ACROSORGANICS-ZINC00085314
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0120    1.3770    0.2250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0250    0.0010   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1530   -0.7260   -0.2760 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3590   -0.0130   -0.2580 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100    1.3650    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2280    2.0780    0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2630    3.5640    0.5360 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4020    4.1270    0.5210 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6190   -0.6570   -0.5840 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.4610   -0.7430    0.3230 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8010   -0.9670   -1.7720 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0780   -2.2090   -0.5050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0820   -2.8940   -0.1440 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9200    1.9080    0.4100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9860   -0.5110   -0.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3630    1.8940    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1520    4.1380    0.7660 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0060   -2.6600   -1.0140 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 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  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  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  2  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 18  2  0  0  0  0
M  CHG  1   8  -1
M  CHG  1   9   1
M  CHG  1  11  -1
M  CHG  1  13  -1
M  END