D0W4IK
 Wcorina  10100417263D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 19 18  0     1  0  0  0  0  0999 V2000
   -0.0172    1.4168    0.0098 S   0  0  1  0  0  0  0  0  0  0  0  0
    4.2336    0.2921    2.6769 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6846    2.0446   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6870    2.0210   -1.5640 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3866    1.6192    1.2608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1194    1.5744   -1.7048 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4128    0.7895    1.1992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0830    2.4616   -1.7268 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2142    1.6413   -0.8662 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6700    3.1329   -0.0618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6423    3.1100   -1.5837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0981    1.6183   -2.3880 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0507    1.9926    2.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3515    0.5229   -1.7877 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7487    0.4161    0.2431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8509    3.5131   -1.6439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1095    2.1415   -1.8278 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1976   -0.5300    2.2255 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  8  1  0  0  0  0
  2 19  1  0  0  0  0
  4  6  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5  7  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  8  2  0  0  0  0
  6 14  1  0  0  0  0
  7  9  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
M  END

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