IFLAB-ZINC02454586
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0230   -0.6870    1.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0410   -2.0810    1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0370   -2.6760   -0.0210 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0170   -1.9790   -1.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0060   -0.6610   -1.1730 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0330    0.0020   -2.4770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0370   -0.9920   -3.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0100   -2.6120   -2.8150 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0620   -2.8050    2.3060 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250   -0.1570    2.1350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280    0.6200   -2.5400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8430    0.6440   -2.5660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9430   -0.8840   -4.2330 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8490   -0.8600   -4.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8150   -3.0270    2.6470 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 15  1  0  0  0  0
  4  5  1  0  0  0  0
  4 11  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
 11 20  1  0  0  0  0
M  CHG  1   7   1
M  END