LJ3RK6
  -OEChem-05022321293D

 22 23  0     0  0  0  0  0  0999 V2000
    3.5324    1.4465   -0.0005 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9592   -0.7758    0.0016 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7946    0.9798   -0.0008 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4903    0.4852   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3942   -0.9080   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9916   -1.2310    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7175    1.1577   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6969   -0.0497   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8799    0.3815   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5797   -1.6695   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8146   -1.0105   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2117    1.0570    0.0022 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1134    0.1368    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0334    1.9621   -0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4204   -2.2244    0.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7577    2.2424    0.0017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5431   -2.7552   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7256   -1.6045    0.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5631    1.1900    1.0302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1595    2.0392   -0.4799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9527    0.4689   -0.5501 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5112    1.5118    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  1  0  0  0  0
  1 22  1  0  0  0  0
  2 13  2  0  0  0  0
  3  4  1  0  0  0  0
  3  8  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  8  2  0  0  0  0
  6 15  1  0  0  0  0
  7  9  2  0  0  0  0
  7 16  1  0  0  0  0
  8 13  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  2  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 12 20  1  0  0  0  0
 12 21  1  0  0  0  0
M  END

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