L5U1NQ
  -OEChem-05022321593D

 23 24  0     0  0  0  0  0  0999 V2000
    4.5708    0.3834   -0.0011 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.8558   -1.6921   -0.0008 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6758    1.1070    0.0009 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6392   -0.4567   -0.0007 N   0  3  0  0  0  0  0  0  0  0  0  0
   -4.3616   -1.5102    0.0005 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5339    0.8202   -0.0037 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0824   -0.4544    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115    0.9232    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3154   -0.1035    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3558   -1.0895    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2471   -0.9207    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7268    1.8614    0.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2959    0.0062    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0374    1.3753    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7367   -0.2496    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5344   -2.1565    0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1355    2.0072    0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4230   -1.9927    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5261    2.9275    0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8409    2.1089    0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8280   -2.3727    0.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3727   -1.5916   -0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5058    0.4906   -0.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  2  4  2  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  3 17  1  0  0  0  0
  4 13  1  0  0  0  0
  5 15  1  0  0  0  0
  5 21  1  0  0  0  0
  5 22  1  0  0  0  0
  6 15  2  0  0  0  0
  6 23  1  0  0  0  0
  7  8  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  2  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 13  2  0  0  0  0
 11 18  1  0  0  0  0
 12 14  2  0  0  0  0
 12 19  1  0  0  0  0
 13 14  1  0  0  0  0
 14 20  1  0  0  0  0
M  CHG  2   1  -1   4   1
M  END

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