NCI:333344
BBtclserve11129919062D 0   0.00000     0.00000176493
999-99-9
 19 19  0  0  0  0  0  0  0  0  2 V2000
    3.3522    1.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7589    0.1509    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9400    1.8734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1711   -0.6581    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6310    2.8245    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9400    1.8734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5779   -1.5717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6799    3.1335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4400    3.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2490    2.8245    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9901   -2.3807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4400    4.4123    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.3968   -3.2942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3060    4.9123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5740    4.9123    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8090   -4.1033    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2212   -4.9123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.5155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6180   -4.6911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
  9 10  2  0  0  0  0
M  CHG  2  12   1  15  -1
M  END