COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.075  -1.628   0.648  1.00  0.00           C  
HETATM    2  C   UNL     1       7.085  -0.329   1.120  1.00  0.00           C  
HETATM    3  C   UNL     1       6.014  -2.080  -0.113  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.151  -1.136  -1.696  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.864  -0.983  -1.213  1.00  0.00           C  
HETATM    6  C   UNL     1       6.033   0.519   0.829  1.00  0.00           C  
HETATM    7  C   UNL     1       4.962  -1.231  -0.404  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.068   0.724   0.447  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.203  -0.528  -1.029  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.970   0.941   1.750  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.705  -1.484   0.252  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.681  -0.214  -0.064  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.096  -0.202   0.477  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.509   0.174   0.735  1.00  0.00           C  
HETATM   15  C   UNL     1       4.971   0.068   0.067  1.00  0.00           C  
HETATM   16  C   UNL     1       0.152   0.170   0.190  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.796   0.374   0.562  1.00  0.00           C  
HETATM   18  C   UNL     1       1.414   0.910   0.101  1.00  0.00           C  
HETATM   19  C   UNL     1       3.991   1.547  -1.666  1.00  0.00           C  
HETATM   20  C   UNL     1       3.824   0.993  -0.249  1.00  0.00           C  
HETATM   21  N   UNL     1      -7.009   0.189   0.057  1.00  0.00           N  
HETATM   22  N   UNL     1      -5.330   1.065   1.655  1.00  0.00           N  
HETATM   23  N   UNL     1       2.562   0.254  -0.160  1.00  0.00           N  
HETATM   24  N   UNL     1       2.814   2.353  -2.018  1.00  0.00           N  
HETATM   25  O   UNL     1       1.426   2.116   0.261  1.00  0.00           O  
HETATM   26  S   UNL     1      -0.023  -1.566  -0.017  1.00  0.00           S  
HETATM   27  H   UNL     1       7.899  -2.290   0.872  1.00  0.00           H  
HETATM   28  H   UNL     1       7.914   0.023   1.715  1.00  0.00           H  
HETATM   29  H   UNL     1       6.006  -3.095  -0.482  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.334  -1.720  -2.585  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.025  -1.446  -1.712  1.00  0.00           H  
HETATM   32  H   UNL     1       6.040   1.535   1.198  1.00  0.00           H  
HETATM   33  H   UNL     1       4.133  -1.584  -1.000  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.217   1.782   0.608  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.207  -0.645  -1.411  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.357   1.386   2.520  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.371  -2.335   0.238  1.00  0.00           H  
HETATM   38  H   UNL     1       4.884   2.171  -1.709  1.00  0.00           H  
HETATM   39  H   UNL     1       4.090   0.721  -2.370  1.00  0.00           H  
HETATM   40  H   UNL     1       3.814   1.817   0.464  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.886   1.569   2.271  1.00  0.00           H  
HETATM   42  H   UNL     1       2.553  -0.707  -0.288  1.00  0.00           H  
HETATM   43  H   UNL     1       2.663   3.087  -1.343  1.00  0.00           H  
HETATM   44  H   UNL     1       2.901   2.730  -2.950  1.00  0.00           H  
CONECT    1    3    3    2   27                                       
CONECT    2    1    6    6   28                                       
CONECT    3    1    1    7   29                                       
CONECT    4    5    9    9   30                                       
CONECT    5   12   12    4   31                                       
CONECT    6    2    2   15   32                                       
CONECT    7    3   15   15   33                                       
CONECT    8   16   16   13   34                                       
CONECT    9    4    4   21   35                                       
CONECT   10   14   14   22   36                                       
CONECT   11   26   13   13   37                                       
CONECT   12   14    5    5   17                                       
CONECT   13   11   11    8   14                                       
CONECT   14   13   10   10   12                                       
CONECT   15    7    7    6   20                                       
CONECT   16   18   26    8    8                                       
CONECT   17   12   22   21   21                                       
CONECT   18   25   25   16   23                                       
CONECT   19   20   24   38   39                                       
CONECT   20   15   23   19   40                                       
CONECT   21   17   17    9                                            
CONECT   22   10   17   41                                            
CONECT   23   18   20   42                                            
CONECT   24   19   43   44                                            
CONECT   25   18   18                                                 
CONECT   26   16   11                                                 
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
