COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.637   1.975   1.032  1.00  0.00           N  
HETATM    2  C   UNL     1       4.266   0.647   0.527  1.00  0.00           C  
HETATM    3  C   UNL     1       5.246   0.226  -0.569  1.00  0.00           C  
HETATM    4  C   UNL     1       6.642   0.054   0.033  1.00  0.00           C  
HETATM    5  C   UNL     1       6.628  -1.106   1.031  1.00  0.00           C  
HETATM    6  C   UNL     1       7.645  -0.245  -1.082  1.00  0.00           C  
HETATM    7  C   UNL     1       2.870   0.697  -0.038  1.00  0.00           C  
HETATM    8  O   UNL     1       2.383   1.760  -0.360  1.00  0.00           O  
HETATM    9  N   UNL     1       2.162  -0.441  -0.187  1.00  0.00           N  
HETATM   10  C   UNL     1       0.794  -0.535  -0.719  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.153   0.234   0.166  1.00  0.00           C  
HETATM   12  O   UNL     1       0.266   0.809   1.148  1.00  0.00           O  
HETATM   13  C   UNL     1       0.410  -2.030  -0.730  1.00  0.00           C  
HETATM   14  C   UNL     1       1.787  -2.745  -0.726  1.00  0.00           C  
HETATM   15  C   UNL     1       2.629  -1.795   0.161  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.466   0.282  -0.135  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.387   1.030   0.725  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.786   0.926   0.172  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.242   1.866  -0.733  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.523   1.770  -1.244  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.352   0.739  -0.842  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.897  -0.199   0.067  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.613  -0.105   0.575  1.00  0.00           C  
HETATM   24 CL   UNL     1      -6.937  -1.495   0.572  1.00  0.00          Cl  
HETATM   25  H   UNL     1       4.611   2.663   0.294  1.00  0.00           H  
HETATM   26  H   UNL     1       4.044   2.249   1.801  1.00  0.00           H  
HETATM   27  H   UNL     1       4.301  -0.075   1.344  1.00  0.00           H  
HETATM   28  H   UNL     1       4.919  -0.719  -1.005  1.00  0.00           H  
HETATM   29  H   UNL     1       5.276   0.992  -1.344  1.00  0.00           H  
HETATM   30  H   UNL     1       6.931   0.971   0.546  1.00  0.00           H  
HETATM   31  H   UNL     1       6.338  -2.023   0.518  1.00  0.00           H  
HETATM   32  H   UNL     1       7.622  -1.228   1.460  1.00  0.00           H  
HETATM   33  H   UNL     1       5.913  -0.893   1.826  1.00  0.00           H  
HETATM   34  H   UNL     1       7.655   0.581  -1.793  1.00  0.00           H  
HETATM   35  H   UNL     1       8.640  -0.367  -0.653  1.00  0.00           H  
HETATM   36  H   UNL     1       7.356  -1.162  -1.595  1.00  0.00           H  
HETATM   37  H   UNL     1       0.762  -0.139  -1.733  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.152  -2.279  -1.630  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.159  -2.285   0.164  1.00  0.00           H  
HETATM   40  H   UNL     1       2.198  -2.805  -1.734  1.00  0.00           H  
HETATM   41  H   UNL     1       1.712  -3.735  -0.277  1.00  0.00           H  
HETATM   42  H   UNL     1       3.689  -1.902  -0.068  1.00  0.00           H  
HETATM   43  H   UNL     1       2.445  -2.000   1.216  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.801  -0.178  -0.920  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.363   0.613   1.732  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.086   2.076   0.757  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.597   2.675  -1.044  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.878   2.502  -1.954  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.354   0.665  -1.238  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.258  -0.837   1.284  1.00  0.00           H  
CONECT    1    2   25   26                                            
CONECT    2    3    1    7   27                                       
CONECT    3    2    4   28   29                                       
CONECT    4    3    5    6   30                                       
CONECT    5    4   31   32   33                                       
CONECT    6    4   34   35   36                                       
CONECT    7    2    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   15   10                                            
CONECT   10    9   13   11   37                                       
CONECT   11   10   16   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   14   10   38   39                                       
CONECT   14   15   13   40   41                                       
CONECT   15    9   14   42   43                                       
CONECT   16   11   17   44                                            
CONECT   17   16   18   45   46                                       
CONECT   18   17   23   23   19                                       
CONECT   19   18   20   20   47                                       
CONECT   20   21   19   19   48                                       
CONECT   21   22   22   20   49                                       
CONECT   22   23   21   21   24                                       
CONECT   23   18   18   22   50                                       
CONECT   24   22                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37   10                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
