NCI:328025
BBtclserve11129919052D 0   0.00000     0.00000175042
999-99-9
 16 16  0  0  0  0  0  0  0  0  2 V2000
    2.7431    0.7565    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000    0.0873    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.5352    1.7346    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942    0.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    1.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0032   -0.5036    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    2.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122    0.4474    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0032   -0.5036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    3.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5032    2.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5032    2.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5910   -1.3126    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1843   -2.2262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7720   -3.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1897   -2.3307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
  8  9  2  0  0  0  0
M  CHG  2   1   1   2  -1
M  END