EXO4875
  -OEChem-04222010103D

 21 21  0     1  0  0  0  0  0999 V2000
    0.2411    0.1281    1.1473 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.1712   -0.6853    1.1040 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9954    1.2711    1.1227 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4790    0.8356   -1.0504 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8349   -1.8081   -0.6656 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1992   -0.8015    0.1869 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7215   -0.6600   -0.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633    0.4971    0.0085 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8393    0.1264    0.3975 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1801    0.7481   -0.7836 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5527    0.5552   -1.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2088   -0.2068   -0.1712 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3204   -1.1419    1.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2765   -1.6469   -0.3566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6150   -0.0767   -1.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7956   -1.9588   -0.3590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3594   -2.7027   -0.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4894    1.3206   -1.3904 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0349    0.9555   -1.9953 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2479   -0.5046   -0.1709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4815    2.1097    0.9719 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1  9  1  0  0  0  0
  2  9  1  0  0  0  0
  2 12  1  0  0  0  0
  3  8  1  0  0  0  0
  3 21  1  0  0  0  0
  4  8  2  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  END

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