A1J28
  CCTOOLS-0619261019

 31 31  0  0  0  0  0  0  0  0999 V2000
   -3.2520    0.4270    0.0010 C   0  0  0  0  0
   -0.8880    0.5930    0.0000 C   0  0  0  0  0
    0.4530    0.0100   -0.0010 C   0  0  0  0  0
    1.5370    0.8130    0.0000 C   0  0  0  0  0
    2.8870    0.2270   -0.0010 C   0  0  0  0  0
    4.3180   -1.7040    0.0010 C   0  0  0  0  0
    4.0130    1.0560    0.0000 C   0  0  0  0  0
   -6.8200   -1.0180   -0.0010 C   0  0  0  0  0
   -5.7210    0.0450    0.0010 C   0  0  0  0  0
   -4.3510   -0.6370   -0.0010 C   0  0  0  0  0
   -1.9730   -0.2100   -0.0010 O   0  0  0  0  0
   -1.0270    1.8010    0.0020 O   0  0  0  0  0
    3.0500   -1.1620    0.0020 C   0  0  0  0  0
    5.4280   -0.8760   -0.0030 C   0  0  0  0  0
    5.2750    0.4990   -0.0010 C   0  0  0  0  0
   -3.3480    1.0510   -0.8880 H   0  0  0  0  0
   -3.3480    1.0470    0.8920 H   0  0  0  0  0
    0.5760   -1.0630   -0.0030 H   0  0  0  0  0
    1.4140    1.8860    0.0020 H   0  0  0  0  0
    4.4460   -2.7760    0.0040 H   0  0  0  0  0
    3.8950    2.1300    0.0010 H   0  0  0  0  0
   -7.7960   -0.5330   -0.0000 H   0  0  0  0  0
   -6.7250   -1.6390   -0.8920 H   0  0  0  0  0
   -6.7240   -1.6420    0.8880 H   0  0  0  0  0
   -5.8170    0.6690   -0.8880 H   0  0  0  0  0
   -5.8170    0.6660    0.8920 H   0  0  0  0  0
   -4.2550   -1.2570   -0.8920 H   0  0  0  0  0
   -4.2550   -1.2600    0.8880 H   0  0  0  0  0
    2.1850   -1.8090    0.0060 H   0  0  0  0  0
    6.4180   -1.3070   -0.0030 H   0  0  0  0  0
    6.1450    1.1380   -0.0040 H   0  0  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2 12  2  0  0  0
  3  2  1  0  0  0
  3  4  2  0  0  0
  3 18  1  0  0  0
  4 19  1  0  0  0
  5  4  1  0  0  0
  5  7  2  0  0  0
  6 13  2  0  0  0
  6 14  1  0  0  0
  6 20  1  0  0  0
  7 21  1  0  0  0
  8  9  1  0  0  0
  8 22  1  0  0  0
  8 23  1  0  0  0
  8 24  1  0  0  0
  9 10  1  0  0  0
  9 25  1  0  0  0
  9 26  1  0  0  0
 10  1  1  0  0  0
 10 27  1  0  0  0
 10 28  1  0  0  0
 11  1  1  0  0  0
 11  2  1  0  0  0
 13  5  1  0  0  0
 13 29  1  0  0  0
 14 15  2  0  0  0
 14 30  1  0  0  0
 15  7  1  0  0  0
 15 31  1  0  0  0
M  END
$$$$
