LKRE39
  -OEChem-05032301463D

 18 18  0     0  0  0  0  0  0999 V2000
    0.6395   -1.1009    0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1447    1.2553   -0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6142   -1.8394   -0.0004 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1451    0.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6714   -0.7819    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4802   -0.0489    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1817    1.5020   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5901    0.8612    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9381   -0.3616    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4445    2.5552   -0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0826    0.4619   -0.8923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0822    0.4618    0.8932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7459    1.9456    0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1244   -1.3654   -0.3945 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4852    0.3541   -0.6215 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3271   -0.3098    1.0213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1850   -1.8818    0.8393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1844   -1.8817   -0.8405 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  1  6  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  1  0  0  0  0
  3  5  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  2  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
M  END

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