NCI:280598
BBtclserve11129918422D 0   0.00000     0.00000160908
999-99-9
 20 22  0  0  0  0  0  0  0  0  2 V2000
    4.4487    0.3091    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.4487   -0.6909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5827    0.8091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147   -1.1909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5827   -1.1909    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4781    1.8037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691    0.4024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147   -2.1909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2658   -0.8818    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5827   -2.1909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2213    2.4728    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5000    2.0116    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4612   -0.5758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2658   -2.4999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4487   -2.6909    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8536   -1.6909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0134    3.4509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1723    2.1638    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.5748   -3.4509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  2  0  0  0  0
  9 17  2  0  0  0  0
 11 18  2  0  0  0  0
 11 19  1  0  0  0  0
 15 20  1  0  0  0  0
 12 14  2  0  0  0  0
 10 16  1  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  2  11   1  19  -1
M  END