NCI:661442
BBtclserve11129920082D 0   0.00000     0.00000231559
999-99-9
 16 16  0  0  0  0  0  0  0  0  2 V2000
    2.0000    0.5502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.9498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.5502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.0502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -0.7588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2709    0.0502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831    0.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9921    1.8103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2709    0.0502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7709   -0.8158    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.6844   -1.2225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7928   -1.0237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4400   -0.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6664   -1.8103    0.0000 I   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  1  6  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  2  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
  5  6  1  0  0  0  0
  8  9  1  0  0  0  0
M  CHG  2  12   1  16  -1
M  END