NCID-ZINC01575458
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
    0.1270    1.3420   -0.2950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2650    0.0090    0.3120 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.2840    0.0420    0.7080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7110   -0.4700    1.3740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8600   -0.0470    1.4690 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1820   -1.4220    2.2150 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8990   -2.0460    3.3410 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.3130   -1.2400    3.9580 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0270   -2.9620    2.8690 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5870   -3.8300    1.8230 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9760   -3.2980    1.2800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0690   -2.8770    4.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2430   -2.9670    3.7430 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2490   -1.3580   -1.0880 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.1210    1.3090   -0.7540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5860    1.6490   -1.0690 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1460    2.1230    0.4730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7830   -1.7550    2.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8530   -2.3680    2.4620 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4350   -3.5790    3.6750 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4060   -3.3180    5.3060 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 21  1  0  0  0  0
M  CHG  1  21  -1
M  END