ACROSORGANICS-ZINC00054929
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0370    1.5560   -0.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0750    0.1620   -0.2490 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1020   -0.5980   -0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3310    0.0630   -0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3620    1.4620    0.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1820    2.2130   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6460    2.1520    0.2060 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.6810    1.4750    0.1390 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6230    3.3790    0.3910 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0890   -2.0610   -0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1350   -2.8400    0.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1490   -4.3640    0.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1040   -4.8700   -0.5460 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9610    2.1260   -0.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0370   -0.3280   -0.3850 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2490   -0.5200    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1910    3.2980    0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9210   -2.5160   -0.8210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6940   -2.4210    0.8060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8280   -4.9310    0.6760 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 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 17  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 19  1  0  0  0  0
 12 13  1  0  0  0  0
 12 20  2  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  13  -1
M  END