ACROSORGANICS-ZINC00168194
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 18  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3610    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
    1.2270   -0.6790   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4280    0.0560   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3780    1.4480   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690    2.0850    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6310    2.2360   -0.0200 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.5860    3.4530   -0.0130 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7080    1.6660   -0.0330 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4500   -0.8570   -0.0360 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3960   -0.6420   -0.0430 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9110   -2.1470   -0.0370 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6090   -2.0880   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4270   -3.5640   -0.0210 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620    1.8830    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9240   -0.5600    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1350    3.1640    0.0080 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 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  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  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  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END