ACROSORGANICS-ZINC01598621
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.4250    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -0.6070   -1.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1680    0.1600   -2.0650 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810   -0.4550   -3.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8350   -1.8350   -3.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2750   -2.6030   -2.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6660   -1.9920   -1.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0910   -3.0420    0.2530 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    0.3640   -4.2170 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3330    1.5800   -4.1560 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9210   -0.1780   -5.1640 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8020    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.7860   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7760    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1260    1.2380   -2.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3150   -2.3140   -4.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3180   -3.6800   -2.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  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 10  1  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  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END