S8E
  CCTOOLS-0410261002

 37 37  0  0  1  0  0  0  0  0999 V2000
   -1.7890   -0.5390   -0.6090 C   0  0  0  0  0
    3.3270   -0.0240    0.3500 C   0  0  0  0  0
   -0.3260   -3.5840    1.1810 C   0  0  0  0  0
   -4.7740   -1.3090   -1.1890 C   0  0  0  0  0
   -3.0240    0.1900   -0.1450 C   0  0  0  0  0
   -3.0620    1.3110    0.6010 C   0  0  0  0  0
   -5.1090    0.7620    0.1960 C   0  0  0  0  0
    4.2500    1.1960    0.3250 C   0  0  0  0  0
    0.6220   -2.3830    1.1830 C   0  0  0  0  0
   -4.3220   -0.1560   -0.4050 N   0  0  0  0  0
   -4.3480    1.6360    0.7960 N   0  0  0  0  0
   -6.5890    0.7770    0.1750 N   0  3  0  0  0
    1.9470    0.4110    0.6020 N   0  0  0  0  0
    0.9640   -2.0270   -0.2000 N   0  0  0  0  0
   -7.1980   -0.0920   -0.4230 O   0  0  0  0  0
   -7.1980    1.6580    0.7550 O   0  5  0  0  0
   -0.6270    0.1400   -0.1290 O   0  0  0  0  0
    1.2220   -0.0430   -1.8380 O   0  0  0  0  0
    0.8720   -0.3630   -0.4360 P   0  0  0  0  0
    6.0970    0.6130   -0.0120 BR  0  0  0  0  0
   -1.8010   -1.5570   -0.2220 H   0  0  0  0  0
   -1.7700   -0.5640   -1.6990 H   0  0  0  0  0
    3.3770   -0.5370   -0.6100 H   0  0  0  0  0
    3.6440   -0.7030    1.1420 H   0  0  0  0  0
    0.1620   -4.4310    0.6980 H   0  0  0  0  0
   -0.5790   -3.8480    2.2080 H   0  0  0  0  0
   -1.2340   -3.3290    0.6370 H   0  0  0  0  0
   -4.9040   -2.1680   -0.5310 H   0  0  0  0  0
   -5.7230   -1.0720   -1.6690 H   0  0  0  0  0
   -4.0300   -1.5430   -1.9510 H   0  0  0  0  0
   -2.2060    1.8530    0.9770 H   0  0  0  0  0
    3.9330    1.8750   -0.4670 H   0  0  0  0  0
    4.2010    1.7090    1.2850 H   0  0  0  0  0
    0.1350   -1.5360    1.6660 H   0  0  0  0  0
    1.5310   -2.6380    1.7280 H   0  0  0  0  0
    1.6910    0.2610    1.5660 H   0  0  0  0  0
    1.8780   -2.3770   -0.4490 H   0  0  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  2 13  1  0  0  0
  2 23  1  0  0  0
  2 24  1  0  0  0
  3  9  1  0  0  0
  3 25  1  0  0  0
  3 26  1  0  0  0
  3 27  1  0  0  0
  4 28  1  0  0  0
  4 29  1  0  0  0
  4 30  1  0  0  0
  5  1  1  0  0  0
  5 10  1  0  0  0
  6 11  1  0  0  0
  6  5  2  0  0  0
  6 31  1  0  0  0
  7 10  1  0  0  0
  7 12  1  0  0  0
  8  2  1  0  0  0
  8 32  1  0  0  0
  8 33  1  0  0  0
  9 14  1  0  0  0
  9 34  1  0  0  0
  9 35  1  0  0  0
 10  4  1  0  0  0
 11  7  2  0  0  0
 12 15  2  0  0  0
 13 36  1  0  0  0
 14 19  1  0  0  0
 14 37  1  0  0  0
 16 12  1  0  0  0
 17 19  1  0  0  0
 17  1  1  0  0  0
 19 13  1  0  0  0
 19 18  2  0  0  0
 20  8  1  0  0  0
M  CHG  1  12   1
M  CHG  1  16  -1
M  END
$$$$
