L42GUR
  -OEChem-05022322003D

 22 23  0     0  0  0  0  0  0999 V2000
   -3.7158    1.0580    0.0006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8206   -1.2127   -0.0009 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9779    1.0479    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5143   -0.6104    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3722    0.7789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7965   -1.1642    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8120   -1.1594    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6923   -0.1200    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9169   -0.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4675    1.6501   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7450    1.0827   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2951   -0.8738   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1199   -0.1770   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506   -2.2160    0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3801    1.9753   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9468   -2.2377   -0.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3344    2.7267   -0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6094    1.7429   -0.0026 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6473   -1.0037   -1.0282 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9950   -0.2202    0.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3194   -1.8457    0.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6943    0.9874    0.0005 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  5  1  0  0  0  0
  3  8  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5 10  1  0  0  0  0
  6  8  2  0  0  0  0
  6 14  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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