LE6G2R
  -OEChem-05022322562D

 27 28  0     0  0  0  0  0  0999 V2000
    5.5932   -0.7045    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0813   -1.9907    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8898   -0.7873    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6013    0.9049    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1808    0.0923    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8988    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8748    1.2323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4604    0.1159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6811    1.9907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6535    0.6049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6486   -0.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8636   -1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1809    0.0973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3615    1.6164    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6086    1.7922    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9776    0.5048    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9738   -0.2683    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2718    2.0103    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4428    1.7248    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7282    0.8958    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2863    2.1256    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5462    2.5958    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0760    1.8557    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5008   -1.2701    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4935    0.6277    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4882   -0.4462    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 14  1  0  0  0  0
  2 13  2  0  0  0  0
  3  8  1  0  0  0  0
  3 13  1  0  0  0  0
  3 25  1  0  0  0  0
  4 11  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  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
 10 22  1  0  0  0  0
 10 23  1  0  0  0  0
 10 24  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
M  END

$$$$