NCI:692600
BBtclserve11129920262D 0   0.00000     0.00000245644
999-99-9
 16 17  0  0  0  0  0  0  0  0  2 V2000
    4.2058   -0.4716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3968   -1.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7058   -2.0104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7058   -2.0104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0148   -1.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090   -0.2503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.3374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090    1.2885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3090    1.2885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6180    0.3374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6913    1.0111    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.5385    0.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7280    2.0104    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.7936    0.3374    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.7881    0.2329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3869    1.2510    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  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
  1 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
  1 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
  4  5  1  0  0  0  0
  9 10  1  0  0  0  0
  6 10  1  0  0  0  0
M  CHG  4  11   1  13  -1  14   1  16  -1
M  END