D08SIT
 Wcorina  10100417233D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 15 16  0     0  0  0  0  0  0999 V2000
   -0.0169    1.3945    0.0097 N   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
    1.2720    1.8600   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1114    0.7291   -0.0142 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8382    3.1321    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5002    0.8981   -0.0269 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2311   -0.4348   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1973    3.2716   -0.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0269    2.1574   -0.0256 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2045    4.0066    0.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1519    0.0369   -0.0374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8145    1.9464    0.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5431   -1.4688   -0.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6321    4.2602   -0.0101 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0989    2.2887   -0.0351 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 12  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5 10  1  0  0  0  0
  6  9  1  0  0  0  0
  6 11  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
M  END

$$$$