B50MXN
  -OEChem-04022118133D

 20 21  0     0  0  0  0  0  0999 V2000
    2.2923   -1.7915    0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3096   -2.9054    0.0004 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7884    2.4291    0.0005 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.9636    2.1327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8646   -1.7836    0.0001 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7120   -0.4661   -0.0003 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7913    1.6599    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4515   -0.5192   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9420   -0.1737   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6022    0.2714   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6192   -0.0059   -1.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6189   -0.0057    1.2081 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9730    0.3300   -1.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9728    0.3301    1.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6497    0.4979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1060   -0.1331   -2.1583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1056   -0.1328    2.1584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5002    0.4608   -2.1485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4999    0.4612    2.1485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7038    0.7595    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  7  2  0  0  0  0
  5  8  2  0  0  0  0
  6 10  2  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  2  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  2  0  0  0  0
 12 17  1  0  0  0  0
 13 15  2  0  0  0  0
 13 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
M  CHG  4   2  -1   3  -1   5   1   7   1
M  END

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