A1CPU
  CCTOOLS-0522260957

 21 21  0  0  0  0  0  0  0  0999 V2000
    0.7850    0.9140    0.0250 C   0  0  0  0  0
   -3.4280   -1.2550    0.1040 C   0  0  0  0  0
   -1.3140   -0.2490   -0.2910 C   0  0  0  0  0
   -0.6220   -1.4480   -0.3930 C   0  0  0  0  0
    0.7540   -1.4630   -0.2930 C   0  0  0  0  0
    1.4560   -0.2870   -0.0790 C   0  0  0  0  0
   -0.6080    0.9450   -0.0800 C   0  0  0  0  0
   -1.3310    2.2250    0.0320 C   0  0  0  0  0
   -4.7740   -1.1970    0.0870 N   0  0  0  0  0
   -2.7030   -0.2320   -0.3920 N   0  0  0  0  0
   -2.8660   -2.2290    0.5660 O   0  0  0  0  0
   -2.5460    2.2370    0.0380 O   0  0  0  0  0
   -0.6450    3.3810    0.1260 O   0  0  0  0  0
    3.3400   -0.3280    0.0690 BR  0  0  0  0  0
    1.3360    1.8280    0.1920 H   0  0  0  0  0
   -1.1610   -2.3690   -0.5560 H   0  0  0  0  0
    1.2880   -2.3990   -0.3740 H   0  0  0  0  0
   -5.2950   -1.9330    0.4440 H   0  0  0  0  0
   -5.2220   -0.4200   -0.2810 H   0  0  0  0  0
   -3.1490    0.5160   -0.8190 H   0  0  0  0  0
   -1.1630    4.1940    0.1970 H   0  0  0  0  0
  1  6  1  0  0  0
  1 15  1  0  0  0
  2 11  2  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  4 16  1  0  0  0
  5 17  1  0  0  0
  6  5  2  0  0  0
  6 14  1  0  0  0
  7  1  2  0  0  0
  7  3  1  0  0  0
  8  7  1  0  0  0
  9  2  1  0  0  0
  9 18  1  0  0  0
  9 19  1  0  0  0
 10  2  1  0  0  0
 10  3  1  0  0  0
 10 20  1  0  0  0
 12  8  2  0  0  0
 13  8  1  0  0  0
 13 21  1  0  0  0
M  END
$$$$
