ACROSORGANICS-ZINC00331012
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
    0.4850    1.4570    0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2400   -0.0250    0.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0060   -0.7770    1.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2180   -2.1390    1.1150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1990   -2.6960   -0.1540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0420   -1.8810   -1.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2460   -0.5880   -1.0860 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0660   -2.4760   -2.6280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4320   -4.1460   -0.3400 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0560   -4.5430   -1.3080 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -4.9420    0.4740 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5520    1.6400    0.3540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1310    1.9610   -0.6680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0520    1.8420    1.0990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0020   -0.3100    2.2150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4040   -2.7520    1.9850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9510   -2.5380   -3.0150 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6660   -1.8450   -3.2840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5010   -3.4750   -2.5870 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 16  1  0  0  0  0
  5  6  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END