970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0533    0.7970    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0533   -0.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3438    1.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1033   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3438   -1.2533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1033    1.2315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7690    1.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8159   -0.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4785    0.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5129   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2005    1.1877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4973   -0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5129   -1.2752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2349   -0.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2005   -0.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9287    0.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2223   -1.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9537   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9131   -0.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9537   -1.2752    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
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  2  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  4  0  0  0  0
 12 15  4  0  0  0  0
 13 16  4  0  0  0  0
 13 17  4  0  0  0  0
 15 18  4  0  0  0  0
 14 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  1  0  0  0  0
 20 23  4  0  0  0  0
 19 22  4  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI24691

>  <IDNUMBER>
BAS 00347765

>  <Activity>
0
$$$$
ASI518
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.3099    0.9054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4078   -0.3099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3099   -0.7260    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4078    0.5057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0195   -0.3099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0195    0.5057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1339   -0.7260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3099    1.7212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7457   -0.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8516   -0.2855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1174   -1.5662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0195    2.1373    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.4389   -0.2774    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1094    0.9381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5612   -0.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8761   -1.9740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6021   -1.5499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0195    2.9038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7048    1.7212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1650   -0.6770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4144    0.5302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3363   -1.9577    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
  5  6  4  0  0  0  0
  1  6  4  0  0  0  0
  2  7  1  0  0  0  0
  1  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  4  0  0  0  0
  7 11  4  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
  4 14  1  0  0  0  0
 10 15  4  0  0  0  0
 11 16  4  0  0  0  0
 15 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
 17 22  1  0  0  0  0
  2  3  4  0  0  0  0
 16 17  4  0  0  0  0
M  CHG  2  12   1  13   1
M  END
>  <NAME>
ASI518

>  <IDNUMBER>
BAS 00018442

>  <Activity>
0
$$$$
ASI7031
  Marvin  04201015132D          

 22 23  0  0  0  0            999 V2000
   -0.6962    0.0838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4008    0.4990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6962   -0.7423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4008   -1.1491    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1137    0.0838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1137   -0.7423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0377    0.5116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0168   -1.1743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5983    0.1258    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0503    1.3336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3840    1.3210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7549    0.0964    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8308    0.4990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1724    0.1090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8895    0.5284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8308   -1.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3280   -0.2894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0135    0.8513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1915   -0.5956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4594    0.5116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5354    0.0838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5354   -0.7423    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
 14 20  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
 12 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>
ASI7031

>  <IDNUMBER>
BAS 00141381

>  <Activity>
0
$$$$
ASI21282
  Marvin  04201015132D          

 21 22  0  0  0  0            999 V2000
    0.0000    0.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7172    0.4551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4316    0.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7282    1.2910    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7282    0.4662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1433    0.4551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4316   -0.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8633    0.0442    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7172   -1.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7282    2.9240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7282   -1.2137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0111    1.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4261    1.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4261    2.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1433    1.2910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7282   -2.0357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4261   -2.4467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4261   -3.2660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433   -3.6743    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
 11 15  1  0  0  0  0
  6 12  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
 14 15  1  0  0  0  0
 13 16  1  0  0  0  0
  7 17  1  0  0  0  0
 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  8 10  4  0  0  0  0
 11 16  1  0  0  0  0
M  CHG  1   4   1
M  END
>  <NAME>
ASI21282

>  <IDNUMBER>
BAS 00327894

>  <Activity>
0
$$$$
ASI644
  Marvin  04201015132D          

 24 27  0  0  1  0            999 V2000
   -0.5887   -0.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2249   -0.3598    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8462    0.6010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2632   -0.6664    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6761    0.6091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5028   -1.1447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9336   -0.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7768    0.2453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5070    1.0302    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.2821    1.2101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0327   -1.7661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3123   -1.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3123    3.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0466    1.6638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2403    1.2223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7472   -0.3434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0293    1.0425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2991    0.2657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6614   -0.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9353   -1.6189    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
  2  6  1  0  0  0  0
  4  7  4  0  0  0  0
  2  8  1  0  0  0  0
  8  9  1  0  0  0  0
  3 10  1  0  0  0  0
  6 11  2  0  0  0  0
  6 12  1  0  0  0  0
 13 15  1  0  0  0  0
 13 14  2  0  0  0  0
  9 15  1  0  0  0  0
  5 16  1  0  0  0  0
  7 17  1  0  0  0  0
 12 18  4  0  0  0  0
 12 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
 18 23  4  0  0  0  0
 22 24  4  0  0  0  0
  5  7  4  0  0  0  0
  9 10  1  0  0  0  0
 20 21  1  0  0  0  0
 23 24  4  0  0  0  0
M  CHG  1   9   1
M  END
>  <NAME>
ASI644

>  <IDNUMBER>
BAS 00024552

>  <Activity>
0
$$$$
ASI15366
  Marvin  04201015132D          

 23 25  0  0  0  0            999 V2000
   -1.4621   -0.0985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1925    0.6870    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1244   -0.0985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3733    0.6870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7570   -0.5885    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2528   -0.3604    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6533   -0.3396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1115    1.4051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4499    1.3092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2444    0.1996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6695    1.5555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6443    0.4978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4265   -1.1795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0669    1.8692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0759    0.9826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0247   -0.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8932    2.6754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8576    1.6203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8043   -1.7266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2172   -1.4284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3832   -2.2658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9677   -2.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7506   -2.8128    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
  4  8  2  0  0  0  0
  9 11  4  0  0  0  0
  7 10  1  0  0  0  0
 11 15  4  0  0  0  0
 12 16  4  0  0  0  0
  6 13  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  4  0  0  0  0
 10 16  4  0  0  0  0
 14 17  1  0  0  0  0
 14 18  1  0  0  0  0
 13 19  4  0  0  0  0
 13 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>
ASI15366

>  <IDNUMBER>
BAS 00285505

>  <Activity>
0
$$$$
ASI24487
  Marvin  04201015132D          

 28 31  0  0  0  0            999 V2000
   -0.3655   -1.3048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3655    0.0040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1061   -0.6603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1594   -0.2358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1594   -1.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0943    0.8253    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0943   -2.0712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6721    1.4384    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3930    2.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6956   -2.2127    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8747   -1.4856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8747    0.1886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9275   -0.6603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9315    2.8337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4087    2.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3227   -2.4524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5821   -0.2358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5821   -1.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3171    0.1415    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.1987   -1.5996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0218   -2.9712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0280   -1.7214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8118   -3.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9550    1.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6721    3.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4738    3.3053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7764    1.9376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9926    2.6882    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  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
  4 12  4  0  0  0  0
  3 13  2  0  0  0  0
  9 14  2  0  0  0  0
  9 15  1  0  0  0  0
 16 22  1  0  0  0  0
 17 18  4  0  0  0  0
 11 18  4  0  0  0  0
 17 19  1  0  0  0  0
 10 20  1  0  0  0  0
 10 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 15 24  4  0  0  0  0
 15 25  4  0  0  0  0
 25 26  4  0  0  0  0
 24 27  4  0  0  0  0
 27 28  4  0  0  0  0
  2  4  1  0  0  0  0
 16 23  1  0  0  0  0
 12 17  4  0  0  0  0
 26 28  4  0  0  0  0
M  CHG  1  10   1
M  END
>  <NAME>
ASI24487

>  <IDNUMBER>
BAS 00345626

>  <Activity>
0
$$$$
ASI18345
  Marvin  04201015132D          

 15 16  0  0  0  0            999 V2000
    0.8039   -0.6871    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0943   -0.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5180   -0.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0943    0.5479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6198   -0.6871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6198    0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5180    0.5479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8039    0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8039   -1.5136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2231   -0.6737    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3384    0.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3384   -0.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0525    0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0525    1.7920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1078   -1.9267    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
  4  6  4  0  0  0  0
  3  7  4  0  0  0  0
  7  8  4  0  0  0  0
  1  9  1  0  0  0  0
  3 10  1  0  0  0  0
 11 12  4  0  0  0  0
  5 12  4  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
  9 15  1  0  0  0  0
  4  8  4  0  0  0  0
  6 11  4  0  0  0  0
M  CHG  1   1   1
M  END
>  <NAME>
ASI18345

>  <IDNUMBER>
BAS 00313033

>  <Activity>
0
$$$$
