COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.525  -2.792   0.312  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.292  -4.156   0.366  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.361  -5.029   0.270  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.865  -3.293   0.083  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.377   1.287   0.136  1.00  0.00           C  
HETATM    6  C   UNL     1       1.939   2.346   1.048  1.00  0.00           C  
HETATM    7  C   UNL     1       3.605   0.798   0.287  1.00  0.00           C  
HETATM    8  C   UNL     1       6.530  -1.334  -0.490  1.00  0.00           C  
HETATM    9 CL   UNL     1      -6.483   0.885  -0.378  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -4.885   1.547  -0.229  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.556   2.861  -0.224  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.233   2.967  -0.091  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.707   1.757  -0.011  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.728   0.843  -0.095  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.437  -0.494  -0.036  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.148  -0.900   0.104  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.843  -2.350   0.167  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.594  -4.581   0.129  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.144  -0.008   0.182  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.326   2.187   0.224  1.00  0.00           N  
HETATM   21  C   UNL     1       0.994   1.721   0.244  1.00  0.00           C  
HETATM   22  C   UNL     1       3.241   1.888   1.067  1.00  0.00           C  
HETATM   23  N   UNL     1       4.925   0.333   0.307  1.00  0.00           N  
HETATM   24  C   UNL     1       5.090  -0.822  -0.587  1.00  0.00           C  
HETATM   25  O   UNL     1       7.432  -0.271  -0.808  1.00  0.00           O  
HETATM   26  C   UNL     1       7.300   0.871   0.043  1.00  0.00           C  
HETATM   27  C   UNL     1       5.868   1.406  -0.049  1.00  0.00           C  
HETATM   28  C   UNL     1       2.662   0.176  -0.520  1.00  0.00           C  
HETATM   29  C   UNL     1       1.360   0.635  -0.540  1.00  0.00           C  
HETATM   30  H   UNL     1       0.291  -2.088   0.384  1.00  0.00           H  
HETATM   31  H   UNL     1       0.713  -4.534   0.480  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.183  -6.093   0.312  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.888  -2.965  -0.033  1.00  0.00           H  
HETATM   34  H   UNL     1       1.656   3.194   1.654  1.00  0.00           H  
HETATM   35  H   UNL     1       6.724  -1.685   0.524  1.00  0.00           H  
HETATM   36  H   UNL     1       6.672  -2.155  -1.192  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.248   3.685  -0.313  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.231  -1.224  -0.101  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.505   3.139   0.271  1.00  0.00           H  
HETATM   40  H   UNL     1       3.977   2.377   1.689  1.00  0.00           H  
HETATM   41  H   UNL     1       4.879  -0.522  -1.613  1.00  0.00           H  
HETATM   42  H   UNL     1       4.402  -1.613  -0.290  1.00  0.00           H  
HETATM   43  H   UNL     1       7.516   0.584   1.072  1.00  0.00           H  
HETATM   44  H   UNL     1       7.999   1.644  -0.275  1.00  0.00           H  
HETATM   45  H   UNL     1       5.670   1.742  -1.067  1.00  0.00           H  
HETATM   46  H   UNL     1       5.747   2.241   0.641  1.00  0.00           H  
HETATM   47  H   UNL     1       2.945  -0.672  -1.127  1.00  0.00           H  
HETATM   48  H   UNL     1       0.625   0.148  -1.165  1.00  0.00           H  
CONECT    1   17   17    2   30                                       
CONECT    2    1    3    3   31                                       
CONECT    3    2    2   18   32                                       
CONECT    4   17   18   18   33                                       
CONECT    5   13   20   19   19                                       
CONECT    6   21   21   22   34                                       
CONECT    7   28   22   22   23                                       
CONECT    8   24   25   35   36                                       
CONECT    9   10                                                      
CONECT   10    9   11   11   14                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   13                                            
CONECT   13    5   12   12   14                                       
CONECT   14   10   13   15                                            
CONECT   15   14   16   16   38                                       
CONECT   16   15   15   19   17                                       
CONECT   17    1    1    4   16                                       
CONECT   18    3    4    4                                            
CONECT   19    5    5   16                                            
CONECT   20    5   21   39                                            
CONECT   21    6    6   20   29                                       
CONECT   22    6    7    7   40                                       
CONECT   23    7   27   24                                            
CONECT   24    8   23   41   42                                       
CONECT   25    8   26                                                 
CONECT   26   25   27   43   44                                       
CONECT   27   23   26   45   46                                       
CONECT   28    7   29   29   47                                       
CONECT   29   21   28   28   48                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   15                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
