NCI:655041
BBtclserve11129920062D 0   0.00000     0.00000228360
999-99-9
 20 21  0  0  0  0  0  0  0  0  1 V2000
    4.7026    3.0173    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6808    3.2252    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1808    2.3592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5116    1.6160    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.0228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1753    2.2547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    1.5228    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.5228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7631    3.0637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7576    2.9591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3563    3.9772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.0228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.9772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.4772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.9772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.0228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.4772    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.9772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.9772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.4772    0.0000 C   0  0  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
  1  5  2  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
  8 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
  8 16  2  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
  4  5  1  0  0  0  0
 15 16  1  0  0  0  0
M  END