corina  12080917083D 1   1.00000     0.00000 
CORINA 3.46 0026  05.08.2008
 18 20  0  0  0  0  0  0  0  0999 V2000
   -0.0159    1.3192    0.0093 N   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
    1.1497   -0.6783   -0.0121 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2908   -0.0793   -0.0198 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5212   -0.8897    0.0118 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8971   -2.5886   -0.0033 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4987    3.3503    0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1428    1.9831    0.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3469    1.2450   -0.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3667    2.1642   -0.0181 N   0  0  3  0  0  0  0  0  0  0  0  0
    2.7983    3.4441   -0.0061 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5348    4.5086    0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7363    1.8727   -0.0318 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6157    2.6943   -0.7249 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9659    2.4044   -0.7361 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4425    1.2971   -0.0585 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5695    0.4771    0.6326 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2189    0.7647    0.6524 C   0  0  0  0  0  0  0  0  0  0  0  0
  4  9  1  0  0  0  0
  1  2  2  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  7  2  0  0  0  0
  2  5  1  0  0  0  0
  7 12  1  0  0  0  0
  8  1  1  0  0  0  0
 10 13  1  0  0  0  0
  5  6  1  0  0  0  0
 13 14  2  0  0  0  0
  8  9  2  0  0  0  0
 14 15  1  0  0  0  0
  2  3  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
  3  4  2  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
M  END
$$$$