D0Q3QS
 Wcorina  11010620313D 1   1.00000     0.00000     0
CORINA evaluation license 3.40 0067  02.08.2006
 18 18  0     0  0            999 V2000
   -0.0170    1.4005    0.0097 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
    1.1882    2.1114    0.0021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2989    2.1213    0.0197 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2134   -0.6720   -0.0131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1612   -0.7018    0.0098 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3776    1.4422   -0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3143    3.4691    0.0271 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3446    1.5015    0.0213 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4017    0.0488   -0.0206 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6189   -0.6228   -0.0354 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1773    3.1914    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2357   -1.7517   -0.0188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5073   -0.8994   -0.8713 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3051    1.9955   -0.0196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1809    3.8982    0.0336 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6378   -1.5926   -0.0404 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4494   -0.1216   -0.0406 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  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3 12  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7 10  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
 10 11  1  0  0  0  0
 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
M  END

$$$$