COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -14.963   1.039  -4.439  1.00  0.00           C  
HETATM    2  C   UNL     1     -13.593   0.382  -2.715  1.00  0.00           C  
HETATM    3  C   UNL     1     -14.178  -0.895  -2.751  1.00  0.00           C  
HETATM    4  C   UNL     1     -15.189  -1.135  -3.697  1.00  0.00           C  
HETATM    5  C   UNL     1      29.241   3.734  -0.478  1.00  0.00           C  
HETATM    6  C   UNL     1      27.953   3.591   0.335  1.00  0.00           C  
HETATM    7  C   UNL     1      26.837   3.058  -0.567  1.00  0.00           C  
HETATM    8  C   UNL     1      25.549   2.915   0.246  1.00  0.00           C  
HETATM    9  C   UNL     1      24.434   2.381  -0.655  1.00  0.00           C  
HETATM   10  C   UNL     1      23.146   2.238   0.157  1.00  0.00           C  
HETATM   11  C   UNL     1      22.030   1.705  -0.744  1.00  0.00           C  
HETATM   12  C   UNL     1      20.742   1.562   0.068  1.00  0.00           C  
HETATM   13  C   UNL     1      19.627   1.028  -0.833  1.00  0.00           C  
HETATM   14  C   UNL     1      18.338   0.886  -0.021  1.00  0.00           C  
HETATM   15  C   UNL     1      17.223   0.352  -0.922  1.00  0.00           C  
HETATM   16  C   UNL     1      15.935   0.209  -0.110  1.00  0.00           C  
HETATM   17  C   UNL     1      14.820  -0.324  -1.011  1.00  0.00           C  
HETATM   18  C   UNL     1      13.531  -0.467  -0.199  1.00  0.00           C  
HETATM   19  C   UNL     1      12.416  -1.001  -1.100  1.00  0.00           C  
HETATM   20  C   UNL     1      11.128  -1.144  -0.288  1.00  0.00           C  
HETATM   21  S   UNL     1       9.806  -1.776  -1.357  1.00  0.00           S  
HETATM   22  C   UNL     1       8.385  -1.876  -0.233  1.00  0.00           C  
HETATM   23  C   UNL     1       7.168  -2.402  -0.996  1.00  0.00           C  
HETATM   24  N   UNL     1       6.020  -2.482  -0.088  1.00  0.00           N  
HETATM   25  C   UNL     1       4.830  -2.922  -0.544  1.00  0.00           C  
HETATM   26  O   UNL     1       4.710  -3.251  -1.705  1.00  0.00           O  
HETATM   27  C   UNL     1       3.650  -3.004   0.390  1.00  0.00           C  
HETATM   28  C   UNL     1       2.432  -3.530  -0.373  1.00  0.00           C  
HETATM   29  N   UNL     1       1.285  -3.611   0.534  1.00  0.00           N  
HETATM   30  C   UNL     1       0.095  -4.051   0.079  1.00  0.00           C  
HETATM   31  O   UNL     1      -0.050  -4.293  -1.100  1.00  0.00           O  
HETATM   32  C   UNL     1      -1.054  -4.241   1.035  1.00  0.00           C  
HETATM   33  O   UNL     1      -0.595  -4.052   2.375  1.00  0.00           O  
HETATM   34  C   UNL     1      -2.151  -3.221   0.723  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.557  -1.811   0.741  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.737  -3.510  -0.661  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.256  -3.323   1.776  1.00  0.00           C  
HETATM   38  O   UNL     1      -4.281  -2.371   1.484  1.00  0.00           O  
HETATM   39  P   UNL     1      -5.602  -2.200   2.389  1.00  0.00           P  
HETATM   40  O   UNL     1      -5.210  -1.951   3.794  1.00  0.00           O  
HETATM   41  O   UNL     1      -6.485  -3.544   2.308  1.00  0.00           O  
HETATM   42  O   UNL     1      -6.468  -0.956   1.845  1.00  0.00           O  
HETATM   43  P   UNL     1      -7.611  -0.023   2.488  1.00  0.00           P  
HETATM   44  O   UNL     1      -8.526  -0.855   3.303  1.00  0.00           O  
HETATM   45  O   UNL     1      -6.929   1.097   3.422  1.00  0.00           O  
HETATM   46  O   UNL     1      -8.444   0.694   1.311  1.00  0.00           O  
HETATM   47  C   UNL     1      -9.594   1.506   1.554  1.00  0.00           C  
HETATM   48  C   UNL     1     -10.139   2.030   0.224  1.00  0.00           C  
HETATM   49  O   UNL     1     -10.646   0.937  -0.560  1.00  0.00           O  
HETATM   50  C   UNL     1     -11.315   2.992   0.482  1.00  0.00           C  
HETATM   51  O   UNL     1     -11.023   4.290  -0.040  1.00  0.00           O  
HETATM   52  P   UNL     1     -10.970   5.613   0.876  1.00  0.00           P  
HETATM   53  O   UNL     1     -10.745   6.904  -0.059  1.00  0.00           O  
HETATM   54  O   UNL     1     -12.245   5.753   1.613  1.00  0.00           O  
HETATM   55  O   UNL     1      -9.754   5.491   1.924  1.00  0.00           O  
HETATM   56  C   UNL     1     -12.502   2.353  -0.278  1.00  0.00           C  
HETATM   57  O   UNL     1     -13.277   3.352  -0.945  1.00  0.00           O  
HETATM   58  C   UNL     1     -11.780   1.440  -1.300  1.00  0.00           C  
HETATM   59  N   UNL     1     -12.653   0.339  -1.716  1.00  0.00           N  
HETATM   60  C   UNL     1     -12.682  -0.914  -1.182  1.00  0.00           C  
HETATM   61  N   UNL     1     -13.577  -1.637  -1.790  1.00  0.00           N  
HETATM   62  N   UNL     1     -14.012   1.309  -3.570  1.00  0.00           N  
HETATM   63  N   UNL     1     -15.543  -0.145  -4.511  1.00  0.00           N  
HETATM   64  N   UNL     1     -15.802  -2.372  -3.780  1.00  0.00           N  
HETATM   65  H   UNL     1     -15.284   1.817  -5.117  1.00  0.00           H  
HETATM   66  H   UNL     1      29.530   2.761  -0.875  1.00  0.00           H  
HETATM   67  H   UNL     1      29.076   4.429  -1.301  1.00  0.00           H  
HETATM   68  H   UNL     1      30.035   4.114   0.165  1.00  0.00           H  
HETATM   69  H   UNL     1      28.118   2.896   1.158  1.00  0.00           H  
HETATM   70  H   UNL     1      27.664   4.564   0.733  1.00  0.00           H  
HETATM   71  H   UNL     1      26.673   3.752  -1.390  1.00  0.00           H  
HETATM   72  H   UNL     1      27.126   2.085  -0.964  1.00  0.00           H  
HETATM   73  H   UNL     1      25.714   2.220   1.070  1.00  0.00           H  
HETATM   74  H   UNL     1      25.261   3.888   0.644  1.00  0.00           H  
HETATM   75  H   UNL     1      24.269   3.076  -1.479  1.00  0.00           H  
HETATM   76  H   UNL     1      24.722   1.408  -1.053  1.00  0.00           H  
HETATM   77  H   UNL     1      23.311   1.543   0.981  1.00  0.00           H  
HETATM   78  H   UNL     1      22.857   3.211   0.555  1.00  0.00           H  
HETATM   79  H   UNL     1      21.865   2.400  -1.568  1.00  0.00           H  
HETATM   80  H   UNL     1      22.319   0.732  -1.142  1.00  0.00           H  
HETATM   81  H   UNL     1      20.907   0.867   0.892  1.00  0.00           H  
HETATM   82  H   UNL     1      20.454   2.535   0.466  1.00  0.00           H  
HETATM   83  H   UNL     1      19.462   1.723  -1.657  1.00  0.00           H  
HETATM   84  H   UNL     1      19.915   0.056  -1.231  1.00  0.00           H  
HETATM   85  H   UNL     1      18.503   0.191   0.803  1.00  0.00           H  
HETATM   86  H   UNL     1      18.050   1.858   0.377  1.00  0.00           H  
HETATM   87  H   UNL     1      17.058   1.047  -1.746  1.00  0.00           H  
HETATM   88  H   UNL     1      17.512  -0.621  -1.320  1.00  0.00           H  
HETATM   89  H   UNL     1      16.100  -0.486   0.714  1.00  0.00           H  
HETATM   90  H   UNL     1      15.646   1.182   0.288  1.00  0.00           H  
HETATM   91  H   UNL     1      14.655   0.370  -1.835  1.00  0.00           H  
HETATM   92  H   UNL     1      15.108  -1.297  -1.409  1.00  0.00           H  
HETATM   93  H   UNL     1      13.696  -1.162   0.625  1.00  0.00           H  
HETATM   94  H   UNL     1      13.243   0.506   0.199  1.00  0.00           H  
HETATM   95  H   UNL     1      12.251  -0.306  -1.924  1.00  0.00           H  
HETATM   96  H   UNL     1      12.705  -1.974  -1.498  1.00  0.00           H  
HETATM   97  H   UNL     1      11.293  -1.839   0.536  1.00  0.00           H  
HETATM   98  H   UNL     1      10.839  -0.171   0.110  1.00  0.00           H  
HETATM   99  H   UNL     1       8.619  -2.552   0.589  1.00  0.00           H  
HETATM  100  H   UNL     1       8.165  -0.884   0.163  1.00  0.00           H  
HETATM  101  H   UNL     1       6.934  -1.725  -1.818  1.00  0.00           H  
HETATM  102  H   UNL     1       7.387  -3.393  -1.392  1.00  0.00           H  
HETATM  103  H   UNL     1       6.117  -2.219   0.840  1.00  0.00           H  
HETATM  104  H   UNL     1       3.884  -3.681   1.212  1.00  0.00           H  
HETATM  105  H   UNL     1       3.430  -2.013   0.786  1.00  0.00           H  
HETATM  106  H   UNL     1       2.199  -2.854  -1.195  1.00  0.00           H  
HETATM  107  H   UNL     1       2.652  -4.522  -0.770  1.00  0.00           H  
HETATM  108  H   UNL     1       1.382  -3.348   1.463  1.00  0.00           H  
HETATM  109  H   UNL     1      -1.453  -5.249   0.927  1.00  0.00           H  
HETATM  110  H   UNL     1      -0.225  -3.174   2.544  1.00  0.00           H  
HETATM  111  H   UNL     1      -0.770  -1.739  -0.009  1.00  0.00           H  
HETATM  112  H   UNL     1      -2.339  -1.085   0.519  1.00  0.00           H  
HETATM  113  H   UNL     1      -1.140  -1.606   1.727  1.00  0.00           H  
HETATM  114  H   UNL     1      -3.057  -4.551  -0.710  1.00  0.00           H  
HETATM  115  H   UNL     1      -3.593  -2.858  -0.836  1.00  0.00           H  
HETATM  116  H   UNL     1      -1.978  -3.326  -1.422  1.00  0.00           H  
HETATM  117  H   UNL     1      -3.679  -4.328   1.763  1.00  0.00           H  
HETATM  118  H   UNL     1      -2.839  -3.118   2.762  1.00  0.00           H  
HETATM  119  H   UNL     1      -6.778  -3.769   1.414  1.00  0.00           H  
HETATM  120  H   UNL     1      -6.316   1.679   2.953  1.00  0.00           H  
HETATM  121  H   UNL     1     -10.360   0.911   2.052  1.00  0.00           H  
HETATM  122  H   UNL     1      -9.317   2.347   2.190  1.00  0.00           H  
HETATM  123  H   UNL     1      -9.350   2.544  -0.323  1.00  0.00           H  
HETATM  124  H   UNL     1     -11.532   3.052   1.549  1.00  0.00           H  
HETATM  125  H   UNL     1     -10.703   7.739   0.427  1.00  0.00           H  
HETATM  126  H   UNL     1      -8.885   5.395   1.510  1.00  0.00           H  
HETATM  127  H   UNL     1     -13.125   1.766   0.397  1.00  0.00           H  
HETATM  128  H   UNL     1     -14.033   3.001  -1.435  1.00  0.00           H  
HETATM  129  H   UNL     1     -11.452   2.016  -2.165  1.00  0.00           H  
HETATM  130  H   UNL     1     -12.054  -1.257  -0.372  1.00  0.00           H  
HETATM  131  H   UNL     1     -15.535  -3.087  -3.180  1.00  0.00           H  
HETATM  132  H   UNL     1     -16.499  -2.526  -4.437  1.00  0.00           H  
CONECT    1   62   62   63   65                                       
CONECT    2   62   59    3    3                                       
CONECT    3    2    2    4   61                                       
CONECT    4   63   63    3   64                                       
CONECT    5    6   66   67   68                                       
CONECT    6    7    5   69   70                                       
CONECT    7    8    6   71   72                                       
CONECT    8    9    7   73   74                                       
CONECT    9   10    8   75   76                                       
CONECT   10   11    9   77   78                                       
CONECT   11   12   10   79   80                                       
CONECT   12   13   11   81   82                                       
CONECT   13   14   12   83   84                                       
CONECT   14   13   15   85   86                                       
CONECT   15   14   16   87   88                                       
CONECT   16   15   17   89   90                                       
CONECT   17   16   18   91   92                                       
CONECT   18   17   19   93   94                                       
CONECT   19   18   20   95   96                                       
CONECT   20   19   21   97   98                                       
CONECT   21   20   22                                                 
CONECT   22   23   21   99  100                                       
CONECT   23   24   22  101  102                                       
CONECT   24   23   25  103                                            
CONECT   25   27   24   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   28   25  104  105                                       
CONECT   28   29   27  106  107                                       
CONECT   29   30   28  108                                            
CONECT   30   32   29   31   31                                       
CONECT   31   30   30                                                 
CONECT   32   33   30   34  109                                       
CONECT   33   32  110                                                 
CONECT   34   36   32   37   35                                       
CONECT   35   34  111  112  113                                       
CONECT   36   34  114  115  116                                       
CONECT   37   34   38  117  118                                       
CONECT   38   37   39                                                 
CONECT   39   42   40   40   38                                       
CONECT   39   41                                                      
CONECT   40   39   39                                                 
CONECT   41   39  119                                                 
CONECT   42   43   39                                                 
CONECT   43   46   42   44   44                                       
CONECT   43   45                                                      
CONECT   44   43   43                                                 
CONECT   45   43  120                                                 
CONECT   46   47   43                                                 
CONECT   47   48   46  121  122                                       
CONECT   48   50   49   47  123                                       
CONECT   49   58   48                                                 
CONECT   50   51   56   48  124                                       
CONECT   51   52   50                                                 
CONECT   52   54   54   55   53                                       
CONECT   52   51                                                      
CONECT   53   52  125                                                 
CONECT   54   52   52                                                 
CONECT   55   52  126                                                 
CONECT   56   57   50   58  127                                       
CONECT   57   56  128                                                 
CONECT   58   56   59   49  129                                       
CONECT   59   58    2   60                                            
CONECT   60   59   61   61  130                                       
CONECT   61    3   60   60                                            
CONECT   62    1    1    2                                            
CONECT   63    1    4    4                                            
CONECT   64    4  131  132                                            
CONECT   65    1                                                      
CONECT   66    5                                                      
CONECT   67    5                                                      
CONECT   68    5                                                      
CONECT   69    6                                                      
CONECT   70    6                                                      
CONECT   71    7                                                      
CONECT   72    7                                                      
CONECT   73    8                                                      
CONECT   74    8                                                      
CONECT   75    9                                                      
CONECT   76    9                                                      
CONECT   77   10                                                      
CONECT   78   10                                                      
CONECT   79   11                                                      
CONECT   80   11                                                      
CONECT   81   12                                                      
CONECT   82   12                                                      
CONECT   83   13                                                      
CONECT   84   13                                                      
CONECT   85   14                                                      
CONECT   86   14                                                      
CONECT   87   15                                                      
CONECT   88   15                                                      
CONECT   89   16                                                      
CONECT   90   16                                                      
CONECT   91   17                                                      
CONECT   92   17                                                      
CONECT   93   18                                                      
CONECT   94   18                                                      
CONECT   95   19                                                      
CONECT   96   19                                                      
CONECT   97   20                                                      
CONECT   98   20                                                      
CONECT   99   22                                                      
CONECT  100   22                                                      
CONECT  101   23                                                      
CONECT  102   23                                                      
CONECT  103   24                                                      
CONECT  104   27                                                      
CONECT  105   27                                                      
CONECT  106   28                                                      
CONECT  107   28                                                      
CONECT  108   29                                                      
CONECT  109   32                                                      
CONECT  110   33                                                      
CONECT  111   35                                                      
CONECT  112   35                                                      
CONECT  113   35                                                      
CONECT  114   36                                                      
CONECT  115   36                                                      
CONECT  116   36                                                      
CONECT  117   37                                                      
CONECT  118   37                                                      
CONECT  119   41                                                      
CONECT  120   45                                                      
CONECT  121   47                                                      
CONECT  122   47                                                      
CONECT  123   48                                                      
CONECT  124   50                                                      
CONECT  125   53                                                      
CONECT  126   55                                                      
CONECT  127   56                                                      
CONECT  128   57                                                      
CONECT  129   58                                                      
CONECT  130   60                                                      
CONECT  131   64                                                      
CONECT  132   64                                                      
MASTER        0    0    0    0    0    0    0    0  132    0  132    0
END
