B7UM1H
  -OEChem-04022117273D

 21 21  0     0  0  0  0  0  0999 V2000
   -3.5600   -1.3472    0.3528 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3783    2.5027   -0.2986 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.9771    1.0824    0.1971 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7831    1.3344   -0.0909 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.1051    0.5566   -0.8845 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2374    0.2348    2.5126 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3942   -0.5115   -0.6031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8572    0.2593   -0.1855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5271    0.5313   -0.5058 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2659   -1.0557    0.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0144   -1.8263   -0.3800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3444   -2.0984   -0.0597 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7815   -0.2288   -0.9367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7108    0.0691   -0.0275 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0314    0.3381   -0.5015 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4471    0.1592    1.3736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1854    1.5489   -0.6854 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6917   -2.6502   -0.4524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6484   -3.1276    0.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0201   -0.2803   -1.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6504   -2.3084    0.4700 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 21  1  0  0  0  0
  2  4  1  0  0  0  0
  3  4  2  0  0  0  0
  4  8  1  0  0  0  0
  5 15  3  0  0  0  0
  6 16  3  0  0  0  0
  7  9  2  0  0  0  0
  7 11  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 17  1  0  0  0  0
 10 12  1  0  0  0  0
 11 12  2  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 20  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
M  CHG  2   2  -1   4   1
M  END

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