PUBCHEM-ZINC05973860
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 20  0  0  1  0  0  0  0  0999 V2000
   -0.0160    1.3400    0.0090 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
    1.2820   -0.4080   -0.0090 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0750    0.6440   -0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2910    1.7540   -0.0010 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1680    2.9370   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5320    2.3310   -0.4230 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.6750    2.3880   -1.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3970    0.9630    0.0050 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6780    3.0260    0.3150 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3960    2.3380   -0.3480 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1860   -0.8880    0.0070 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3040   -0.4050    0.0180 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0450   -2.0970   -0.0010 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8920    1.9720    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8290    3.6610   -0.7570 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2240    3.3900    0.9730 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6240    4.1010    0.1390 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5950    2.8290    1.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  5  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  END