CHEMBLOCK-ZINC01438795
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0220    1.8100    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8450   -0.4970    1.0350 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3090   -0.5200   -0.1820 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8470   -0.4240   -1.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2210   -0.5780   -1.4810 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8840   -0.9080   -2.6480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1730   -1.0840   -3.8210 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7990   -0.9310   -3.8260 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1360   -0.6050   -2.6570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0380   -1.1190   -5.0810 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6220   -1.4080   -6.1100 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1730   -0.9840   -5.0850 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0000    2.1870    0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500    2.1710   -0.8710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5330    2.1610    0.9090 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7760   -0.4400   -0.5650 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9570   -1.0270   -2.6450 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6900   -1.3400   -4.7330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9380   -0.4890   -2.6600 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  2  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  2  0  0  0  0
  8 19  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 20  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END