COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.980  -0.534  -0.857  1.00  0.00           C  
HETATM    2  C   UNL     1       7.148   0.382  -0.424  1.00  0.00           C  
HETATM    3  C   UNL     1       8.381  -0.456  -0.077  1.00  0.00           C  
HETATM    4  C   UNL     1       5.278   1.394   0.458  1.00  0.00           C  
HETATM    5  C   UNL     1       4.732   0.150  -0.267  1.00  0.00           C  
HETATM    6  C   UNL     1       3.777   0.564  -1.380  1.00  0.00           C  
HETATM    7  C   UNL     1       2.574   1.294  -0.772  1.00  0.00           C  
HETATM    8  C   UNL     1       0.641   0.119   0.232  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.258  -0.313  -1.005  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.921  -0.443  -2.353  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.352  -0.842   0.010  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.310   0.164  -0.017  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.650  -0.163  -0.122  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.036  -1.489  -0.200  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.083  -2.492  -0.172  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.743  -2.172  -0.074  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.060  -0.083   1.410  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.420  -0.410   1.332  1.00  0.00           C  
HETATM   19  C   UNL     1       2.842  -0.060   1.349  1.00  0.00           C  
HETATM   20  C   UNL     1       4.044  -0.780   0.726  1.00  0.00           C  
HETATM   21  N   UNL     1       6.144  -1.881  -0.293  1.00  0.00           N  
HETATM   22  N   UNL     1       1.982   0.442   0.268  1.00  0.00           N  
HETATM   23  N   UNL     1       0.009  -0.008  -0.946  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.994  -0.515   0.115  1.00  0.00           N  
HETATM   25  O   UNL     1       6.663   1.072   0.748  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.073  -0.595   2.346  1.00  0.00           O  
HETATM   27 CL   UNL     1      -3.826   1.828   0.081  1.00  0.00          Cl  
HETATM   28 CL   UNL     1      -6.849   1.092  -0.156  1.00  0.00          Cl  
HETATM   29  H   UNL     1       5.912  -0.581  -1.944  1.00  0.00           H  
HETATM   30  H   UNL     1       7.384   1.094  -1.215  1.00  0.00           H  
HETATM   31  H   UNL     1       8.686  -1.033  -0.951  1.00  0.00           H  
HETATM   32  H   UNL     1       9.194   0.203   0.225  1.00  0.00           H  
HETATM   33  H   UNL     1       8.140  -1.135   0.741  1.00  0.00           H  
HETATM   34  H   UNL     1       5.222   2.267  -0.191  1.00  0.00           H  
HETATM   35  H   UNL     1       4.724   1.570   1.380  1.00  0.00           H  
HETATM   36  H   UNL     1       4.293   1.229  -2.073  1.00  0.00           H  
HETATM   37  H   UNL     1       3.434  -0.322  -1.913  1.00  0.00           H  
HETATM   38  H   UNL     1       2.901   2.235  -0.331  1.00  0.00           H  
HETATM   39  H   UNL     1       1.834   1.490  -1.549  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.189  -0.249  -3.137  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.317  -1.452  -2.467  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.735   0.277  -2.428  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.082  -1.742  -0.281  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.387  -3.526  -0.237  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.001  -2.956  -0.053  1.00  0.00           H  
HETATM   46  H   UNL     1       0.432   0.010   2.367  1.00  0.00           H  
HETATM   47  H   UNL     1       2.280  -0.757   1.970  1.00  0.00           H  
HETATM   48  H   UNL     1       3.191   0.774   1.958  1.00  0.00           H  
HETATM   49  H   UNL     1       3.702  -1.676   0.208  1.00  0.00           H  
HETATM   50  H   UNL     1       4.747  -1.059   1.511  1.00  0.00           H  
HETATM   51  H   UNL     1       6.978  -2.323  -0.651  1.00  0.00           H  
HETATM   52  H   UNL     1       6.154  -1.852   0.715  1.00  0.00           H  
CONECT    1    2    5   21   29                                       
CONECT    2   25    1    3   30                                       
CONECT    3    2   31   32   33                                       
CONECT    4   25    5   34   35                                       
CONECT    5    6    4    1   20                                       
CONECT    6    7    5   36   37                                       
CONECT    7    6   22   38   39                                       
CONECT    8   23   22   17   17                                       
CONECT    9   10   23   23   24                                       
CONECT   10    9   40   41   42                                       
CONECT   11   16   12   12   24                                       
CONECT   12   11   11   13   27                                       
CONECT   13   14   14   12   28                                       
CONECT   14   15   13   13   43                                       
CONECT   15   16   16   14   44                                       
CONECT   16   15   15   11   45                                       
CONECT   17    8    8   18   46                                       
CONECT   18   24   17   26   26                                       
CONECT   19   22   20   47   48                                       
CONECT   20    5   19   49   50                                       
CONECT   21    1   51   52                                            
CONECT   22    7    8   19                                            
CONECT   23    9    9    8                                            
CONECT   24    9   11   18                                            
CONECT   25    2    4                                                 
CONECT   26   18   18                                                 
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
