D03SAM
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 20 20  0     1  0  0  0  0  0999 V2000
   -0.0165    1.3646    0.0095 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9601   -0.1323   -2.1815 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0475    0.7351   -0.0135 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5378   -1.3205   -1.4280 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1956   -0.9188    0.0081 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6734   -2.3457   -1.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2963   -0.3761   -0.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2679    1.7816   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6591   -1.7580   -1.9021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0456   -0.4015    0.4530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9680   -1.8115    0.5907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9172   -2.6319   -2.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3600   -3.2274   -0.8549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5520   -1.9082   -0.9399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8050    1.9295    0.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7737    0.2918   -1.7616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2056    0.5330   -2.2603 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6647   -1.3913   -0.0213 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5957    2.8106    0.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  9  1  0  0  0  0
  1 16  1  0  0  0  0
  4  2  1  0  0  0  0
  2 17  1  0  0  0  0
  2 18  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  2  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6  8  2  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8 19  1  0  0  0  0
  9 20  1  0  0  0  0
M  END

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