NCID-ZINC01601513
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.1330    1.3130   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0880   -0.1120   -0.0940 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7300   -0.5950   -1.0630 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4010    0.0720   -1.8380 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7110   -2.0630   -1.0660 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4910   -2.7430   -1.9960 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4850   -4.1340   -2.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6970   -4.8570   -1.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0810   -4.1840   -0.1720 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0630   -2.7930   -0.1680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8140   -4.7800    0.6800 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7090   -6.3360   -1.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1240   -6.8830   -1.9230 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.8580    1.7150    0.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5130    1.7350   -0.9520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8170    1.5870    0.7910 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1080   -2.2030   -2.7110 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0930   -4.6720   -2.7380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7040   -2.3730    0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6090   -6.9090   -0.4520 O   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  1  0  0  0  0
  3  4  2  0  0  0  0
  3  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 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 19  1  0  0  0  0
 12 13  1  0  0  0  0
 12 20  2  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  CHG  1  13  -1
M  END