L8FI7E
  -OEChem-05022322303D

 22 22  0     0  0  0  0  0  0999 V2000
    3.5298   -0.9354    0.0010 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.5816   -1.6943   -0.0004 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0775   -0.5155    0.0011 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8647    1.4207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8524   -0.6948   -0.0007 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4209    0.7269   -0.0011 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0394    0.8100   -0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2803    0.7146    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8343   -0.5224   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4941   -0.3741   -0.0019 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7937    0.6116    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9069    0.1967    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2844    0.2562    0.0019 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9544    1.2653   -0.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9534    1.2661    0.8883 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1607    0.0887    0.8913 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1618    0.0878   -0.8872 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2356    1.6136    0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0675   -1.6879   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1300   -0.4366    0.0026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3381    0.8752   -0.8986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3368    0.8755    0.9024 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4 12  2  0  0  0  0
  5 10  1  0  0  0  0
  5 12  1  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
 13 20  1  0  0  0  0
 13 21  1  0  0  0  0
 13 22  1  0  0  0  0
M  END

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