APOLLO-ZINC00161939
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 20  0  0  0  0  0  0  0  0999 V2000
   -0.0030    1.3520    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560   -0.0440   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3150   -0.6780   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5080    0.0540   -0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4310    1.4700   -0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1740    2.0980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0980    3.5640    0.0090 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0280    4.0840    0.0220 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1610    4.2010    0.0030 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6500   -0.8190   -0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2960   -2.1490   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6170   -2.3760   -0.0280 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -3.2420   -0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5030   -2.9260   -0.0660 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9810    1.8290    0.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8570   -0.6330    0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3530    2.0460   -0.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6800   -0.4800   -0.0450 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8280   -4.4360   -0.0590 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 19  2  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  14  -1
M  END