COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.642   0.380  -0.234  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.752   1.254  -1.072  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.816  -0.435   0.140  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.689  -1.443   1.106  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.763  -2.205   1.462  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.004  -1.988   0.866  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.146  -0.975  -0.101  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.048  -0.198  -0.463  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.465  -0.757  -0.713  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.500  -1.561  -0.327  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.297  -2.551   0.647  1.00  0.00           C  
HETATM   12  O   UNL     1      -9.236  -3.251   0.986  1.00  0.00           O  
HETATM   13  N   UNL     1      -7.096  -2.751   1.216  1.00  0.00           N  
HETATM   14  O   UNL     1      -7.646   0.205  -1.647  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.452   0.158   0.358  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.288   0.967  -0.013  1.00  0.00           C  
HETATM   17  C   UNL     1       0.973   0.192   0.272  1.00  0.00           C  
HETATM   18  O   UNL     1       0.906  -0.925   0.739  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.286   2.262   0.802  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.485   3.093   0.425  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.677   2.937   1.109  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.393   4.016  -0.600  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.777   3.700   0.764  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.493   4.779  -0.945  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.685   4.619  -0.264  1.00  0.00           C  
HETATM   26  C   UNL     1       7.530  -1.551  -0.490  1.00  0.00           C  
HETATM   27  C   UNL     1       8.195  -1.365   0.707  1.00  0.00           C  
HETATM   28  C   UNL     1       7.703  -0.470   1.641  1.00  0.00           C  
HETATM   29  C   UNL     1       6.545   0.241   1.378  1.00  0.00           C  
HETATM   30  C   UNL     1       5.878   0.059   0.183  1.00  0.00           C  
HETATM   31  C   UNL     1       6.369  -0.839  -0.756  1.00  0.00           C  
HETATM   32 CL   UNL     1       8.540  -0.240   3.144  1.00  0.00          Cl  
HETATM   33  N   UNL     1       5.693  -1.025  -1.970  1.00  0.00           N  
HETATM   34  C   UNL     1       6.036  -1.853  -2.981  1.00  0.00           C  
HETATM   35  N   UNL     1       5.135  -1.715  -3.918  1.00  0.00           N  
HETATM   36  N   UNL     1       4.246  -0.857  -3.569  1.00  0.00           N  
HETATM   37  N   UNL     1       4.510  -0.395  -2.394  1.00  0.00           N  
HETATM   38  C   UNL     1       4.617   0.833  -0.102  1.00  0.00           C  
HETATM   39  C   UNL     1       3.401  -0.011   0.285  1.00  0.00           C  
HETATM   40  N   UNL     1       2.175   0.742   0.008  1.00  0.00           N  
HETATM   41  H   UNL     1      -2.731  -1.618   1.573  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.151   0.580  -1.204  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.651  -2.978   2.207  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.996  -3.446   1.885  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.478  -1.428  -0.764  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.551   0.262  -1.983  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.366  -0.537   1.029  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.335   1.206  -1.076  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.329   2.023   1.864  1.00  0.00           H  
HETATM   50  H   UNL     1       0.625   2.822   0.591  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.748   2.219   1.912  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.461   4.142  -1.130  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.708   3.577   1.298  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.420   5.501  -1.745  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.545   5.215  -0.534  1.00  0.00           H  
HETATM   56  H   UNL     1       7.917  -2.246  -1.220  1.00  0.00           H  
HETATM   57  H   UNL     1       9.099  -1.919   0.914  1.00  0.00           H  
HETATM   58  H   UNL     1       6.163   0.939   2.108  1.00  0.00           H  
HETATM   59  H   UNL     1       6.895  -2.507  -3.010  1.00  0.00           H  
HETATM   60  H   UNL     1       4.618   1.756   0.478  1.00  0.00           H  
HETATM   61  H   UNL     1       4.570   1.072  -1.165  1.00  0.00           H  
HETATM   62  H   UNL     1       3.400  -0.934  -0.295  1.00  0.00           H  
HETATM   63  H   UNL     1       3.448  -0.250   1.347  1.00  0.00           H  
HETATM   64  H   UNL     1       2.229   1.635  -0.366  1.00  0.00           H  
CONECT    1    3    2    2   15                                       
CONECT    2    1    1                                                 
CONECT    3    1    4    8    8                                       
CONECT    4    3    5    5   41                                       
CONECT    5    4    4    6   43                                       
CONECT    6    5    7    7   13                                       
CONECT    7    8    6    6    9                                       
CONECT    8    3    3    7   42                                       
CONECT    9    7   10   10   14                                       
CONECT   10   11    9    9   45                                       
CONECT   11   13   10   12   12                                       
CONECT   12   11   11                                                 
CONECT   13    6   11   44                                            
CONECT   14    9   46                                                 
CONECT   15    1   16   47                                            
CONECT   16   15   17   19   48                                       
CONECT   17   16   18   18   40                                       
CONECT   18   17   17                                                 
CONECT   19   16   20   49   50                                       
CONECT   20   19   21   22   22                                       
CONECT   21   20   23   23   51                                       
CONECT   22   20   20   24   52                                       
CONECT   23   21   21   25   53                                       
CONECT   24   22   25   25   54                                       
CONECT   25   23   24   24   55                                       
CONECT   26   27   31   31   56                                       
CONECT   27   26   28   28   57                                       
CONECT   28   27   27   29   32                                       
CONECT   29   28   30   30   58                                       
CONECT   30   29   29   31   38                                       
CONECT   31   26   26   30   33                                       
CONECT   32   28                                                      
CONECT   33   31   34   37                                            
CONECT   34   33   35   35   59                                       
CONECT   35   34   34   36                                            
CONECT   36   35   37   37                                            
CONECT   37   33   36   36                                            
CONECT   38   30   39   60   61                                       
CONECT   39   38   40   62   63                                       
CONECT   40   17   39   64                                            
CONECT   41    4                                                      
CONECT   42    8                                                      
CONECT   43    5                                                      
CONECT   44   13                                                      
CONECT   45   10                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   29                                                      
CONECT   59   34                                                      
CONECT   60   38                                                      
CONECT   61   38                                                      
CONECT   62   39                                                      
CONECT   63   39                                                      
CONECT   64   40                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
