NCID-ZINC01692553
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
    0.0290    1.4070    0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0230    0.0410    0.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1330   -0.6640   -0.2150 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3580    0.0040   -0.2730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4040    1.3840   -0.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400    2.0770    0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3000    3.9450    0.4910 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.5990   -0.7450   -0.5560 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6800   -1.4310   -1.5550 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0750   -2.1260   -0.4380 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0020   -2.6900   -0.5080 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1050   -2.7660   -0.5510 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8790    1.9550    0.4620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9700   -0.4750    0.0950 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3480    1.9060   -0.1040 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6420   -0.6670    0.2940 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4320   -1.1750    0.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  2  0  0  0  0
  3 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  5  6  2  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END