s1007.mol
  corina  12080917183D 1   1.00000     0.00000 
CORINA 3.46 0026  05.08.2008
 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.0184    1.5045    0.0103 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4133   -0.1696   -0.7425 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2067    1.3032   -1.1159 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4299    2.0085   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7463   -2.0639   -0.2262 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0816   -0.7487   -0.3308 C   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
   -1.0536   -0.8801    0.3258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5927   -2.1417    0.1847 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1763   -0.5581    0.6704 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0973   -2.9556    0.3392 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3315   -2.8165   -0.4050 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5674    1.9793   -1.2959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7171    1.9956    1.2519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8242    2.7591    1.2817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1318    2.9816    2.6436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1944    2.3408    3.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3434    1.7405    2.5164 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4685    1.3861   -2.3366 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1  4  1  0  0  0  0
  2  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  7  6  2  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  5  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
  5 12  1  0  0  0  0
  3 13  1  4  0  0  0
  1 14  1  0  0  0  0
 17 18  1  0  0  0  0
 15 16  1  0  0  0  0
 14 15  2  0  0  0  0
 16 17  2  0  0  0  0
 14 18  1  0  0  0  0
  3 19  1  4  0  0  0
M  END
$$$$