NCI:300621
BBtclserve11129918502D 0   0.00000     0.00000167713
57631-20-6
 18 19  0  0  0  0  0  0  0  0  1 V2000
    6.4302    0.1481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4791    0.4571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6701   -0.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1701    1.4081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8611    0.4571    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.6701   -1.1307    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7579    2.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1701    1.4081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8041   -1.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5361   -1.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3511    3.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823    2.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8040   -2.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5361   -2.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878    2.1126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6701   -3.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.9217    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1810    1.1991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  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
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  2  0  0  0  0
 15 18  1  0  0  0  0
  5  8  1  0  0  0  0
 14 16  1  0  0  0  0
M  END