9AB
  CCTOOLS-1004241119

 39 40  0  0  0  0  0  0  0  0999 V2000
    0.2070    3.2280   -1.0580 C   0  0  0  0  0
   -4.9700    0.9300    0.0550 C   0  0  0  0  0
   -6.3540    0.5730   -0.4910 C   0  0  0  0  0
   -3.9910    1.1030   -1.1080 C   0  0  0  0  0
   -7.3320    0.4000    0.6720 C   0  0  0  0  0
   -2.6080    1.4610   -0.5610 C   0  0  0  0  0
   -8.7160    0.0430    0.1250 C   0  0  0  0  0
   -1.6290    1.6330   -1.7240 C   0  0  0  0  0
   -9.6800   -0.1270    1.2710 C   0  0  0  0  0
    2.9430   -0.1310    0.2350 C   0  0  0  0  0
    1.8580   -0.9000   -0.1680 C   0  0  0  0  0
    2.8980    1.2420    0.1450 C   0  0  0  0  0
    0.7200   -0.2980   -0.6640 C   0  0  0  0  0
    1.7510    1.8680   -0.3560 C   0  0  0  0  0
    0.6580    1.0870   -0.7620 C   0  0  0  0  0
    1.4090    3.1660   -0.5630 N   0  0  0  0  0
   -0.3040    1.9750   -1.2010 N   0  0  0  0  0
   -9.3000    0.0230    2.4080 O   0  0  0  0  0
    4.4920   -0.9770    0.9120 BR  0  0  0  0  0
    1.9410   -2.7850   -0.0350 BR  0  0  0  0  0
    4.3800    2.2790    0.6970 BR  0  0  0  0  0
   -0.7510   -1.3540   -1.2080 BR  0  0  0  0  0
   -0.3110    4.1410   -1.3120 H   0  0  0  0  0
   -5.0320    1.8610    0.6190 H   0  0  0  0  0
   -4.6200    0.1320    0.7090 H   0  0  0  0  0
   -6.7040    1.3720   -1.1450 H   0  0  0  0  0
   -6.2920   -0.3580   -1.0550 H   0  0  0  0  0
   -3.9300    0.1720   -1.6720 H   0  0  0  0  0
   -4.3410    1.9020   -1.7620 H   0  0  0  0  0
   -6.9830   -0.3980    1.3260 H   0  0  0  0  0
   -7.3940    1.3310    1.2360 H   0  0  0  0  0
   -2.6690    2.3910    0.0030 H   0  0  0  0  0
   -2.2580    0.6620    0.0930 H   0  0  0  0  0
   -9.0660    0.8420   -0.5280 H   0  0  0  0  0
   -8.6550   -0.8880   -0.4390 H   0  0  0  0  0
   -1.5670    0.7020   -2.2890 H   0  0  0  0  0
   -1.9790    2.4320   -2.3780 H   0  0  0  0  0
  -10.9620   -0.4450    1.0280 O   0  0  0  0  0
  -11.5420   -0.5430    1.7950 H   0  0  0  0  0
  1 17  1  0  0  0
  1 16  2  0  0  0
  1 23  1  0  0  0
  2  4  1  0  0  0
  2 24  1  0  0  0
  2 25  1  0  0  0
  3  2  1  0  0  0
  3 26  1  0  0  0
  3 27  1  0  0  0
  4  6  1  0  0  0
  4 28  1  0  0  0
  4 29  1  0  0  0
  5  3  1  0  0  0
  5 30  1  0  0  0
  5 31  1  0  0  0
  6  8  1  0  0  0
  6 32  1  0  0  0
  6 33  1  0  0  0
  7  5  1  0  0  0
  7 34  1  0  0  0
  7 35  1  0  0  0
  8 17  1  0  0  0
  8 36  1  0  0  0
  8 37  1  0  0  0
  9  7  1  0  0  0
  9 38  1  0  0  0
 10 19  1  0  0  0
 11 10  1  0  0  0
 11 20  1  0  0  0
 12 21  1  0  0  0
 12 10  2  0  0  0
 13 11  2  0  0  0
 14 12  1  0  0  0
 15 14  2  0  0  0
 15 13  1  0  0  0
 16 14  1  0  0  0
 17 15  1  0  0  0
 18  9  2  0  0  0
 22 13  1  0  0  0
 38 39  1  0  0  0
M  END
$$$$
