NCI:112793
BBtclserve11129917302D 0   0.00000     0.00000 86187
999-99-9
 16 17  0  0  0  0  0  0  0  0  2 V2000
    2.8660    1.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    1.8988    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8660    0.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6456    1.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8366    2.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8535    0.5139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147    2.2352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8147    3.1012    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.6012    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.1012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.1012    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
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
  9 10  1  0  0  0  0
 12 13  1  0  0  0  0
M  CHG  3   2   1  14   1  16  -1
M  END