COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.180   0.897  -0.251  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.542   1.925  -0.944  1.00  0.00           C  
HETATM    3  C   UNL     1       0.816   1.819  -1.179  1.00  0.00           C  
HETATM    4  N   UNL     1       1.467   0.751  -0.743  1.00  0.00           N  
HETATM    5  N   UNL     1      -0.465  -0.142   0.163  1.00  0.00           N  
HETATM    6  C   UNL     1      -7.573  -0.067  -0.229  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.472  -1.316  -0.175  1.00  0.00           C  
HETATM    8  O   UNL     1      -8.468  -2.081  -1.381  1.00  0.00           O  
HETATM    9  C   UNL     1      -7.506  -1.844   0.901  1.00  0.00           C  
HETATM   10  N   UNL     1      -6.501  -0.938   0.301  1.00  0.00           N  
HETATM   11  C   UNL     1      -5.728  -0.248   1.342  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.563   0.470   0.710  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.285   0.031   0.671  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.616   1.706   0.054  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.849   2.549  -0.142  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.412   2.004  -0.361  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.550   0.963   0.009  1.00  0.00           N  
HETATM   18  C   UNL     1       0.834  -0.210  -0.086  1.00  0.00           C  
HETATM   19  N   UNL     1       1.549  -1.311   0.354  1.00  0.00           N  
HETATM   20  C   UNL     1       2.942  -1.345   0.209  1.00  0.00           C  
HETATM   21  C   UNL     1       3.672  -0.177   0.309  1.00  0.00           C  
HETATM   22  C   UNL     1       5.063  -0.221   0.163  1.00  0.00           C  
HETATM   23  C   UNL     1       6.117   0.788   0.206  1.00  0.00           C  
HETATM   24 CL   UNL     1       5.897   2.488   0.479  1.00  0.00          Cl  
HETATM   25  N   UNL     1       7.254   0.185   0.001  1.00  0.00           N  
HETATM   26  N   UNL     1       7.044  -1.186  -0.180  1.00  0.00           N  
HETATM   27  C   UNL     1       8.090  -2.180  -0.433  1.00  0.00           C  
HETATM   28  C   UNL     1       5.701  -1.451  -0.084  1.00  0.00           C  
HETATM   29  C   UNL     1       4.941  -2.614  -0.180  1.00  0.00           C  
HETATM   30  C   UNL     1       3.585  -2.560  -0.030  1.00  0.00           C  
HETATM   31  H   UNL     1      -1.097   2.785  -1.290  1.00  0.00           H  
HETATM   32  H   UNL     1       1.341   2.597  -1.713  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.385   0.295  -1.240  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.878   0.724   0.456  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.477  -1.116   0.198  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.032  -2.866  -1.352  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.790  -1.573   1.918  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.266  -2.902   0.794  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.367   0.475   1.850  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.358  -0.976   2.063  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.915  -0.893   1.090  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.960   3.232   0.700  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.756   3.122  -1.064  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.725   1.903  -0.203  1.00  0.00           H  
HETATM   45  H   UNL     1       1.086  -2.058   0.763  1.00  0.00           H  
HETATM   46  H   UNL     1       3.173   0.762   0.498  1.00  0.00           H  
HETATM   47  H   UNL     1       8.452  -2.576   0.516  1.00  0.00           H  
HETATM   48  H   UNL     1       7.682  -2.993  -1.034  1.00  0.00           H  
HETATM   49  H   UNL     1       8.915  -1.711  -0.970  1.00  0.00           H  
HETATM   50  H   UNL     1       5.425  -3.560  -0.369  1.00  0.00           H  
HETATM   51  H   UNL     1       3.004  -3.467  -0.101  1.00  0.00           H  
CONECT    1    5    5    2   17                                       
CONECT    2    3    3    1   31                                       
CONECT    3    4    2    2   32                                       
CONECT    4   18   18    3                                            
CONECT    5   18    1    1                                            
CONECT    6   10    7   33   34                                       
CONECT    7    9    6    8   35                                       
CONECT    8    7   36                                                 
CONECT    9   10    7   37   38                                       
CONECT   10   11    9    6                                            
CONECT   11   12   10   39   40                                       
CONECT   12   13   13   14   11                                       
CONECT   13   17   12   12   41                                       
CONECT   14   16   16   12   15                                       
CONECT   15   14   42   43   44                                       
CONECT   16   17   14   14                                            
CONECT   17    1   13   16                                            
CONECT   18   19    4    4    5                                       
CONECT   19   20   18   45                                            
CONECT   20   21   21   19   30                                       
CONECT   21   20   20   22   46                                       
CONECT   22   21   23   28   28                                       
CONECT   23   24   22   25   25                                       
CONECT   24   23                                                      
CONECT   25   23   23   26                                            
CONECT   26   25   28   27                                            
CONECT   27   26   47   48   49                                       
CONECT   28   22   22   26   29                                       
CONECT   29   30   30   28   50                                       
CONECT   30   20   29   29   51                                       
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
