A1COR
  CCTOOLS-0522260957

 19 20  0  0  0  0  0  0  0  0999 V2000
   -0.9250    0.3640    0.0290 C   0  0  0  0  0
   -4.9920   -0.7160   -0.0090 C   0  0  0  0  0
   -3.5330   -0.3510   -0.1040 C   0  0  0  0  0
   -1.3190   -0.9940    0.0910 C   0  0  0  0  0
   -0.3440   -1.9880    0.1060 C   0  0  0  0  0
    0.9880   -1.6340    0.0650 C   0  0  0  0  0
    1.3710   -0.3000    0.0100 C   0  0  0  0  0
    0.4210    0.7020   -0.0130 C   0  0  0  0  0
   -2.0060    1.3650    0.0060 C   0  0  0  0  0
   -2.6490   -1.2710    0.1400 N   0  0  0  0  0
   -1.8330    2.5180    0.3520 O   0  0  0  0  0
   -3.2100    0.9100   -0.4300 O   0  0  0  0  0
    3.2070    0.1470   -0.0390 BR  0  0  0  0  0
   -5.6010    0.1590   -0.2360 H   0  0  0  0  0
   -5.2150   -1.5080   -0.7240 H   0  0  0  0  0
   -5.2150   -1.0630    0.9990 H   0  0  0  0  0
   -0.6280   -3.0290    0.1490 H   0  0  0  0  0
    1.7450   -2.4050    0.0770 H   0  0  0  0  0
    0.7220    1.7380   -0.0600 H   0  0  0  0  0
  1  9  1  0  0  0
  1  8  2  0  0  0
  2  3  1  0  0  0
  2 14  1  0  0  0
  2 15  1  0  0  0
  2 16  1  0  0  0
  3 12  1  0  0  0
  4  1  1  0  0  0
  5  4  2  0  0  0
  5  6  1  0  0  0
  5 17  1  0  0  0
  6  7  2  0  0  0
  6 18  1  0  0  0
  7  8  1  0  0  0
  7 13  1  0  0  0
  8 19  1  0  0  0
  9 11  2  0  0  0
 10  3  2  0  0  0
 10  4  1  0  0  0
 12  9  1  0  0  0
M  END
$$$$
