NCI:59236
BBtclserve11129917082D 0   0.00000     0.00000 49398
7460-51-7
 18 19  0  0  0  0  0  0  0  0  2 V2000
    4.5981    0.8840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.8840    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8660    0.8840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.6160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0981    2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5981    1.8840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    3.6160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0981    2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -2.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5981    3.6160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.6160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.6160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -3.6160    0.0000 O   0  0  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
  3  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  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
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 17 18  1  0  0  0  0
 12 15  1  0  0  0  0
 14 17  1  0  0  0  0
M  CHG  1   3   1
M  END