B4U8GL
  -OEChem-04042104343D

 17 18  0     0  0  0  0  0  0999 V2000
   -3.4395   -0.7183    0.0007 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.9906    1.4305    0.0003 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1866    1.4039   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8691   -0.7113    0.0005 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6210    0.2320    0.0001 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0412    0.6498   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4938   -0.6668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3106    0.9955   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2299   -0.0586   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5562   -1.7133   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8063   -1.3896   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2511    0.5462    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6042    2.0397   -0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8757   -2.7506    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2351    2.4141   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5145   -2.2155   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2721    0.9003    0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  3 12  1  0  0  0  0
  3 15  1  0  0  0  0
  4  7  1  0  0  0  0
  4 12  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  2  0  0  0  0
  8 13  1  0  0  0  0
  9 11  1  0  0  0  0
 10 11  2  0  0  0  0
 10 14  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
M  CHG  2   1  -1   5   1
M  END

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