2S3
  Mrv0541 02241213072D          

 17 18  0  0  0  0            999 V2000
    1.2942   -1.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5797   -1.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1347   -1.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5797   -0.2422    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2942    0.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0087   -0.2422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7232    0.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1347    0.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8884   -0.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1433   -0.9499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9503   -1.1214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5023   -0.5083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2474    0.2763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4404    0.4478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0279    1.1623    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210    0.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0854   -0.5342    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  1  0  0  0
  4 17  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  2  0  0  0  0
  9 10  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  END