RDKit          3D

 20 20  0  0  0  0  0  0  0  0999 V2000
    8.1499    0.5387    0.0393 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6917    0.3400    0.0608 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4894    0.1773    0.0956 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0845    0.0022    0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8729   -0.1361    0.2043 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4663   -0.2721    0.2735 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2565   -0.3706    0.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1596   -0.4610    0.3879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3747   -0.5183    0.4377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7903   -0.5608    0.4916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9995   -0.5762    0.5348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4629   -0.5696    0.5833 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.1779    0.4047   -0.3559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1741   -0.9609   -0.5255 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3870    1.2533   -0.7500 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5135    0.9681    0.9939 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6664   -0.4311   -0.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9035   -0.7177    1.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4918    0.9407   -1.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0438    0.9495    0.0173 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  3  0
  3  4  1  0
  4  5  3  0
  5  6  1  0
  6  7  3  0
  7  8  1  0
  8  9  3  0
  9 10  1  0
 10 11  3  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 12  1  0
  1 15  1  0
  1 16  1  0
  1 17  1  0
 12 18  1  1
 13 19  1  0
 13 20  1  0
M  END