NCI:400610
BBtclserve11129919222D 0   0.00000     0.00000191154
7505-66-0
 17 18  0  0  0  0  0  0  0  0  2 V2000
    3.7321    0.4806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.9806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.9806    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.9806    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7891    2.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4071    2.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -2.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8380    2.2594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0981    3.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0981    3.5194    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -2.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -3.5194    0.0000 I   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
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  2  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 10 15  1  0  0  0  0
 11 16  2  0  0  0  0
 16 17  1  0  0  0  0
 14 15  1  0  0  0  0
 12 16  1  0  0  0  0
M  CHG  1   5   1
M  END