NCI:667510
BBtclserve11129920112D 0   0.00000     0.00000234163
999-99-9
 20 21  0  0  0  0  0  0  0  0  2 V2000
    4.8147    2.2399    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147    1.3739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6456    0.6308    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    1.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8366    2.0320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2215    3.1535    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2160    3.2580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3093    1.2694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0935    2.7012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.4625    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.9625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.9625    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.6337    3.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  8  2  0  0  0  0
  5  9  2  0  0  0  0
  4 10  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 11 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
  6 20  1  0  0  0  0
  4  5  1  0  0  0  0
 11 12  2  0  0  0  0
 15 16  2  0  0  0  0
M  CHG  2  17   1  19  -1
M  END