A1J4B
  CCTOOLS-0612260951

 25 27  0  0  0  0  0  0  0  0999 V2000
   -2.0960    0.4700    0.0060 C   0  0  0  0  0
   -3.4980    1.0260    0.0120 C   0  0  0  0  0
   -4.4560   -0.1000   -0.4030 C   0  0  0  0  0
   -2.8890   -1.9190   -0.0400 C   0  0  0  0  0
    1.5210    0.5130    0.0070 C   0  0  0  0  0
    1.8230    1.8650    0.0300 C   0  0  0  0  0
    0.8400    2.8400    0.0470 C   0  0  0  0  0
   -0.4970    2.5290    0.0400 C   0  0  0  0  0
   -0.8320    1.1710    0.0180 C   0  0  0  0  0
    0.1710    0.1670    0.0010 C   0  0  0  0  0
   -1.8180   -0.8540   -0.0190 C   0  0  0  0  0
   -4.1620   -1.3060    0.3830 N   0  0  0  0  0
   -0.4630   -1.0420   -0.0180 N   0  0  0  0  0
    2.8790   -0.8030   -0.0150 BR  0  0  0  0  0
   -3.7510    1.3750    1.0120 H   0  0  0  0  0
   -3.5700    1.8510   -0.6970 H   0  0  0  0  0
   -5.4840    0.2130   -0.2200 H   0  0  0  0  0
   -4.3250   -0.3160   -1.4630 H   0  0  0  0  0
   -2.9860   -2.3210   -1.0480 H   0  0  0  0  0
   -2.6230   -2.7190    0.6500 H   0  0  0  0  0
    2.8590    2.1680    0.0350 H   0  0  0  0  0
    1.1350    3.8790    0.0640 H   0  0  0  0  0
   -1.2560    3.2980    0.0530 H   0  0  0  0  0
   -4.1630   -1.1030    1.3710 H   0  0  0  0  0
   -0.0200   -1.9050   -0.0330 H   0  0  0  0  0
  1  2  1  0  0  0
  1  9  1  0  0  0
  2  3  1  0  0  0
  2 15  1  0  0  0
  2 16  1  0  0  0
  3 12  1  0  0  0
  3 17  1  0  0  0
  3 18  1  0  0  0
  4 11  1  0  0  0
  4 19  1  0  0  0
  4 20  1  0  0  0
  5  6  2  0  0  0
  6  7  1  0  0  0
  6 21  1  0  0  0
  7  8  2  0  0  0
  7 22  1  0  0  0
  8  9  1  0  0  0
  8 23  1  0  0  0
  9 10  2  0  0  0
 10 13  1  0  0  0
 10  5  1  0  0  0
 11  1  2  0  0  0
 12  4  1  0  0  0
 12 24  1  0  0  0
 13 11  1  0  0  0
 13 25  1  0  0  0
 14  5  1  0  0  0
M  END
$$$$
