LEJ9X7
  -OEChem-05022322133D

 27 28  0     0  0  0  0  0  0999 V2000
   -4.5983    0.8597   -0.3983 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.1447   -1.6557   -0.3083 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4476    0.5496    0.1492 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8348   -0.9088    0.2685 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0813   -1.6378    0.3793 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7283    0.3257   -0.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0554    0.4746    0.0952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1613    0.2485   -0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1053    1.5422    0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0404   -0.8165   -0.2368 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2865    1.6167    0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4324   -0.7421   -0.1829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9455    1.3141   -0.4534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1258   -0.7028    0.1308 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3777   -0.4801   -0.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7958    0.0125    0.0978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6700    2.4497    0.4636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4232   -1.7746   -0.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7589    2.5704    0.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9599   -1.6673   -0.3683 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8250    1.4717    0.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6639    2.3085   -0.7713 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0022    0.7713   -0.6623 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4926   -0.8202   -0.0324 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9401    0.4428    1.0928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8446   -2.5731    0.6936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0689   -1.4375    0.2603 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2 15  2  0  0  0  0
  3  7  1  0  0  0  0
  3 15  1  0  0  0  0
  3 21  1  0  0  0  0
  4  8  1  0  0  0  0
  4 14  2  0  0  0  0
  5 14  1  0  0  0  0
  5 26  1  0  0  0  0
  5 27  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 11  1  0  0  0  0
  9 17  1  0  0  0  0
 10 12  2  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
 13 22  1  0  0  0  0
 15 16  1  0  0  0  0
 16 23  1  0  0  0  0
 16 24  1  0  0  0  0
 16 25  1  0  0  0  0
M  END

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