D0Y6MY
 Wcorina  10100417213D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 17 17  0     0  0  0  0  0  0999 V2000
   -0.0186    1.5178    0.0104 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
    1.3390    1.9375   -0.0003 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9617    1.9117   -0.9768 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4503    2.8377    4.9232 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0761    2.9955    5.7305 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6830    2.0218    1.5625 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1581    2.2311    2.6359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0463    2.2124    1.7005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3700    2.6309    3.8648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5765    2.6087    2.9158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7477    2.8163    3.9985 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2226    2.0856    2.5259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6998    2.0516    0.8558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6416    2.7561    3.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1628    3.1252    4.9465 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3524   -0.3882   -0.8133 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  2  0  0  0  0
  1  7  1  0  0  0  0
  2 17  1  0  0  0  0
  5  6  3  0  0  0  0
  5 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  2  0  0  0  0
  8 13  1  0  0  0  0
  9 11  1  0  0  0  0
  9 14  1  0  0  0  0
 10 12  1  0  0  0  0
 11 12  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
M  CHG  1   5   1
M  END

$$$$