NCI:12361
BBtclserve11129916442D 0   0.00000     0.00000 12035
999-99-9
 20 22  0  0  0  0  0  0  0  0  2 V2000
    5.5441    1.4200    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.1373    2.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9563    0.6110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7251    3.1426    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1428    2.4381    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2653   -0.3401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    0.6110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4563   -0.9279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1789   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6473   -0.3401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2872    1.3541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5608   -1.9224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2834   -1.7413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691   -0.5480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090    1.1462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4744   -2.3291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1969   -2.1481    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3015   -3.1426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0060   -1.5603    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
  8 10  1  0  0  0  0
 13 16  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  2  17   1  20  -1
M  END