COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.059  -1.148  -0.261  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.452  -2.051  -0.787  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.693  -0.014  -1.000  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.326   0.065  -0.644  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.929   1.774  -0.027  1.00  0.00           C  
HETATM    6  C   UNL     1       7.519   2.609   1.154  1.00  0.00           C  
HETATM    7  C   UNL     1       7.925   1.275   0.523  1.00  0.00           C  
HETATM    8  C   UNL     1       6.714   0.387   0.403  1.00  0.00           C  
HETATM    9  C   UNL     1       5.874   0.492  -0.689  1.00  0.00           C  
HETATM   10  C   UNL     1       4.510  -1.181   0.116  1.00  0.00           C  
HETATM   11  C   UNL     1       5.306  -1.347   1.233  1.00  0.00           C  
HETATM   12  C   UNL     1       6.431  -0.551   1.385  1.00  0.00           C  
HETATM   13  C   UNL     1       3.285  -2.041  -0.060  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.285  -1.321  -0.618  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.653  -1.396  -0.981  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.531   0.716  -0.826  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.004   0.698  -1.211  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.670   0.952   0.142  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.984  -0.085   0.864  1.00  0.00           C  
HETATM   20  N   UNL     1       4.813  -0.282  -0.801  1.00  0.00           N  
HETATM   21  N   UNL     1      -7.028   1.154   0.370  1.00  0.00           N  
HETATM   22  O   UNL     1       0.898  -1.963  -0.428  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.930   2.898  -0.481  1.00  0.00           O  
HETATM   24  O   UNL     1      -7.934  -0.736   1.254  1.00  0.00           O  
HETATM   25  O   UNL     1       8.474   1.510  -0.775  1.00  0.00           O  
HETATM   26  S   UNL     1      -5.290  -0.607   0.860  1.00  0.00           S  
HETATM   27  H   UNL     1       1.931  -0.506   0.611  1.00  0.00           H  
HETATM   28  H   UNL     1       2.201  -0.531  -1.149  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.422  -3.131  -0.772  1.00  0.00           H  
HETATM   30  H   UNL     1       0.581   0.636  -0.508  1.00  0.00           H  
HETATM   31  H   UNL     1       7.100   2.430   2.144  1.00  0.00           H  
HETATM   32  H   UNL     1       8.395   3.252   1.240  1.00  0.00           H  
HETATM   33  H   UNL     1       6.772   3.095   0.526  1.00  0.00           H  
HETATM   34  H   UNL     1       8.672   0.789   1.151  1.00  0.00           H  
HETATM   35  H   UNL     1       6.089   1.217  -1.460  1.00  0.00           H  
HETATM   36  H   UNL     1       5.053  -2.085   1.980  1.00  0.00           H  
HETATM   37  H   UNL     1       7.072  -0.658   2.248  1.00  0.00           H  
HETATM   38  H   UNL     1       3.144  -2.658   0.827  1.00  0.00           H  
HETATM   39  H   UNL     1       3.414  -2.683  -0.932  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.562  -1.964  -1.117  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.566   1.795  -0.833  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.824   1.649  -1.712  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.657   0.080  -1.828  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.977   1.445   0.825  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.882   1.609   0.301  1.00  0.00           H  
HETATM   46  H   UNL     1       9.258   2.076  -0.774  1.00  0.00           H  
CONECT    1   13   22   27   28                                       
CONECT    2   14   14   15   29                                       
CONECT    3   15   15   16   17                                       
CONECT    4   14   16   16   30                                       
CONECT    5   18   21   23   23                                       
CONECT    6    7   31   32   33                                       
CONECT    7   25    8    6   34                                       
CONECT    8    7   12   12    9                                       
CONECT    9    8   20   20   35                                       
CONECT   10   11   11   20   13                                       
CONECT   11   12   10   10   36                                       
CONECT   12    8    8   11   37                                       
CONECT   13   10    1   38   39                                       
CONECT   14   22    2    2    4                                       
CONECT   15    2    3    3   40                                       
CONECT   16    4    4    3   41                                       
CONECT   17    3   18   42   43                                       
CONECT   18   26   17    5   44                                       
CONECT   19   26   24   24   21                                       
CONECT   20    9    9   10                                            
CONECT   21   19    5   45                                            
CONECT   22    1   14                                                 
CONECT   23    5    5                                                 
CONECT   24   19   19                                                 
CONECT   25    7   46                                                 
CONECT   26   18   19                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
