NCID-ZINC04823073
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
   -0.0010    1.3440    0.7780 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0040   -0.0970    0.5160 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1980   -0.7650    0.2660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4070   -0.0920    0.3850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5920   -0.7550    0.1360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5770   -2.0890   -0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3740   -2.7620   -0.3500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1850   -2.1030   -0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1020   -2.8220   -0.2420 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0740   -2.2510   -0.7010 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1880   -3.9860    0.1070 O   0  5  0  0  0  0  0  0  0  0  0  0
   -5.2020   -2.9940   -0.5690 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.0200    1.6860    0.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4200    1.8690   -0.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6060    1.5510    1.6610 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8400   -0.5870    0.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4200    0.9490    0.6720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5330   -0.2320    0.2290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3650   -3.8040   -0.6370 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  2  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END