ACROSORGANICS-ZINC00057130
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  1  0  0  0  0  0999 V2000
   -0.0220    1.3770   -0.0740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0440   -0.0200   -0.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1510   -0.7250    0.0730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660   -0.0490    0.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3830    1.3480    0.1300 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1900    2.0790    0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1850    3.5880   -0.0260 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3160    3.9880    0.5080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1930    4.1270   -1.4780 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2380    4.8200   -1.7130 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3570    4.1280    0.6300 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1250   -2.6160    0.1100 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9570    1.9230   -0.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9950   -0.5400   -0.1250 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3030   -0.5910    0.2470 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3360    1.8690    0.1930 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7550    4.6690   -0.1060 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1940    3.8740   -2.2020 O   0  5  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 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  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  9  1  0  0  0  0
  7 11  1  0  0  0  0
  9 10  2  0  0  0  0
  9 18  1  0  0  0  0
 11 17  1  0  0  0  0
M  CHG  1  18  -1
M  END