BJ59AS
  -OEChem-04022106253D

 21 21  0     1  0  0  0  0  0999 V2000
   -2.3309    0.2520    0.0641 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8886    1.8234    0.0179 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3339   -0.1964    1.4521 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4896    0.0627   -0.8016 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4907    0.8448   -0.4271 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5463    1.7253    0.3379 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4931   -1.5455    0.5426 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2132   -0.7630    0.2161 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8836   -0.4501   -0.7591 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6370   -1.8688   -0.3370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6396   -0.6457   -0.2341 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1806    0.7615   -0.0718 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0989   -0.5228    1.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6477   -0.1516   -1.7702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2034   -2.5383   -1.0718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3273   -2.3648    0.3341 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7216   -0.8992   -1.2986 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4492   -1.4962    0.1912 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1929   -2.5089    0.3960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5055    2.4477    0.4670 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8418    1.7541   -0.3161 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  9  1  0  0  0  0
  2 20  1  0  0  0  0
  5 12  1  0  0  0  0
  5 21  1  0  0  0  0
  6 12  2  0  0  0  0
  7 11  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 13  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 12  1  0  0  0  0
 11 17  1  0  0  0  0
M  END

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