B39XFE
  -OEChem-04012114343D

 18 17  0     0  0  0  0  0  0999 V2000
    1.7648   -0.0704    0.0495 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1620    0.0061   -0.2643 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4419    0.9319   -0.7529 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9209   -0.0718    1.4927 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2298   -1.6175   -0.5251 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5706    1.1729    0.0863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0328    0.9981   -0.3068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6704   -0.1538    0.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2457   -1.1954   -0.1953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1483    2.0340   -0.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4782    1.3497    1.1640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0985    0.8446   -1.3909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5859    1.9138   -0.0698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6732   -0.1216    1.5024 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8641   -2.4287   -0.0102 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2059   -1.7565   -1.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6962   -1.9926    0.3857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2771   -1.2728   -1.2764 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  2  0  0  0  0
  8 14  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
M  END

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