B2BE6I
  -OEChem-04022102283D

 21 22  0     0  0  0  0  0  0999 V2000
    0.5208   -3.1008    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7227   -1.0744   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3300    0.8923    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5012   -0.5079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0826    0.6266    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9601    1.4495    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6388   -1.3070    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9215   -0.7533    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4772    1.6972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4488    1.2230   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7372    1.1165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8044   -0.2620   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0843    2.5309   -0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8005   -1.3948   -0.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3951    2.7817    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4581    2.1917    0.5108 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1619    0.5781    0.5244 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7959    1.3661   -1.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6347    1.7237   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7621   -0.7720   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8188   -3.1707    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 21  1  0  0  0  0
  2  4  1  0  0  0  0
  2 12  2  0  0  0  0
  3  4  2  0  0  0  0
  3  6  1  0  0  0  0
  3  9  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  2  0  0  0  0
  5  8  1  0  0  0  0
  5 10  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  2  0  0  0  0
  8 14  1  0  0  0  0
  9 11  2  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  END

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