NCI:321271
BBtclserve11129919042D 0   0.00000     0.00000173584
80348-54-5
 18 19  0  0  0  0  0  0  0  0  2 V2000
    4.5032    0.2306    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.5032    0.2306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5032    0.2306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    1.2306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032   -0.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942    1.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122    1.8184    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372   -1.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3692   -1.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7431    1.5094    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.0032    2.7694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633    1.5093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0032    2.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372   -2.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3692   -2.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.1785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5352    0.5312    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.5032   -2.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  2  0  0  0  0
 10 16  2  0  0  0  0
 10 17  1  0  0  0  0
 14 18  2  0  0  0  0
 11 13  2  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  2  10   1  17  -1
M  END