IFLAB-ZINC03881108
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.4950    1.4550    0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2250   -0.0270    0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1280   -0.7280    1.1950 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3680   -2.1000    1.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2650   -2.7250   -0.0480 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0660   -2.0920   -1.1570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3260   -0.7320   -1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8060    0.1550   -2.7520 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.2450   -0.0260    2.4900 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1410    1.1830    2.5370 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4480    1.9980    0.0150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1320    1.7340   -0.7600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9960    1.7060    1.0140 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6420   -2.6530    1.9920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1400   -2.6440   -2.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4670   -0.7280    3.6180 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5360   -0.2250    4.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
M  END