NCI:201699
BBtclserve11129918172D 0   0.00000     0.00000135885
999-99-9
 19 21  0  0  0  0  0  0  0  0  2 V2000
    6.9879    1.1196    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.9014    0.7129    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.8833    2.1142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1789    0.5318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2653    0.9386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2834   -0.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4563    0.3508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9563    1.8896    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.4744   -1.0505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6473    0.9386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5608   -0.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    1.8896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5789   -2.0450    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6691    0.7307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2872    2.6328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925   -2.4517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7699   -2.6328    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0000    1.4738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  2  0  0  0  0
 12 15  2  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 18 19  2  0  0  0  0
M  CHG  4   1   1   2  -1  13   1  17  -1
M  END