COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.035   2.588   2.179  1.00  0.00           N  
HETATM    2  C   UNL     1       1.412  -1.514   0.083  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.909  -0.544   0.331  1.00  0.00           C  
HETATM    4  C   UNL     1       1.880  -2.725  -0.745  1.00  0.00           C  
HETATM    5  C   UNL     1       0.713  -3.022  -1.715  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.045  -1.672  -1.766  1.00  0.00           C  
HETATM    7  C   UNL     1       2.338  -0.347  -0.144  1.00  0.00           C  
HETATM    8  C   UNL     1       2.129  -3.909   0.153  1.00  0.00           C  
HETATM    9  C   UNL     1       3.386  -4.481   0.209  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.933   1.756   2.890  1.00  0.00           C  
HETATM   11  C   UNL     1       6.222   2.758  -0.365  1.00  0.00           C  
HETATM   12  C   UNL     1       1.329  -5.509   1.744  1.00  0.00           C  
HETATM   13  C   UNL     1       5.433   2.209  -1.380  1.00  0.00           C  
HETATM   14 CL   UNL     1      -6.374  -0.264  -3.607  1.00  0.00          Cl  
HETATM   15  C   UNL     1      -6.684   1.596  -0.082  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.960   1.097  -1.341  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.011   0.356  -2.026  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.779   0.107  -1.458  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.485   0.607  -0.185  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.451   1.357   0.505  1.00  0.00           C  
HETATM   21  N   UNL     1      -5.170   1.862   1.779  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.174   0.347   0.427  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.214  -0.286  -0.278  1.00  0.00           C  
HETATM   24  N   UNL     1      -5.298   2.367   3.856  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.187   2.852   3.432  1.00  0.00           N  
HETATM   26  O   UNL     1      -0.690  -0.190   1.474  1.00  0.00           O  
HETATM   27  N   UNL     1       0.051  -1.176  -0.374  1.00  0.00           N  
HETATM   28  C   UNL     1       3.614  -5.568   1.033  1.00  0.00           C  
HETATM   29  C   UNL     1       2.586  -6.082   1.800  1.00  0.00           C  
HETATM   30  C   UNL     1       1.102  -4.419   0.924  1.00  0.00           C  
HETATM   31  O   UNL     1       2.026   0.533  -0.917  1.00  0.00           O  
HETATM   32  N   UNL     1       3.514  -0.283   0.512  1.00  0.00           N  
HETATM   33  C   UNL     1       4.421   0.735   0.218  1.00  0.00           C  
HETATM   34  C   UNL     1       4.539   1.204  -1.086  1.00  0.00           C  
HETATM   35  C   UNL     1       6.105   2.280   0.944  1.00  0.00           C  
HETATM   36  C   UNL     1       5.208   1.276   1.230  1.00  0.00           C  
HETATM   37  C   UNL     1       7.181   3.835  -0.675  1.00  0.00           C  
HETATM   38  O   UNL     1       7.870   4.308   0.207  1.00  0.00           O  
HETATM   39  O   UNL     1       7.293   4.294  -1.937  1.00  0.00           O  
HETATM   40  H   UNL     1       1.394  -1.773   1.142  1.00  0.00           H  
HETATM   41  H   UNL     1       2.783  -2.476  -1.302  1.00  0.00           H  
HETATM   42  H   UNL     1       1.091  -3.290  -2.702  1.00  0.00           H  
HETATM   43  H   UNL     1       0.075  -3.812  -1.321  1.00  0.00           H  
HETATM   44  H   UNL     1       0.443  -0.982  -2.455  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.087  -1.826  -2.049  1.00  0.00           H  
HETATM   46  H   UNL     1       4.189  -4.080  -0.390  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.889   1.260   2.966  1.00  0.00           H  
HETATM   48  H   UNL     1       0.525  -5.911   2.343  1.00  0.00           H  
HETATM   49  H   UNL     1       5.524   2.573  -2.392  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.427   2.177   0.443  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.923   1.286  -1.793  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.042  -0.472  -1.995  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.980   0.662   1.442  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.408  -0.601  -1.293  1.00  0.00           H  
HETATM   55  H   UNL     1       4.596  -6.015   1.077  1.00  0.00           H  
HETATM   56  H   UNL     1       2.763  -6.933   2.441  1.00  0.00           H  
HETATM   57  H   UNL     1       0.119  -3.972   0.880  1.00  0.00           H  
HETATM   58  H   UNL     1       3.729  -0.944   1.188  1.00  0.00           H  
HETATM   59  H   UNL     1       3.929   0.779  -1.870  1.00  0.00           H  
HETATM   60  H   UNL     1       6.716   2.700   1.730  1.00  0.00           H  
HETATM   61  H   UNL     1       5.114   0.909   2.241  1.00  0.00           H  
HETATM   62  H   UNL     1       7.935   5.001  -2.091  1.00  0.00           H  
CONECT    1   25   25   21                                            
CONECT    2    4   27    7   40                                       
CONECT    3   27   23   26   26                                       
CONECT    4    5    8    2   41                                       
CONECT    5    6    4   42   43                                       
CONECT    6    5   27   44   45                                       
CONECT    7   31   31    2   32                                       
CONECT    8   30    4    9    9                                       
CONECT    9    8    8   28   46                                       
CONECT   10   24   24   21   47                                       
CONECT   11   13   37   35   35                                       
CONECT   12   30   30   29   48                                       
CONECT   13   34   34   11   49                                       
CONECT   14   17                                                      
CONECT   15   20   20   16   50                                       
CONECT   16   15   17   17   51                                       
CONECT   17   16   16   18   14                                       
CONECT   18   19   19   17   52                                       
CONECT   19   20   22   18   18                                       
CONECT   20   21   15   15   19                                       
CONECT   21   10    1   20                                            
CONECT   22   19   23   23   53                                       
CONECT   23   22   22    3   54                                       
CONECT   24   10   10   25                                            
CONECT   25   24    1    1                                            
CONECT   26    3    3                                                 
CONECT   27    6    2    3                                            
CONECT   28   29   29    9   55                                       
CONECT   29   12   28   28   56                                       
CONECT   30   12   12    8   57                                       
CONECT   31    7    7                                                 
CONECT   32    7   33   58                                            
CONECT   33   34   32   36   36                                       
CONECT   34   13   13   33   59                                       
CONECT   35   11   11   36   60                                       
CONECT   36   33   33   35   61                                       
CONECT   37   39   11   38   38                                       
CONECT   38   37   37                                                 
CONECT   39   37   62                                                 
CONECT   40    2                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   32                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   39                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
