D0T3PV
 Wcorina  10100417253D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 11 11  0     0  0  0  0  0  0999 V2000
   -0.0209    1.6890    0.0113 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.6966   -1.5118   -0.0223 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3678    1.7681   -0.0306 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1347   -0.4410   -0.0407 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5225    1.9197   -0.0022 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1422    0.7650   -0.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3005   -0.3580   -0.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6078    0.6545   -0.0293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7647   -0.5981    0.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3269    1.6450   -0.0407 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  8  2  0  0  0  0
  3  9  1  0  0  0  0
  3 11  1  0  0  0  0
  4  9  2  0  0  0  0
  5  8  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
M  END

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