COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.664   3.102   3.816  1.00  0.00           C  
HETATM    2  C   UNL     1       6.912   0.355  -0.930  1.00  0.00           C  
HETATM    3  C   UNL     1       7.488  -0.481  -2.103  1.00  0.00           C  
HETATM    4  C   UNL     1       8.892   0.129  -2.305  1.00  0.00           C  
HETATM    5  C   UNL     1       9.903   2.342  -1.701  1.00  0.00           C  
HETATM    6  C   UNL     1      11.237   1.934  -2.270  1.00  0.00           C  
HETATM    7  C   UNL     1      12.236   3.080  -2.101  1.00  0.00           C  
HETATM    8  C   UNL     1       7.509   1.754  -1.222  1.00  0.00           C  
HETATM    9  C   UNL     1       5.387  -1.994  -0.477  1.00  0.00           C  
HETATM   10  C   UNL     1       2.627  -1.520  -1.732  1.00  0.00           C  
HETATM   11  C   UNL     1       3.146  -1.044  -3.090  1.00  0.00           C  
HETATM   12  C   UNL     1       0.515   2.215   3.358  1.00  0.00           C  
HETATM   13  C   UNL     1       3.024  -2.981  -1.517  1.00  0.00           C  
HETATM   14  C   UNL     1       1.286  -3.243   2.278  1.00  0.00           C  
HETATM   15  C   UNL     1       0.281  -3.917   1.380  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.763  -3.188   0.849  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.693  -3.807   0.015  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.568  -5.163  -0.275  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.518  -5.889   0.265  1.00  0.00           C  
HETATM   20  C   UNL     1       0.405  -5.264   1.092  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.813  -3.023  -0.562  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.967  -1.685  -0.228  1.00  0.00           C  
HETATM   23  C   UNL     1       2.422   0.882   4.728  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.021  -0.957  -0.782  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.908  -1.579  -1.683  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.739  -2.925  -1.995  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.711  -3.635  -1.443  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.905  -0.854  -3.044  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.182  -1.227  -2.289  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.558   0.565  -1.454  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.333   1.812  -1.632  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.266   2.211  -0.674  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.485   1.364   0.553  1.00  0.00           C  
HETATM   34  C   UNL     1       2.859   2.279   4.287  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.741   1.384   2.831  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.933   0.870   0.580  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.798   4.094  -1.890  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.890   3.770  -2.883  1.00  0.00           C  
HETATM   39  C   UNL     1      -6.140   2.614  -2.763  1.00  0.00           C  
HETATM   40  C   UNL     1      -4.481   0.424  -0.641  1.00  0.00           C  
HETATM   41  C   UNL     1      -3.884   1.486   0.245  1.00  0.00           C  
HETATM   42  C   UNL     1      -2.613   2.042  -0.394  1.00  0.00           C  
HETATM   43  C   UNL     1      -2.973   2.787  -1.681  1.00  0.00           C  
HETATM   44  C   UNL     1      -1.660   0.890  -0.721  1.00  0.00           C  
HETATM   45  C   UNL     1       1.757  -1.102   3.454  1.00  0.00           C  
HETATM   46  C   UNL     1      -1.931   3.007   0.580  1.00  0.00           C  
HETATM   47  C   UNL     1      -0.353   2.959   2.370  1.00  0.00           C  
HETATM   48  C   UNL     1       1.018  -1.737   2.303  1.00  0.00           C  
HETATM   49  C   UNL     1       2.781  -1.171   0.719  1.00  0.00           C  
HETATM   50  C   UNL     1       3.235  -0.658  -0.623  1.00  0.00           C  
HETATM   51  C   UNL     1       5.406   0.390  -0.980  1.00  0.00           C  
HETATM   52  N   UNL     1       1.048   1.010   2.702  1.00  0.00           N  
HETATM   53  N   UNL     1       1.731   0.235   3.604  1.00  0.00           N  
HETATM   54  N   UNL     1       1.474  -1.141   1.045  1.00  0.00           N  
HETATM   55  N   UNL     1       4.697  -0.722  -0.702  1.00  0.00           N  
HETATM   56  N   UNL     1       8.863   1.486  -1.739  1.00  0.00           N  
HETATM   57  N   UNL     1      -5.819  -0.628  -2.086  1.00  0.00           N  
HETATM   58  N   UNL     1      -7.956   3.321  -0.833  1.00  0.00           N  
HETATM   59  O   UNL     1       2.370  -1.792   4.240  1.00  0.00           O  
HETATM   60  O   UNL     1       9.765   3.442  -1.208  1.00  0.00           O  
HETATM   61  O   UNL     1       4.832   1.418  -1.271  1.00  0.00           O  
HETATM   62  O   UNL     1       3.592  -1.612   1.505  1.00  0.00           O  
HETATM   63  O   UNL     1      -0.393  -7.213  -0.015  1.00  0.00           O  
HETATM   64  O   UNL     1      -7.225   2.144   1.722  1.00  0.00           O  
HETATM   65  O   UNL     1      -1.135   2.257   1.532  1.00  0.00           O  
HETATM   66  O   UNL     1      -0.345   4.167   2.335  1.00  0.00           O  
HETATM   67  H   UNL     1       1.975   3.738   2.987  1.00  0.00           H  
HETATM   68  H   UNL     1       1.322   3.733   4.636  1.00  0.00           H  
HETATM   69  H   UNL     1       7.260  -0.026   0.030  1.00  0.00           H  
HETATM   70  H   UNL     1       7.561  -1.533  -1.827  1.00  0.00           H  
HETATM   71  H   UNL     1       6.881  -0.357  -3.000  1.00  0.00           H  
HETATM   72  H   UNL     1       9.636  -0.474  -1.785  1.00  0.00           H  
HETATM   73  H   UNL     1       9.126   0.176  -3.368  1.00  0.00           H  
HETATM   74  H   UNL     1      11.603   1.053  -1.743  1.00  0.00           H  
HETATM   75  H   UNL     1      11.125   1.704  -3.330  1.00  0.00           H  
HETATM   76  H   UNL     1      12.349   3.311  -1.041  1.00  0.00           H  
HETATM   77  H   UNL     1      13.201   2.785  -2.513  1.00  0.00           H  
HETATM   78  H   UNL     1      11.871   3.962  -2.628  1.00  0.00           H  
HETATM   79  H   UNL     1       6.912   2.273  -1.972  1.00  0.00           H  
HETATM   80  H   UNL     1       7.561   2.343  -0.306  1.00  0.00           H  
HETATM   81  H   UNL     1       5.557  -2.489  -1.434  1.00  0.00           H  
HETATM   82  H   UNL     1       6.344  -1.807   0.010  1.00  0.00           H  
HETATM   83  H   UNL     1       4.774  -2.633   0.159  1.00  0.00           H  
HETATM   84  H   UNL     1       1.541  -1.431  -1.706  1.00  0.00           H  
HETATM   85  H   UNL     1       2.712  -1.658  -3.880  1.00  0.00           H  
HETATM   86  H   UNL     1       2.863  -0.003  -3.243  1.00  0.00           H  
HETATM   87  H   UNL     1       4.232  -1.133  -3.116  1.00  0.00           H  
HETATM   88  H   UNL     1      -0.089   1.922   4.217  1.00  0.00           H  
HETATM   89  H   UNL     1       4.070  -3.118  -1.793  1.00  0.00           H  
HETATM   90  H   UNL     1       2.887  -3.245  -0.468  1.00  0.00           H  
HETATM   91  H   UNL     1       2.398  -3.623  -2.137  1.00  0.00           H  
HETATM   92  H   UNL     1       1.199  -3.644   3.288  1.00  0.00           H  
HETATM   93  H   UNL     1       2.292  -3.427   1.900  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.860  -2.137   1.079  1.00  0.00           H  
HETATM   95  H   UNL     1      -2.287  -5.648  -0.919  1.00  0.00           H  
HETATM   96  H   UNL     1       1.224  -5.831   1.511  1.00  0.00           H  
HETATM   97  H   UNL     1      -2.277  -1.211   0.455  1.00  0.00           H  
HETATM   98  H   UNL     1       3.296   0.295   5.008  1.00  0.00           H  
HETATM   99  H   UNL     1       1.745   0.961   5.579  1.00  0.00           H  
HETATM  100  H   UNL     1      -5.423  -3.410  -2.675  1.00  0.00           H  
HETATM  101  H   UNL     1      -3.591  -4.679  -1.690  1.00  0.00           H  
HETATM  102  H   UNL     1      -6.631  -1.666  -3.718  1.00  0.00           H  
HETATM  103  H   UNL     1      -7.075   0.055  -3.620  1.00  0.00           H  
HETATM  104  H   UNL     1      -7.959  -2.008  -1.562  1.00  0.00           H  
HETATM  105  H   UNL     1      -8.568  -0.348  -1.772  1.00  0.00           H  
HETATM  106  H   UNL     1      -8.929  -1.590  -2.995  1.00  0.00           H  
HETATM  107  H   UNL     1      -6.810   0.508   0.529  1.00  0.00           H  
HETATM  108  H   UNL     1       3.575   2.189   3.470  1.00  0.00           H  
HETATM  109  H   UNL     1       3.335   2.787   5.125  1.00  0.00           H  
HETATM  110  H   UNL     1      -6.569   2.048   3.679  1.00  0.00           H  
HETATM  111  H   UNL     1      -7.478   0.630   3.105  1.00  0.00           H  
HETATM  112  H   UNL     1      -5.806   0.896   2.557  1.00  0.00           H  
HETATM  113  H   UNL     1      -9.141   0.408   1.545  1.00  0.00           H  
HETATM  114  H   UNL     1      -9.607   1.713   0.428  1.00  0.00           H  
HETATM  115  H   UNL     1      -9.082   0.138  -0.214  1.00  0.00           H  
HETATM  116  H   UNL     1      -8.385   4.996  -1.981  1.00  0.00           H  
HETATM  117  H   UNL     1      -6.769   4.413  -3.742  1.00  0.00           H  
HETATM  118  H   UNL     1      -5.424   2.338  -3.522  1.00  0.00           H  
HETATM  119  H   UNL     1      -4.604   2.293   0.379  1.00  0.00           H  
HETATM  120  H   UNL     1      -3.641   1.053   1.215  1.00  0.00           H  
HETATM  121  H   UNL     1      -3.596   3.648  -1.441  1.00  0.00           H  
HETATM  122  H   UNL     1      -2.060   3.125  -2.173  1.00  0.00           H  
HETATM  123  H   UNL     1      -3.518   2.119  -2.347  1.00  0.00           H  
HETATM  124  H   UNL     1      -2.110   0.251  -1.480  1.00  0.00           H  
HETATM  125  H   UNL     1      -0.719   1.293  -1.097  1.00  0.00           H  
HETATM  126  H   UNL     1      -1.472   0.308   0.181  1.00  0.00           H  
HETATM  127  H   UNL     1      -1.286   3.687   0.024  1.00  0.00           H  
HETATM  128  H   UNL     1      -2.689   3.581   1.112  1.00  0.00           H  
HETATM  129  H   UNL     1      -0.051  -1.563   2.420  1.00  0.00           H  
HETATM  130  H   UNL     1       2.910   0.375  -0.746  1.00  0.00           H  
HETATM  131  H   UNL     1       0.310   0.483   2.258  1.00  0.00           H  
HETATM  132  H   UNL     1       0.834  -0.724   0.446  1.00  0.00           H  
HETATM  133  H   UNL     1       0.140  -7.401  -0.799  1.00  0.00           H  
CONECT    1   12   34   67   68                                       
CONECT    2   51    3    8   69                                       
CONECT    3    2    4   70   71                                       
CONECT    4    3   56   72   73                                       
CONECT    5   56   60   60    6                                       
CONECT    6    5    7   74   75                                       
CONECT    7    6   76   77   78                                       
CONECT    8    2   56   79   80                                       
CONECT    9   55   81   82   83                                       
CONECT   10   50   11   13   84                                       
CONECT   11   10   85   86   87                                       
CONECT   12    1   52   47   88                                       
CONECT   13   10   89   90   91                                       
CONECT   14   48   15   92   93                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   94                                       
CONECT   17   16   18   18   21                                       
CONECT   18   17   17   19   95                                       
CONECT   19   18   63   20   20                                       
CONECT   20   15   19   19   96                                       
CONECT   21   17   22   22   27                                       
CONECT   22   21   21   24   97                                       
CONECT   23   53   34   98   99                                       
CONECT   24   22   25   25   40                                       
CONECT   25   24   24   26   57                                       
CONECT   26   25   27   27  100                                       
CONECT   27   21   26   26  101                                       
CONECT   28   57   29  102  103                                       
CONECT   29   28  104  105  106                                       
CONECT   30   57   31   40   40                                       
CONECT   31   30   32   32   39                                       
CONECT   32   31   31   33   58                                       
CONECT   33   32   64   36  107                                       
CONECT   34    1   23  108  109                                       
CONECT   35   64  110  111  112                                       
CONECT   36   33  113  114  115                                       
CONECT   37   58   58   38  116                                       
CONECT   38   37   39   39  117                                       
CONECT   39   31   38   38  118                                       
CONECT   40   24   30   30   41                                       
CONECT   41   40   42  119  120                                       
CONECT   42   41   43   44   46                                       
CONECT   43   42  121  122  123                                       
CONECT   44   42  124  125  126                                       
CONECT   45   53   59   59   48                                       
CONECT   46   42   65  127  128                                       
CONECT   47   12   65   66   66                                       
CONECT   48   45   54   14  129                                       
CONECT   49   54   50   62   62                                       
CONECT   50   49   55   10  130                                       
CONECT   51   55    2   61   61                                       
CONECT   52   12   53  131                                            
CONECT   53   52   23   45                                            
CONECT   54   48   49  132                                            
CONECT   55   50   51    9                                            
CONECT   56    4    5    8                                            
CONECT   57   25   28   30                                            
CONECT   58   32   37   37                                            
CONECT   59   45   45                                                 
CONECT   60    5    5                                                 
CONECT   61   51   51                                                 
CONECT   62   49   49                                                 
CONECT   63   19  133                                                 
CONECT   64   33   35                                                 
CONECT   65   46   47                                                 
CONECT   66   47   47                                                 
CONECT   67    1                                                      
CONECT   68    1                                                      
CONECT   69    2                                                      
CONECT   70    3                                                      
CONECT   71    3                                                      
CONECT   72    4                                                      
CONECT   73    4                                                      
CONECT   74    6                                                      
CONECT   75    6                                                      
CONECT   76    7                                                      
CONECT   77    7                                                      
CONECT   78    7                                                      
CONECT   79    8                                                      
CONECT   80    8                                                      
CONECT   81    9                                                      
CONECT   82    9                                                      
CONECT   83    9                                                      
CONECT   84   10                                                      
CONECT   85   11                                                      
CONECT   86   11                                                      
CONECT   87   11                                                      
CONECT   88   12                                                      
CONECT   89   13                                                      
CONECT   90   13                                                      
CONECT   91   13                                                      
CONECT   92   14                                                      
CONECT   93   14                                                      
CONECT   94   16                                                      
CONECT   95   18                                                      
CONECT   96   20                                                      
CONECT   97   22                                                      
CONECT   98   23                                                      
CONECT   99   23                                                      
CONECT  100   26                                                      
CONECT  101   27                                                      
CONECT  102   28                                                      
CONECT  103   28                                                      
CONECT  104   29                                                      
CONECT  105   29                                                      
CONECT  106   29                                                      
CONECT  107   33                                                      
CONECT  108   34                                                      
CONECT  109   34                                                      
CONECT  110   35                                                      
CONECT  111   35                                                      
CONECT  112   35                                                      
CONECT  113   36                                                      
CONECT  114   36                                                      
CONECT  115   36                                                      
CONECT  116   37                                                      
CONECT  117   38                                                      
CONECT  118   39                                                      
CONECT  119   41                                                      
CONECT  120   41                                                      
CONECT  121   43                                                      
CONECT  122   43                                                      
CONECT  123   43                                                      
CONECT  124   44                                                      
CONECT  125   44                                                      
CONECT  126   44                                                      
CONECT  127   46                                                      
CONECT  128   46                                                      
CONECT  129   48                                                      
CONECT  130   50                                                      
CONECT  131   52                                                      
CONECT  132   54                                                      
CONECT  133   63                                                      
MASTER        0    0    0    0    0    0    0    0  133    0  133    0
END
