439159
  Marvin  02230614473D          

 20 20  0  0  1  0            999 V2000
    0.1826   -0.1914    0.6885 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.2882   -1.5540    0.7202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9831    0.4571    0.7418 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9884    0.2013   -0.5822 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6190   -1.5434    0.7212 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4203   -2.5495    0.7473 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9776   -0.2612    0.7326 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3641    1.7022   -0.6237 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1781   -0.5829   -0.6630 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3669   -2.5138    0.7091 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1207    0.1754    0.7278 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0582    2.0285   -1.8227 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7643    0.0212    1.5914 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3893   -0.0250   -1.4699 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0011    1.9596    0.2250 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4663    2.3226   -0.5832 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5867   -0.3496   -1.5233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0354   -3.3294    0.6957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2595    1.0452    0.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2510    2.9871   -1.7511 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1 13  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 14  1  0  0  0  0
  5  7  2  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  END