LGUM85
  -OEChem-05022321383D

  9  8  0     0  0  0  0  0  0999 V2000
    1.5957    0.1145   -0.3237 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6369    0.1406    0.4672 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5258   -0.5993   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7067    0.3442   -0.1215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3063   -1.0505   -0.9949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7278   -1.3980    0.6974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5939   -0.1957   -0.4679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9437    0.7943    0.8492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5092    1.1581   -0.8281 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
M  END

$$$$