COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      14.595  -2.773  -2.691  1.00  0.00           C  
HETATM    2  C   UNL     1      13.174  -2.911  -2.139  1.00  0.00           C  
HETATM    3  C   UNL     1      12.780  -1.622  -1.417  1.00  0.00           C  
HETATM    4  C   UNL     1      11.359  -1.760  -0.865  1.00  0.00           C  
HETATM    5  C   UNL     1      10.965  -0.470  -0.143  1.00  0.00           C  
HETATM    6  C   UNL     1       9.544  -0.609   0.409  1.00  0.00           C  
HETATM    7  C   UNL     1       9.155   0.661   1.120  1.00  0.00           C  
HETATM    8  C   UNL     1       8.034   1.266   0.815  1.00  0.00           C  
HETATM    9  C   UNL     1       2.601   1.284   0.256  1.00  0.00           C  
HETATM   10  C   UNL     1       3.336   2.402   0.950  1.00  0.00           C  
HETATM   11  C   UNL     1       4.330   3.093   0.284  1.00  0.00           C  
HETATM   12  C   UNL     1       5.005   4.119   0.918  1.00  0.00           C  
HETATM   13  C   UNL     1       4.683   4.454   2.226  1.00  0.00           C  
HETATM   14  C   UNL     1       3.010   2.738   2.251  1.00  0.00           C  
HETATM   15  C   UNL     1       2.533  -1.171  -0.087  1.00  0.00           C  
HETATM   16  C   UNL     1       0.641  -3.611   2.008  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.969  -2.217  -0.081  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.297  -2.630  -0.670  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.612  -1.596  -1.753  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.179   0.196  -1.615  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.574   0.743  -1.450  1.00  0.00           C  
HETATM   22  C   UNL     1       7.053   0.607  -0.121  1.00  0.00           C  
HETATM   23  C   UNL     1       5.694   0.559   0.528  1.00  0.00           C  
HETATM   24  O   UNL     1       5.537   1.015   1.641  1.00  0.00           O  
HETATM   25  N   UNL     1       4.653   0.010  -0.128  1.00  0.00           N  
HETATM   26  C   UNL     1       3.332  -0.037   0.503  1.00  0.00           C  
HETATM   27  C   UNL     1       3.684   3.759   2.892  1.00  0.00           C  
HETATM   28  O   UNL     1       5.345   5.462   2.852  1.00  0.00           O  
HETATM   29  O   UNL     1       3.020  -1.871  -0.950  1.00  0.00           O  
HETATM   30  N   UNL     1       1.278  -1.407   0.344  1.00  0.00           N  
HETATM   31  C   UNL     1       0.502  -2.509  -0.229  1.00  0.00           C  
HETATM   32  C   UNL     1       0.841  -3.808   0.504  1.00  0.00           C  
HETATM   33  C   UNL     1       2.298  -4.183   0.228  1.00  0.00           C  
HETATM   34  O   UNL     1      -1.338  -1.298   0.619  1.00  0.00           O  
HETATM   35  N   UNL     1      -1.875  -2.978  -0.726  1.00  0.00           N  
HETATM   36  O   UNL     1      -4.978  -1.132  -1.596  1.00  0.00           O  
HETATM   37  O   UNL     1      -4.245   0.948  -1.763  1.00  0.00           O  
HETATM   38  C   UNL     1      -6.569   1.862  -0.406  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.821   3.053  -0.949  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.457   3.936  -1.802  1.00  0.00           C  
HETATM   41  C   UNL     1      -5.774   5.028  -2.301  1.00  0.00           C  
HETATM   42  C   UNL     1      -4.450   5.238  -1.946  1.00  0.00           C  
HETATM   43  C   UNL     1      -3.814   4.350  -1.090  1.00  0.00           C  
HETATM   44  C   UNL     1      -4.503   3.263  -0.589  1.00  0.00           C  
HETATM   45  O   UNL     1      -3.775   6.312  -2.436  1.00  0.00           O  
HETATM   46  N   UNL     1      -7.457  -0.357  -0.998  1.00  0.00           N  
HETATM   47  C   UNL     1      -7.327  -0.705   0.317  1.00  0.00           C  
HETATM   48  O   UNL     1      -6.558  -0.109   1.041  1.00  0.00           O  
HETATM   49  C   UNL     1      -8.158  -1.844   0.852  1.00  0.00           C  
HETATM   50  N   UNL     1      -7.296  -3.056   0.909  1.00  0.00           N  
HETATM   51  C   UNL     1      -6.095  -2.899   0.259  1.00  0.00           C  
HETATM   52  O   UNL     1      -5.818  -1.854  -0.292  1.00  0.00           O  
HETATM   53  C   UNL     1      -5.131  -4.057   0.249  1.00  0.00           C  
HETATM   54  C   UNL     1      -4.140  -3.886  -0.904  1.00  0.00           C  
HETATM   55  C   UNL     1      -8.663  -1.500   2.254  1.00  0.00           C  
HETATM   56  C   UNL     1      -9.594  -0.289   2.179  1.00  0.00           C  
HETATM   57  C   UNL     1      -9.427  -2.695   2.828  1.00  0.00           C  
HETATM   58  H   UNL     1      14.876  -3.691  -3.205  1.00  0.00           H  
HETATM   59  H   UNL     1      14.632  -1.938  -3.391  1.00  0.00           H  
HETATM   60  H   UNL     1      15.287  -2.589  -1.869  1.00  0.00           H  
HETATM   61  H   UNL     1      12.482  -3.095  -2.960  1.00  0.00           H  
HETATM   62  H   UNL     1      13.137  -3.746  -1.439  1.00  0.00           H  
HETATM   63  H   UNL     1      13.472  -1.438  -0.595  1.00  0.00           H  
HETATM   64  H   UNL     1      12.817  -0.787  -2.117  1.00  0.00           H  
HETATM   65  H   UNL     1      10.667  -1.944  -1.686  1.00  0.00           H  
HETATM   66  H   UNL     1      11.322  -2.595  -0.165  1.00  0.00           H  
HETATM   67  H   UNL     1      11.657  -0.287   0.678  1.00  0.00           H  
HETATM   68  H   UNL     1      11.002   0.364  -0.843  1.00  0.00           H  
HETATM   69  H   UNL     1       8.852  -0.792  -0.412  1.00  0.00           H  
HETATM   70  H   UNL     1       9.507  -1.444   1.109  1.00  0.00           H  
HETATM   71  H   UNL     1       9.801   1.074   1.882  1.00  0.00           H  
HETATM   72  H   UNL     1       7.812   2.236   1.234  1.00  0.00           H  
HETATM   73  H   UNL     1       1.587   1.217   0.648  1.00  0.00           H  
HETATM   74  H   UNL     1       2.565   1.484  -0.815  1.00  0.00           H  
HETATM   75  H   UNL     1       4.581   2.832  -0.734  1.00  0.00           H  
HETATM   76  H   UNL     1       5.782   4.658   0.398  1.00  0.00           H  
HETATM   77  H   UNL     1       2.229   2.199   2.768  1.00  0.00           H  
HETATM   78  H   UNL     1      -0.397  -3.343   2.205  1.00  0.00           H  
HETATM   79  H   UNL     1       0.883  -4.536   2.531  1.00  0.00           H  
HETATM   80  H   UNL     1       1.295  -2.813   2.361  1.00  0.00           H  
HETATM   81  H   UNL     1      -3.531  -2.213   0.309  1.00  0.00           H  
HETATM   82  H   UNL     1      -2.928  -0.752  -1.659  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.493  -2.051  -2.736  1.00  0.00           H  
HETATM   84  H   UNL     1      -6.931   1.133  -2.403  1.00  0.00           H  
HETATM   85  H   UNL     1       6.994   1.180  -1.046  1.00  0.00           H  
HETATM   86  H   UNL     1       7.387  -0.407  -0.342  1.00  0.00           H  
HETATM   87  H   UNL     1       4.779  -0.355  -1.018  1.00  0.00           H  
HETATM   88  H   UNL     1       3.447  -0.193   1.576  1.00  0.00           H  
HETATM   89  H   UNL     1       3.430   4.021   3.908  1.00  0.00           H  
HETATM   90  H   UNL     1       4.938   6.332   2.737  1.00  0.00           H  
HETATM   91  H   UNL     1       0.889  -0.847   1.034  1.00  0.00           H  
HETATM   92  H   UNL     1       0.747  -2.614  -1.286  1.00  0.00           H  
HETATM   93  H   UNL     1       0.187  -4.605   0.152  1.00  0.00           H  
HETATM   94  H   UNL     1       2.957  -3.438   0.674  1.00  0.00           H  
HETATM   95  H   UNL     1       2.510  -5.161   0.663  1.00  0.00           H  
HETATM   96  H   UNL     1       2.467  -4.220  -0.848  1.00  0.00           H  
HETATM   97  H   UNL     1      -1.586  -3.757  -1.227  1.00  0.00           H  
HETATM   98  H   UNL     1      -7.595   2.151  -0.177  1.00  0.00           H  
HETATM   99  H   UNL     1      -6.080   1.509   0.502  1.00  0.00           H  
HETATM  100  H   UNL     1      -7.488   3.772  -2.078  1.00  0.00           H  
HETATM  101  H   UNL     1      -6.271   5.718  -2.967  1.00  0.00           H  
HETATM  102  H   UNL     1      -2.784   4.514  -0.809  1.00  0.00           H  
HETATM  103  H   UNL     1      -4.009   2.571   0.077  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.842   7.103  -1.885  1.00  0.00           H  
HETATM  105  H   UNL     1      -8.082  -0.800  -1.594  1.00  0.00           H  
HETATM  106  H   UNL     1      -9.004  -2.024   0.189  1.00  0.00           H  
HETATM  107  H   UNL     1      -7.556  -3.875   1.360  1.00  0.00           H  
HETATM  108  H   UNL     1      -4.588  -4.086   1.194  1.00  0.00           H  
HETATM  109  H   UNL     1      -5.683  -4.988   0.118  1.00  0.00           H  
HETATM  110  H   UNL     1      -4.686  -3.787  -1.841  1.00  0.00           H  
HETATM  111  H   UNL     1      -3.486  -4.757  -0.954  1.00  0.00           H  
HETATM  112  H   UNL     1      -7.816  -1.267   2.899  1.00  0.00           H  
HETATM  113  H   UNL     1      -9.889   0.006   3.186  1.00  0.00           H  
HETATM  114  H   UNL     1      -9.076   0.539   1.695  1.00  0.00           H  
HETATM  115  H   UNL     1     -10.482  -0.548   1.601  1.00  0.00           H  
HETATM  116  H   UNL     1      -8.763  -3.559   2.882  1.00  0.00           H  
HETATM  117  H   UNL     1      -9.787  -2.451   3.827  1.00  0.00           H  
HETATM  118  H   UNL     1     -10.274  -2.928   2.183  1.00  0.00           H  
CONECT    1    2   58   59   60                                       
CONECT    2    1    3   61   62                                       
CONECT    3    2    4   63   64                                       
CONECT    4    3    5   65   66                                       
CONECT    5    4    6   67   68                                       
CONECT    6    5    7   69   70                                       
CONECT    7    6    8    8   71                                       
CONECT    8   22    7    7   72                                       
CONECT    9   26   10   73   74                                       
CONECT   10    9   14   14   11                                       
CONECT   11   10   12   12   75                                       
CONECT   12   11   11   13   76                                       
CONECT   13   27   27   12   28                                       
CONECT   14   10   10   27   77                                       
CONECT   15   29   29   30   26                                       
CONECT   16   32   78   79   80                                       
CONECT   17   35   31   34   34                                       
CONECT   18   54   19   35   81                                       
CONECT   19   36   18   82   83                                       
CONECT   20   21   36   37   37                                       
CONECT   21   46   38   20   84                                       
CONECT   22   23    8   85   86                                       
CONECT   23   22   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   87                                            
CONECT   26   15   25    9   88                                       
CONECT   27   14   13   13   89                                       
CONECT   28   13   90                                                 
CONECT   29   15   15                                                 
CONECT   30   31   15   91                                            
CONECT   31   17   32   30   92                                       
CONECT   32   31   33   16   93                                       
CONECT   33   32   94   95   96                                       
CONECT   34   17   17                                                 
CONECT   35   18   17   97                                            
CONECT   36   20   19                                                 
CONECT   37   20   20                                                 
CONECT   38   39   21   98   99                                       
CONECT   39   44   38   40   40                                       
CONECT   40   39   39   41  100                                       
CONECT   41   42   42   40  101                                       
CONECT   42   43   45   41   41                                       
CONECT   43   44   44   42  102                                       
CONECT   44   43   43   39  103                                       
CONECT   45   42  104                                                 
CONECT   46   47   21  105                                            
CONECT   47   49   48   48   46                                       
CONECT   48   47   47                                                 
CONECT   49   55   50   47  106                                       
CONECT   50   49   51  107                                            
CONECT   51   50   52   52   53                                       
CONECT   52   51   51                                                 
CONECT   53   51   54  108  109                                       
CONECT   54   53   18  110  111                                       
CONECT   55   56   57   49  112                                       
CONECT   56   55  113  114  115                                       
CONECT   57   55  116  117  118                                       
CONECT   58    1                                                      
CONECT   59    1                                                      
CONECT   60    1                                                      
CONECT   61    2                                                      
CONECT   62    2                                                      
CONECT   63    3                                                      
CONECT   64    3                                                      
CONECT   65    4                                                      
CONECT   66    4                                                      
CONECT   67    5                                                      
CONECT   68    5                                                      
CONECT   69    6                                                      
CONECT   70    6                                                      
CONECT   71    7                                                      
CONECT   72    8                                                      
CONECT   73    9                                                      
CONECT   74    9                                                      
CONECT   75   11                                                      
CONECT   76   12                                                      
CONECT   77   14                                                      
CONECT   78   16                                                      
CONECT   79   16                                                      
CONECT   80   16                                                      
CONECT   81   18                                                      
CONECT   82   19                                                      
CONECT   83   19                                                      
CONECT   84   21                                                      
CONECT   85   22                                                      
CONECT   86   22                                                      
CONECT   87   25                                                      
CONECT   88   26                                                      
CONECT   89   27                                                      
CONECT   90   28                                                      
CONECT   91   30                                                      
CONECT   92   31                                                      
CONECT   93   32                                                      
CONECT   94   33                                                      
CONECT   95   33                                                      
CONECT   96   33                                                      
CONECT   97   35                                                      
CONECT   98   38                                                      
CONECT   99   38                                                      
CONECT  100   40                                                      
CONECT  101   41                                                      
CONECT  102   43                                                      
CONECT  103   44                                                      
CONECT  104   45                                                      
CONECT  105   46                                                      
CONECT  106   49                                                      
CONECT  107   50                                                      
CONECT  108   53                                                      
CONECT  109   53                                                      
CONECT  110   54                                                      
CONECT  111   54                                                      
CONECT  112   55                                                      
CONECT  113   56                                                      
CONECT  114   56                                                      
CONECT  115   56                                                      
CONECT  116   57                                                      
CONECT  117   57                                                      
CONECT  118   57                                                      
MASTER        0    0    0    0    0    0    0    0  118    0  118    0
END
