COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.656   2.886  -0.841  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.072   1.582  -1.399  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.659   1.411  -0.846  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.105   0.031  -1.210  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.940  -0.062  -2.727  1.00  0.00           C  
HETATM    6  O   UNL     1      -2.780   2.434  -1.390  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.761   2.834  -0.609  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.637   2.363   0.505  1.00  0.00           O  
HETATM    9  C   UNL     1      -0.783   3.831  -1.074  1.00  0.00           C  
HETATM   10  C   UNL     1       0.182   4.208  -0.242  1.00  0.00           C  
HETATM   11  C   UNL     1       1.246   5.198  -0.613  1.00  0.00           C  
HETATM   12  C   UNL     1       1.593   5.109  -2.096  1.00  0.00           C  
HETATM   13  C   UNL     1       2.496   5.004   0.239  1.00  0.00           C  
HETATM   14  O   UNL     1       2.156   5.152   1.622  1.00  0.00           O  
HETATM   15  C   UNL     1       3.138   3.630   0.032  1.00  0.00           C  
HETATM   16  C   UNL     1       2.578   2.668   1.091  1.00  0.00           C  
HETATM   17  C   UNL     1       4.627   3.748   0.221  1.00  0.00           C  
HETATM   18  O   UNL     1       5.073   4.732   0.774  1.00  0.00           O  
HETATM   19  C   UNL     1       5.596   2.685  -0.244  1.00  0.00           C  
HETATM   20  C   UNL     1       4.905   1.731  -1.209  1.00  0.00           C  
HETATM   21  C   UNL     1       6.226   2.010   0.959  1.00  0.00           C  
HETATM   22  O   UNL     1       5.271   1.853   2.014  1.00  0.00           O  
HETATM   23  C   UNL     1       6.924   0.687   0.691  1.00  0.00           C  
HETATM   24  C   UNL     1       7.848   0.779  -0.518  1.00  0.00           C  
HETATM   25  C   UNL     1       5.964  -0.458   0.602  1.00  0.00           C  
HETATM   26  O   UNL     1       4.777  -0.278   0.791  1.00  0.00           O  
HETATM   27  C   UNL     1       6.413  -1.876   0.330  1.00  0.00           C  
HETATM   28  C   UNL     1       7.385  -2.304   1.434  1.00  0.00           C  
HETATM   29  O   UNL     1       7.062  -1.954  -0.938  1.00  0.00           O  
HETATM   30  C   UNL     1       5.180  -2.780   0.333  1.00  0.00           C  
HETATM   31  O   UNL     1       4.266  -2.335  -0.675  1.00  0.00           O  
HETATM   32  C   UNL     1       5.544  -4.237   0.060  1.00  0.00           C  
HETATM   33  C   UNL     1       5.525  -4.502  -1.448  1.00  0.00           C  
HETATM   34  C   UNL     1       4.513  -5.144   0.745  1.00  0.00           C  
HETATM   35  C   UNL     1       3.236  -5.174  -0.053  1.00  0.00           C  
HETATM   36  C   UNL     1       2.147  -4.558   0.400  1.00  0.00           C  
HETATM   37  C   UNL     1       0.911  -4.562  -0.403  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.147  -3.895   0.031  1.00  0.00           C  
HETATM   39  C   UNL     1      -1.428  -3.818  -0.767  1.00  0.00           C  
HETATM   40  C   UNL     1      -1.088  -3.546  -2.231  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.242  -2.275  -2.332  1.00  0.00           C  
HETATM   42  C   UNL     1      -2.270  -2.674  -0.197  1.00  0.00           C  
HETATM   43  O   UNL     1      -2.617  -2.993   1.158  1.00  0.00           O  
HETATM   44  C   UNL     1      -3.549  -2.444  -0.994  1.00  0.00           C  
HETATM   45  C   UNL     1      -4.076  -1.037  -0.709  1.00  0.00           C  
HETATM   46  O   UNL     1      -5.342  -0.831  -1.339  1.00  0.00           O  
HETATM   47  C   UNL     1      -5.956   0.410  -0.970  1.00  0.00           C  
HETATM   48  O   UNL     1      -6.140   0.442   0.448  1.00  0.00           O  
HETATM   49  C   UNL     1      -7.323   0.499  -1.651  1.00  0.00           C  
HETATM   50  C   UNL     1      -8.207  -0.654  -1.173  1.00  0.00           C  
HETATM   51  C   UNL     1      -8.284  -0.685   0.352  1.00  0.00           C  
HETATM   52  C   UNL     1      -9.083   0.517   0.859  1.00  0.00           C  
HETATM   53  C   UNL     1      -6.884  -0.665   0.962  1.00  0.00           C  
HETATM   54  C   UNL     1      -6.992  -0.538   2.484  1.00  0.00           C  
HETATM   55  C   UNL     1      -5.600  -0.658   3.106  1.00  0.00           C  
HETATM   56  C   UNL     1      -5.691  -0.407   4.613  1.00  0.00           C  
HETATM   57  O   UNL     1      -5.085  -1.971   2.873  1.00  0.00           O  
HETATM   58  H   UNL     1      -5.690   2.833   0.247  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.029   3.724  -1.145  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.665   3.028  -1.230  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.043   1.643  -2.486  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.688   1.511   0.241  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.133  -0.097  -0.732  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.907   0.088  -3.208  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.244   0.707  -3.065  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.551  -1.045  -2.991  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.871   4.247  -2.064  1.00  0.00           H  
HETATM   68  H   UNL     1       0.186   3.775   0.755  1.00  0.00           H  
HETATM   69  H   UNL     1       0.853   6.212  -0.420  1.00  0.00           H  
HETATM   70  H   UNL     1       0.703   5.317  -2.691  1.00  0.00           H  
HETATM   71  H   UNL     1       2.367   5.839  -2.333  1.00  0.00           H  
HETATM   72  H   UNL     1       1.956   4.107  -2.325  1.00  0.00           H  
HETATM   73  H   UNL     1       3.228   5.776  -0.024  1.00  0.00           H  
HETATM   74  H   UNL     1       1.788   6.018   1.846  1.00  0.00           H  
HETATM   75  H   UNL     1       2.905   3.253  -0.956  1.00  0.00           H  
HETATM   76  H   UNL     1       1.496   2.595   0.980  1.00  0.00           H  
HETATM   77  H   UNL     1       3.024   1.683   0.959  1.00  0.00           H  
HETATM   78  H   UNL     1       2.816   3.045   2.086  1.00  0.00           H  
HETATM   79  H   UNL     1       6.394   3.210  -0.804  1.00  0.00           H  
HETATM   80  H   UNL     1       4.489   2.296  -2.043  1.00  0.00           H  
HETATM   81  H   UNL     1       5.628   1.007  -1.584  1.00  0.00           H  
HETATM   82  H   UNL     1       4.103   1.207  -0.689  1.00  0.00           H  
HETATM   83  H   UNL     1       7.001   2.704   1.357  1.00  0.00           H  
HETATM   84  H   UNL     1       4.898   2.686   2.333  1.00  0.00           H  
HETATM   85  H   UNL     1       7.580   0.490   1.571  1.00  0.00           H  
HETATM   86  H   UNL     1       8.443   1.690  -0.453  1.00  0.00           H  
HETATM   87  H   UNL     1       8.510  -0.087  -0.536  1.00  0.00           H  
HETATM   88  H   UNL     1       7.252   0.799  -1.431  1.00  0.00           H  
HETATM   89  H   UNL     1       7.698  -3.334   1.263  1.00  0.00           H  
HETATM   90  H   UNL     1       8.259  -1.652   1.421  1.00  0.00           H  
HETATM   91  H   UNL     1       6.891  -2.229   2.402  1.00  0.00           H  
HETATM   92  H   UNL     1       7.923  -1.515  -0.967  1.00  0.00           H  
HETATM   93  H   UNL     1       4.686  -2.711   1.307  1.00  0.00           H  
HETATM   94  H   UNL     1       3.457  -2.862  -0.733  1.00  0.00           H  
HETATM   95  H   UNL     1       6.529  -4.476   0.452  1.00  0.00           H  
HETATM   96  H   UNL     1       4.532  -4.290  -1.842  1.00  0.00           H  
HETATM   97  H   UNL     1       6.256  -3.860  -1.939  1.00  0.00           H  
HETATM   98  H   UNL     1       5.775  -5.547  -1.636  1.00  0.00           H  
HETATM   99  H   UNL     1       4.920  -6.151   0.828  1.00  0.00           H  
HETATM  100  H   UNL     1       4.310  -4.756   1.745  1.00  0.00           H  
HETATM  101  H   UNL     1       3.189  -5.706  -0.991  1.00  0.00           H  
HETATM  102  H   UNL     1       2.164  -4.060   1.355  1.00  0.00           H  
HETATM  103  H   UNL     1       0.892  -5.115  -1.331  1.00  0.00           H  
HETATM  104  H   UNL     1      -0.096  -3.389   0.990  1.00  0.00           H  
HETATM  105  H   UNL     1      -1.970  -4.756  -0.681  1.00  0.00           H  
HETATM  106  H   UNL     1      -0.527  -4.389  -2.636  1.00  0.00           H  
HETATM  107  H   UNL     1      -2.009  -3.416  -2.800  1.00  0.00           H  
HETATM  108  H   UNL     1      -0.762  -1.453  -1.838  1.00  0.00           H  
HETATM  109  H   UNL     1       0.720  -2.440  -1.847  1.00  0.00           H  
HETATM  110  H   UNL     1      -0.083  -2.027  -3.381  1.00  0.00           H  
HETATM  111  H   UNL     1      -1.668  -1.764  -0.199  1.00  0.00           H  
HETATM  112  H   UNL     1      -3.154  -2.318   1.595  1.00  0.00           H  
HETATM  113  H   UNL     1      -3.403  -2.581  -2.056  1.00  0.00           H  
HETATM  114  H   UNL     1      -4.302  -3.174  -0.663  1.00  0.00           H  
HETATM  115  H   UNL     1      -4.202  -0.926   0.375  1.00  0.00           H  
HETATM  116  H   UNL     1      -7.803   1.447  -1.422  1.00  0.00           H  
HETATM  117  H   UNL     1      -7.190   0.421  -2.731  1.00  0.00           H  
HETATM  118  H   UNL     1      -9.212  -0.525  -1.584  1.00  0.00           H  
HETATM  119  H   UNL     1      -7.794  -1.598  -1.530  1.00  0.00           H  
HETATM  120  H   UNL     1      -8.789  -1.603   0.663  1.00  0.00           H  
HETATM  121  H   UNL     1     -10.092   0.482   0.447  1.00  0.00           H  
HETATM  122  H   UNL     1      -9.134   0.488   1.947  1.00  0.00           H  
HETATM  123  H   UNL     1      -8.594   1.438   0.542  1.00  0.00           H  
HETATM  124  H   UNL     1      -6.371  -1.595   0.715  1.00  0.00           H  
HETATM  125  H   UNL     1      -7.421   0.432   2.738  1.00  0.00           H  
HETATM  126  H   UNL     1      -7.633  -1.331   2.870  1.00  0.00           H  
HETATM  127  H   UNL     1      -4.935   0.078   2.655  1.00  0.00           H  
HETATM  128  H   UNL     1      -4.699  -0.493   5.056  1.00  0.00           H  
HETATM  129  H   UNL     1      -6.083   0.594   4.791  1.00  0.00           H  
HETATM  130  H   UNL     1      -6.355  -1.143   5.064  1.00  0.00           H  
HETATM  131  H   UNL     1      -4.203  -2.119   3.240  1.00  0.00           H  
CONECT    1    2   58   59   60                                       
CONECT    2    3   47    1   61                                       
CONECT    3    4    6    2   62                                       
CONECT    4    5   45    3   63                                       
CONECT    5    4   64   65   66                                       
CONECT    6    7    3                                                 
CONECT    7    9    8    8    6                                       
CONECT    8    7    7                                                 
CONECT    9   10   10    7   67                                       
CONECT   10   11    9    9   68                                       
CONECT   11   13   10   12   69                                       
CONECT   12   11   70   71   72                                       
CONECT   13   15   14   11   73                                       
CONECT   14   13   74                                                 
CONECT   15   17   16   13   75                                       
CONECT   16   15   76   77   78                                       
CONECT   17   19   18   18   15                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   21   79                                       
CONECT   20   19   80   81   82                                       
CONECT   21   19   23   22   83                                       
CONECT   22   21   84                                                 
CONECT   23   25   21   24   85                                       
CONECT   24   23   86   87   88                                       
CONECT   25   27   23   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   28   29   30   25                                       
CONECT   28   27   89   90   91                                       
CONECT   29   27   92                                                 
CONECT   30   32   27   31   93                                       
CONECT   31   30   94                                                 
CONECT   32   33   34   30   95                                       
CONECT   33   32   96   97   98                                       
CONECT   34   32   35   99  100                                       
CONECT   35   34   36   36  101                                       
CONECT   36   35   35   37  102                                       
CONECT   37   36   38   38  103                                       
CONECT   38   37   37   39  104                                       
CONECT   39   38   40   42  105                                       
CONECT   40   41   39  106  107                                       
CONECT   41   40  108  109  110                                       
CONECT   42   39   44   43  111                                       
CONECT   43   42  112                                                 
CONECT   44   42   45  113  114                                       
CONECT   45   44    4   46  115                                       
CONECT   46   45   47                                                 
CONECT   47   46    2   48   49                                       
CONECT   48   47   53                                                 
CONECT   49   47   50  116  117                                       
CONECT   50   49   51  118  119                                       
CONECT   51   53   50   52  120                                       
CONECT   52   51  121  122  123                                       
CONECT   53   48   54   51  124                                       
CONECT   54   55   53  125  126                                       
CONECT   55   57   56   54  127                                       
CONECT   56   55  128  129  130                                       
CONECT   57   55  131                                                 
CONECT   58    1                                                      
CONECT   59    1                                                      
CONECT   60    1                                                      
CONECT   61    2                                                      
CONECT   62    3                                                      
CONECT   63    4                                                      
CONECT   64    5                                                      
CONECT   65    5                                                      
CONECT   66    5                                                      
CONECT   67    9                                                      
CONECT   68   10                                                      
CONECT   69   11                                                      
CONECT   70   12                                                      
CONECT   71   12                                                      
CONECT   72   12                                                      
CONECT   73   13                                                      
CONECT   74   14                                                      
CONECT   75   15                                                      
CONECT   76   16                                                      
CONECT   77   16                                                      
CONECT   78   16                                                      
CONECT   79   19                                                      
CONECT   80   20                                                      
CONECT   81   20                                                      
CONECT   82   20                                                      
CONECT   83   21                                                      
CONECT   84   22                                                      
CONECT   85   23                                                      
CONECT   86   24                                                      
CONECT   87   24                                                      
CONECT   88   24                                                      
CONECT   89   28                                                      
CONECT   90   28                                                      
CONECT   91   28                                                      
CONECT   92   29                                                      
CONECT   93   30                                                      
CONECT   94   31                                                      
CONECT   95   32                                                      
CONECT   96   33                                                      
CONECT   97   33                                                      
CONECT   98   33                                                      
CONECT   99   34                                                      
CONECT  100   34                                                      
CONECT  101   35                                                      
CONECT  102   36                                                      
CONECT  103   37                                                      
CONECT  104   38                                                      
CONECT  105   39                                                      
CONECT  106   40                                                      
CONECT  107   40                                                      
CONECT  108   41                                                      
CONECT  109   41                                                      
CONECT  110   41                                                      
CONECT  111   42                                                      
CONECT  112   43                                                      
CONECT  113   44                                                      
CONECT  114   44                                                      
CONECT  115   45                                                      
CONECT  116   49                                                      
CONECT  117   49                                                      
CONECT  118   50                                                      
CONECT  119   50                                                      
CONECT  120   51                                                      
CONECT  121   52                                                      
CONECT  122   52                                                      
CONECT  123   52                                                      
CONECT  124   53                                                      
CONECT  125   54                                                      
CONECT  126   54                                                      
CONECT  127   55                                                      
CONECT  128   56                                                      
CONECT  129   56                                                      
CONECT  130   56                                                      
CONECT  131   57                                                      
MASTER        0    0    0    0    0    0    0    0  131    0  131    0
END
