ACROSORGANICS-ZINC01687636
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3770    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2120   -0.6810   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4050    0.0270   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3880    1.4080   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1760    2.0870    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1580    3.4860    0.0100 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3120    3.9600    0.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9920    3.9820    0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6950   -0.6970   -0.0350 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.7420   -0.0750   -0.0410 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7100   -1.9150   -0.0410 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9590    1.9040    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5570    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3160    1.9600   -0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2300   -2.0410   -0.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2260   -2.4300   -0.9050 H   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 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  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 15  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END