A1E4O
  CCTOOLS-0206261215

 27 28  0  0  0  0  0  0  0  0999 V2000
   -1.3970   -2.3080   -0.1620 C   0  0  0  0  0
   -0.0910   -1.9330   -0.2470 C   0  0  0  0  0
    4.4400   -2.0960    0.7000 C   0  0  0  0  0
    3.2300   -1.1810    0.8990 C   0  0  0  0  0
    1.5890    0.0340   -0.2740 C   0  0  0  0  0
    1.5870    1.3890   -0.2000 C   0  0  0  0  0
    2.7480    2.1970   -0.2480 C   0  0  0  0  0
   -0.7410    0.3910   -0.0680 C   0  0  0  0  0
   -2.0790   -0.0170    0.0110 C   0  0  0  0  0
   -2.3990   -1.3530   -0.0360 C   0  0  0  0  0
    0.2680   -0.5670   -0.2010 C   0  0  0  0  0
    2.7510   -0.7120   -0.4090 N   0  0  0  0  0
    5.5220   -1.3420    0.1500 O   0  0  0  0  0
    2.6520    3.5290   -0.0550 O   0  0  0  0  0
    3.8330    1.6900   -0.4650 O   0  0  0  0  0
   -0.0450    2.0060   -0.0350 S   0  0  0  0  0
   -3.4490    1.2740    0.1920 BR  0  0  0  0  0
   -1.8150   -3.9920   -0.2200 CL  0  0  0  0  0
    0.6770   -2.6860   -0.3500 H   0  0  0  0  0
    4.7400   -2.5150    1.6610 H   0  0  0  0  0
    4.1770   -2.9040    0.0180 H   0  0  0  0  0
    2.4350   -1.7340    1.3990 H   0  0  0  0  0
    3.5170   -0.3250    1.5090 H   0  0  0  0  0
   -3.4320   -1.6620    0.0260 H   0  0  0  0  0
    2.6130   -1.4850   -1.0420 H   0  0  0  0  0
    6.3250   -1.8590   -0.0020 H   0  0  0  0  0
    3.4970    3.9960   -0.1060 H   0  0  0  0  0
  1 18  1  0  0  0
  2  1  1  0  0  0
  2 19  1  0  0  0
  3 13  1  0  0  0
  3 20  1  0  0  0
  3 21  1  0  0  0
  4 12  1  0  0  0
  4  3  1  0  0  0
  4 22  1  0  0  0
  4 23  1  0  0  0
  5 11  1  0  0  0
  5 12  1  0  0  0
  6  5  2  0  0  0
  7  6  1  0  0  0
  7 14  1  0  0  0
  8  9  2  0  0  0
  8 11  1  0  0  0
  9 10  1  0  0  0
 10  1  2  0  0  0
 10 24  1  0  0  0
 11  2  2  0  0  0
 12 25  1  0  0  0
 13 26  1  0  0  0
 14 27  1  0  0  0
 15  7  2  0  0  0
 16  6  1  0  0  0
 16  8  1  0  0  0
 17  9  1  0  0  0
M  END
$$$$
