COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.966   1.275   1.912  1.00  0.00           C  
HETATM    2  C   UNL     1       0.343   2.767  -0.474  1.00  0.00           C  
HETATM    3  C   UNL     1       2.478   3.861  -1.176  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.840  -2.174   1.131  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.992  -3.237  -0.090  1.00  0.00           C  
HETATM    6  C   UNL     1       1.355  -0.148   1.857  1.00  0.00           C  
HETATM    7  C   UNL     1       0.649  -1.508   1.793  1.00  0.00           C  
HETATM    8  C   UNL     1       2.783  -0.290   1.400  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.644  -1.280   0.994  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.678   0.219   0.665  1.00  0.00           C  
HETATM   11  C   UNL     1       1.150   1.921   0.474  1.00  0.00           C  
HETATM   12  C   UNL     1       5.154  -0.004   1.692  1.00  0.00           C  
HETATM   13  C   UNL     1       5.305  -0.714   0.374  1.00  0.00           C  
HETATM   14  C   UNL     1       6.344  -0.010   2.651  1.00  0.00           C  
HETATM   15  C   UNL     1       1.048   4.107  -0.693  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.012   3.348  -0.711  1.00  0.00           C  
HETATM   17  C   UNL     1       3.404   4.933  -0.598  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.988  -2.540   1.851  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.834  -2.869  -0.819  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.804  -3.062  -2.211  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.089  -3.789  -0.772  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.029  -2.337   3.343  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.883  -3.598  -2.843  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.027  -3.962  -2.125  1.00  0.00           C  
HETATM   25  C   UNL     1       6.827  -2.662  -1.710  1.00  0.00           C  
HETATM   26  C   UNL     1       7.137  -1.757  -2.904  1.00  0.00           C  
HETATM   27  C   UNL     1       7.203  -3.277  -3.060  1.00  0.00           C  
HETATM   28  C   UNL     1       7.865  -2.733  -0.588  1.00  0.00           C  
HETATM   29  C   UNL     1       6.847   1.735   0.780  1.00  0.00           C  
HETATM   30  C   UNL     1       6.474   2.761   0.052  1.00  0.00           C  
HETATM   31  C   UNL     1       5.175   3.459   0.366  1.00  0.00           C  
HETATM   32  C   UNL     1       4.859   4.478  -0.730  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.284   3.961  -1.107  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.520   2.756  -2.021  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.902   5.176  -1.955  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.563   4.266  -0.325  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.965  -4.653  -4.197  1.00  0.00           C  
HETATM   38  F   UNL     1      -4.539  -1.066   3.627  1.00  0.00           F  
HETATM   39  F   UNL     1      -4.851  -3.309   3.924  1.00  0.00           F  
HETATM   40  F   UNL     1      -2.736  -2.448   3.865  1.00  0.00           F  
HETATM   41  F   UNL     1      -5.912   3.155   0.450  1.00  0.00           F  
HETATM   42  F   UNL     1      -5.346   5.368   0.510  1.00  0.00           F  
HETATM   43  F   UNL     1      -6.599   4.556  -1.219  1.00  0.00           F  
HETATM   44  N   UNL     1       0.648   0.767   0.955  1.00  0.00           N  
HETATM   45  N   UNL     1       3.796  -0.023   2.268  1.00  0.00           N  
HETATM   46  N   UNL     1      -0.987   3.002   0.094  1.00  0.00           N  
HETATM   47  N   UNL     1      -2.785  -2.343  -0.174  1.00  0.00           N  
HETATM   48  N   UNL     1      -5.026  -3.056   1.236  1.00  0.00           N  
HETATM   49  N   UNL     1       5.054  -2.035   0.288  1.00  0.00           N  
HETATM   50  O   UNL     1      -1.780  -1.637   1.784  1.00  0.00           O  
HETATM   51  O   UNL     1       3.029  -0.639   0.265  1.00  0.00           O  
HETATM   52  O   UNL     1       2.260   2.280   0.807  1.00  0.00           O  
HETATM   53  O   UNL     1      -3.208   3.661  -0.179  1.00  0.00           O  
HETATM   54  O   UNL     1      -1.855   3.378  -1.915  1.00  0.00           O  
HETATM   55  O   UNL     1       5.654  -0.097  -0.610  1.00  0.00           O  
HETATM   56  O   UNL     1       4.261  -1.993  -2.012  1.00  0.00           O  
HETATM   57  O   UNL     1       4.762  -4.142  -0.894  1.00  0.00           O  
HETATM   58  O   UNL     1      -7.089  -4.496  -2.783  1.00  0.00           O  
HETATM   59  S   UNL     1       5.096  -2.792  -1.184  1.00  0.00           S  
HETATM   60  H   UNL     1       5.500   2.070   2.496  1.00  0.00           H  
HETATM   61  H   UNL     1       0.244   2.249  -1.428  1.00  0.00           H  
HETATM   62  H   UNL     1       2.810   2.878  -0.843  1.00  0.00           H  
HETATM   63  H   UNL     1       2.507   3.905  -2.264  1.00  0.00           H  
HETATM   64  H   UNL     1       1.325   0.238   2.874  1.00  0.00           H  
HETATM   65  H   UNL     1       1.281  -2.235   1.283  1.00  0.00           H  
HETATM   66  H   UNL     1       0.412  -1.855   2.798  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.626  -1.866   0.075  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.915   0.361  -0.390  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.427   0.716   1.281  1.00  0.00           H  
HETATM   70  H   UNL     1       7.247  -0.528   2.329  1.00  0.00           H  
HETATM   71  H   UNL     1       6.129  -0.058   3.719  1.00  0.00           H  
HETATM   72  H   UNL     1       0.506   4.684  -1.443  1.00  0.00           H  
HETATM   73  H   UNL     1       1.071   4.662   0.245  1.00  0.00           H  
HETATM   74  H   UNL     1       3.265   5.866  -1.145  1.00  0.00           H  
HETATM   75  H   UNL     1       3.167   5.090   0.454  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.928  -2.784  -2.778  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.977  -4.074  -0.228  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.856  -3.744  -3.912  1.00  0.00           H  
HETATM   79  H   UNL     1       6.301  -1.238  -3.373  1.00  0.00           H  
HETATM   80  H   UNL     1       8.080  -1.211  -2.890  1.00  0.00           H  
HETATM   81  H   UNL     1       8.189  -3.732  -3.148  1.00  0.00           H  
HETATM   82  H   UNL     1       6.410  -3.759  -3.632  1.00  0.00           H  
HETATM   83  H   UNL     1       8.771  -2.213  -0.899  1.00  0.00           H  
HETATM   84  H   UNL     1       7.464  -2.259   0.308  1.00  0.00           H  
HETATM   85  H   UNL     1       8.098  -3.776  -0.375  1.00  0.00           H  
HETATM   86  H   UNL     1       7.773   1.227   0.568  1.00  0.00           H  
HETATM   87  H   UNL     1       7.092   3.100  -0.764  1.00  0.00           H  
HETATM   88  H   UNL     1       4.373   2.724   0.420  1.00  0.00           H  
HETATM   89  H   UNL     1       5.261   3.972   1.324  1.00  0.00           H  
HETATM   90  H   UNL     1       5.009   4.019  -1.707  1.00  0.00           H  
HETATM   91  H   UNL     1       5.520   5.339  -0.627  1.00  0.00           H  
HETATM   92  H   UNL     1      -4.872   1.913  -1.426  1.00  0.00           H  
HETATM   93  H   UNL     1      -5.270   3.010  -2.770  1.00  0.00           H  
HETATM   94  H   UNL     1      -3.588   2.487  -2.516  1.00  0.00           H  
HETATM   95  H   UNL     1      -2.991   4.958  -2.512  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.709   5.401  -2.651  1.00  0.00           H  
HETATM   97  H   UNL     1      -3.733   6.034  -1.304  1.00  0.00           H  
HETATM   98  H   UNL     1      -6.795  -3.680  -4.657  1.00  0.00           H  
HETATM   99  H   UNL     1      -6.124  -5.311  -4.417  1.00  0.00           H  
HETATM  100  H   UNL     1      -7.880  -5.089  -4.597  1.00  0.00           H  
HETATM  101  H   UNL     1       3.635   0.144   3.210  1.00  0.00           H  
HETATM  102  H   UNL     1      -1.130   2.908   1.048  1.00  0.00           H  
HETATM  103  H   UNL     1       4.848  -2.543   1.089  1.00  0.00           H  
CONECT    1   14   12   29   60                                       
CONECT    2   46   11   15   61                                       
CONECT    3   15   17   62   63                                       
CONECT    4   18   50   47   47                                       
CONECT    5   48   21   21   19                                       
CONECT    6    8   44    7   64                                       
CONECT    7    6    9   65   66                                       
CONECT    8   45    6   51   51                                       
CONECT    9   50    7   10   67                                       
CONECT   10   44    9   68   69                                       
CONECT   11   52   52    2   44                                       
CONECT   12   14    1   45   13                                       
CONECT   13   12   55   55   49                                       
CONECT   14    1   12   70   71                                       
CONECT   15    2    3   72   73                                       
CONECT   16   53   46   54   54                                       
CONECT   17   32    3   74   75                                       
CONECT   18   22   48   48    4                                       
CONECT   19    5   47   20   20                                       
CONECT   20   19   19   23   76                                       
CONECT   21    5    5   24   77                                       
CONECT   22   39   40   38   18                                       
CONECT   23   24   24   20   78                                       
CONECT   24   21   58   23   23                                       
CONECT   25   59   26   27   28                                       
CONECT   26   25   27   79   80                                       
CONECT   27   26   25   81   82                                       
CONECT   28   25   83   84   85                                       
CONECT   29    1   30   30   86                                       
CONECT   30   29   29   31   87                                       
CONECT   31   30   32   88   89                                       
CONECT   32   31   17   90   91                                       
CONECT   33   36   35   53   34                                       
CONECT   34   33   92   93   94                                       
CONECT   35   33   95   96   97                                       
CONECT   36   41   43   42   33                                       
CONECT   37   58   98   99  100                                       
CONECT   38   22                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   36                                                      
CONECT   42   36                                                      
CONECT   43   36                                                      
CONECT   44   11    6   10                                            
CONECT   45   12    8  101                                            
CONECT   46   16    2  102                                            
CONECT   47    4    4   19                                            
CONECT   48   18   18    5                                            
CONECT   49   13   59  103                                            
CONECT   50    4    9                                                 
CONECT   51    8    8                                                 
CONECT   52   11   11                                                 
CONECT   53   33   16                                                 
CONECT   54   16   16                                                 
CONECT   55   13   13                                                 
CONECT   56   59   59                                                 
CONECT   57   59   59                                                 
CONECT   58   24   37                                                 
CONECT   59   56   56   49   57                                       
CONECT   59   57   25                                                 
CONECT   60    1                                                      
CONECT   61    2                                                      
CONECT   62    3                                                      
CONECT   63    3                                                      
CONECT   64    6                                                      
CONECT   65    7                                                      
CONECT   66    7                                                      
CONECT   67    9                                                      
CONECT   68   10                                                      
CONECT   69   10                                                      
CONECT   70   14                                                      
CONECT   71   14                                                      
CONECT   72   15                                                      
CONECT   73   15                                                      
CONECT   74   17                                                      
CONECT   75   17                                                      
CONECT   76   20                                                      
CONECT   77   21                                                      
CONECT   78   23                                                      
CONECT   79   26                                                      
CONECT   80   26                                                      
CONECT   81   27                                                      
CONECT   82   27                                                      
CONECT   83   28                                                      
CONECT   84   28                                                      
CONECT   85   28                                                      
CONECT   86   29                                                      
CONECT   87   30                                                      
CONECT   88   31                                                      
CONECT   89   31                                                      
CONECT   90   32                                                      
CONECT   91   32                                                      
CONECT   92   34                                                      
CONECT   93   34                                                      
CONECT   94   34                                                      
CONECT   95   35                                                      
CONECT   96   35                                                      
CONECT   97   35                                                      
CONECT   98   37                                                      
CONECT   99   37                                                      
CONECT  100   37                                                      
CONECT  101   45                                                      
CONECT  102   46                                                      
CONECT  103   49                                                      
MASTER        0    0    0    0    0    0    0    0  103    0  103    0
END
