COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.205   1.385  -0.633  1.00  0.00           O  
HETATM    2  O   UNL     1       3.918  -1.310   1.030  1.00  0.00           O  
HETATM    3  N   UNL     1      -3.101   1.406  -0.265  1.00  0.00           N  
HETATM    4  N   UNL     1       2.711  -1.223   1.114  1.00  0.00           N  
HETATM    5  N   UNL     1       8.066  -0.742   0.045  1.00  0.00           N  
HETATM    6  N   UNL     1       6.129   0.851  -0.993  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.333  -2.613  -1.725  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.705  -3.476  -0.841  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.913  -2.974   0.171  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.740  -1.602   0.307  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.365  -0.724  -0.587  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.170  -1.251  -1.606  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.194   0.725  -0.489  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.796   0.975  -0.083  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.776   1.649  -0.756  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.153  -0.493   0.891  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.473  -0.098   0.741  1.00  0.00           C  
HETATM   18  C   UNL     1       2.274  -0.236   0.374  1.00  0.00           C  
HETATM   19  C   UNL     1       4.388  -0.361   0.206  1.00  0.00           C  
HETATM   20  C   UNL     1       5.804  -0.133  -0.158  1.00  0.00           C  
HETATM   21  C   UNL     1       0.537   1.260  -0.609  1.00  0.00           C  
HETATM   22  C   UNL     1       0.860   0.185   0.216  1.00  0.00           C  
HETATM   23  S   UNL     1      -2.734  -0.972   1.607  1.00  0.00           S  
HETATM   24  N   UNL     1       3.348   0.329  -0.218  1.00  0.00           N  
HETATM   25  C   UNL     1       7.392   1.050  -1.314  1.00  0.00           C  
HETATM   26  C   UNL     1       8.382   0.237  -0.784  1.00  0.00           C  
HETATM   27  C   UNL     1       6.804  -0.949   0.373  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.284   2.858  -0.203  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.411   3.391   0.684  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.953   3.556   1.118  1.00  0.00           C  
HETATM   31  H   UNL     1      -5.954  -3.011  -2.514  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.836  -4.543  -0.945  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.426  -3.649   0.860  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.663  -0.587  -2.300  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.019   2.483  -1.397  1.00  0.00           H  
HETATM   36  H   UNL     1       0.091  -1.327   1.531  1.00  0.00           H  
HETATM   37  H   UNL     1       1.318   1.790  -1.135  1.00  0.00           H  
HETATM   38  H   UNL     1       7.656   1.849  -1.992  1.00  0.00           H  
HETATM   39  H   UNL     1       9.415   0.404  -1.051  1.00  0.00           H  
HETATM   40  H   UNL     1       6.545  -1.750   1.051  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.070   3.398  -1.125  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.939   4.282   0.345  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.016   2.661   1.221  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.599   2.934   1.940  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.522   4.556   1.064  1.00  0.00           H  
CONECT    1   13   13                                                 
CONECT    2    4   19                                                 
CONECT    3   14   28   13                                            
CONECT    4    2   18   18                                            
CONECT    5   26   26   27                                            
CONECT    6   25   25   20                                            
CONECT    7   12   12    8   31                                       
CONECT    8    7    9    9   32                                       
CONECT    9    8    8   10   33                                       
CONECT   10   11   11    9   23                                       
CONECT   11   12   13   10   10                                       
CONECT   12    7    7   11   34                                       
CONECT   13    3   11    1    1                                       
CONECT   14   15    3   17   17                                       
CONECT   15   21   21   14   35                                       
CONECT   16   22   22   17   36                                       
CONECT   17   16   14   14   23                                       
CONECT   18    4    4   24   22                                       
CONECT   19    2   20   24   24                                       
CONECT   20    6   19   27   27                                       
CONECT   21   15   15   22   37                                       
CONECT   22   18   21   16   16                                       
CONECT   23   17   10                                                 
CONECT   24   19   19   18                                            
CONECT   25    6    6   26   38                                       
CONECT   26   25    5    5   39                                       
CONECT   27   20   20    5   40                                       
CONECT   28    3   30   29   41                                       
CONECT   29   28   30   42   43                                       
CONECT   30   28   29   44   45                                       
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   21                                                      
CONECT   38   25                                                      
CONECT   39   26                                                      
CONECT   40   27                                                      
CONECT   41   28                                                      
CONECT   42   29                                                      
CONECT   43   29                                                      
CONECT   44   30                                                      
CONECT   45   30                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
