NCID-ZINC01569857
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0310    1.3840   -0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0130   -0.0060   -0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2410   -0.6440   -0.2700 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4460    0.0750   -0.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3930    1.4690   -0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1570    2.1300   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1520    3.6160    0.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2230    4.1920    0.2960 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1830    4.3220    0.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0620    6.2520    0.0220 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.7410   -0.6800   -0.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5860   -1.9480   -0.4690 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2640   -2.0140   -0.3970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0080    1.8490    0.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9030   -0.5900   -0.1890 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3250    2.0330   -0.0920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7140    4.0740   -0.8640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7820    4.1050    0.9450 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2530   -2.2520   -0.4520 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8280   -0.0340   -0.3410 O   0  0  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 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 11  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  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 11 12  1  0  0  0  0
 11 20  2  0  0  0  0
 13 19  1  0  0  0  0
M  CHG  1  12  -1
M  END