NCI:177958
BBtclserve11129918112D 0   0.00000     0.00000130593
57412-02-9
 20 22  0  0  0  0  0  0  0  0  2 V2000
    5.5441    2.9096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1373    3.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9563    2.1006    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2653    1.1495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    2.1005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4563    0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1789    0.7428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6473    1.1495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2872    2.8437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5608   -0.4328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2834   -0.2518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691    0.9416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090    2.6358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4744   -0.8395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.6847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5789   -1.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925   -2.2408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5970   -3.2353    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.5105   -3.6421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7880   -3.8231    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
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  2  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
  6  8  1  0  0  0  0
 11 14  1  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  2  18   1  20  -1
M  END