COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1     -10.779   0.197  -1.198  1.00  0.00           C  
HETATM    2  C   UNK A   1      -9.925   1.092  -0.298  1.00  0.00           C  
HETATM    3  C   UNK A   1      -8.467   0.631  -0.356  1.00  0.00           C  
HETATM    4  C   UNK A   1      -7.613   1.526   0.544  1.00  0.00           C  
HETATM    5  C   UNK A   1      -6.155   1.065   0.486  1.00  0.00           C  
HETATM    6  C   UNK A   1      -5.314   1.947   1.372  1.00  0.00           C  
HETATM    7  C   UNK A   1      -3.246   2.616   2.350  1.00  0.00           C  
HETATM    8  C   UNK A   1      -0.399  -1.247   3.039  1.00  0.00           C  
HETATM    9  C   UNK A   1       0.814  -1.890   2.364  1.00  0.00           C  
HETATM   10  C   UNK A   1       1.030  -3.294   2.932  1.00  0.00           C  
HETATM   11  C   UNK A   1       5.101  -8.030   2.044  1.00  0.00           C  
HETATM   12  C   UNK A   1       5.317  -9.434   2.612  1.00  0.00           C  
HETATM   13  C   UNK A   1       6.530 -10.077   1.937  1.00  0.00           C  
HETATM   14  C   UNK A   1      -0.962   3.224   3.161  1.00  0.00           C  
HETATM   15  C   UNK A   1       3.100   3.922   4.043  1.00  0.00           C  
HETATM   16  C   UNK A   0       4.771   3.559   2.307  1.00  0.00           C  
HETATM   17  C   UNK A   0       5.299   3.780   0.913  1.00  0.00           C  
HETATM   18  C   UNK A   0       6.615   3.018   0.740  1.00  0.00           C  
HETATM   19  C   UNK A   0       7.152   3.242  -0.674  1.00  0.00           C  
HETATM   20  C   UNK A   0       8.468   2.481  -0.847  1.00  0.00           C  
HETATM   21  C   UNK A   0      12.711   1.630  -5.437  1.00  0.00           C  
HETATM   22  C   UNK A   0      14.027   0.868  -5.610  1.00  0.00           C  
HETATM   23  C   UNK A   0      14.564   1.092  -7.025  1.00  0.00           C  
HETATM   24  C   UNK A   0      15.880   0.331  -7.198  1.00  0.00           C  
HETATM   25  C   UNK A   0      16.417   0.555  -8.613  1.00  0.00           C  
HETATM   26  C   UNK A   1     -12.237   0.658  -1.140  1.00  0.00           C  
HETATM   27  C   UNK A   1       2.459  -5.340   2.826  1.00  0.00           C  
HETATM   28  C   UNK A   1     -19.173  -0.645  -3.665  1.00  0.00           C  
HETATM   29  C   UNK A   1     -17.715  -1.106  -3.723  1.00  0.00           C  
HETATM   30  C   UNK A   1     -16.861  -0.211  -2.824  1.00  0.00           C  
HETATM   31  C   UNK A   1     -15.403  -0.672  -2.881  1.00  0.00           C  
HETATM   32  C   UNK A   1     -14.549   0.223  -1.982  1.00  0.00           C  
HETATM   33  C   UNK A   1     -13.091  -0.238  -2.039  1.00  0.00           C  
HETATM   34  C   UNK A   1       2.243  -3.936   2.257  1.00  0.00           C  
HETATM   35  C   UNK A   1       3.672  -5.983   2.151  1.00  0.00           C  
HETATM   36  C   UNK A   1       3.888  -7.387   2.719  1.00  0.00           C  
HETATM   37  C   UNK A   0       9.005   2.705  -2.262  1.00  0.00           C  
HETATM   38  C   UNK A   0      10.321   1.943  -2.435  1.00  0.00           C  
HETATM   39  C   UNK A   0      10.858   2.167  -3.850  1.00  0.00           C  
HETATM   40  C   UNK A   0      12.174   1.406  -4.022  1.00  0.00           C  
HETATM   41  O   UNK A   1      -5.827   2.852   1.987  1.00  0.00           O  
HETATM   42  O   UNK A   1      -3.994   1.728   1.478  1.00  0.00           O  
HETATM   43  C   UNK A   1      -1.770   2.214   2.343  1.00  0.00           C  
HETATM   44  C   UNK A   1      -0.611   0.136   2.480  1.00  0.00           C  
HETATM   45  C   UNK A   1     -22.339  -1.975  -5.407  1.00  0.00           C  
HETATM   46  C   UNK A   1     -21.485  -1.080  -4.507  1.00  0.00           C  
HETATM   47  C   UNK A   1     -20.027  -1.541  -4.565  1.00  0.00           C  
HETATM   48  C   UNK A   1       6.745 -11.481   2.505  1.00  0.00           C  
HETATM   49  C   UNK A   1       7.959 -12.123   1.830  1.00  0.00           C  
HETATM   50  C   UNK A   1       1.582   4.117   4.049  1.00  0.00           C  
HETATM   51  C   UNK A   0      17.732  -0.206  -8.785  1.00  0.00           C  
HETATM   52  C   UNK A   1       3.737   4.911   4.985  1.00  0.00           C  
HETATM   53  N   UNK A   1       3.614   4.137   2.688  1.00  0.00           N  
HETATM   54  O   UNK A   1      -1.626   0.893   2.927  1.00  0.00           O  
HETATM   55  O   UNK A   1       0.132   0.564   1.628  1.00  0.00           O  
HETATM   56  O   UNK A   0       5.385   2.861   3.085  1.00  0.00           O  
HETATM   57  O   UNK A   1       4.538   5.713   4.567  1.00  0.00           O  
HETATM   58  S   UNK A   1       0.804   2.832   3.032  1.00  0.00           S  
HETATM   59  H   UNK A   1     -10.418   0.262  -2.224  1.00  0.00           H  
HETATM   60  H   UNK A   1     -10.711  -0.835  -0.854  1.00  0.00           H  
HETATM   61  H   UNK A   1      -9.993   2.124  -0.642  1.00  0.00           H  
HETATM   62  H   UNK A   1     -10.286   1.027   0.728  1.00  0.00           H  
HETATM   63  H   UNK A   1      -8.399  -0.401  -0.012  1.00  0.00           H  
HETATM   64  H   UNK A   1      -8.106   0.696  -1.382  1.00  0.00           H  
HETATM   65  H   UNK A   1      -7.682   2.558   0.199  1.00  0.00           H  
HETATM   66  H   UNK A   1      -7.974   1.461   1.570  1.00  0.00           H  
HETATM   67  H   UNK A   1      -6.087   0.033   0.830  1.00  0.00           H  
HETATM   68  H   UNK A   1      -5.794   1.131  -0.540  1.00  0.00           H  
HETATM   69  H   UNK A   1      -3.345   3.642   1.994  1.00  0.00           H  
HETATM   70  H   UNK A   1      -3.638   2.545   3.364  1.00  0.00           H  
HETATM   71  H   UNK A   1      -1.284  -1.855   2.851  1.00  0.00           H  
HETATM   72  H   UNK A   1      -0.225  -1.181   4.113  1.00  0.00           H  
HETATM   73  H   UNK A   1       0.640  -1.955   1.290  1.00  0.00           H  
HETATM   74  H   UNK A   1       1.699  -1.282   2.553  1.00  0.00           H  
HETATM   75  H   UNK A   1       1.204  -3.228   4.006  1.00  0.00           H  
HETATM   76  H   UNK A   1       0.145  -3.902   2.744  1.00  0.00           H  
HETATM   77  H   UNK A   1       5.986  -7.422   2.232  1.00  0.00           H  
HETATM   78  H   UNK A   1       4.927  -8.095   0.970  1.00  0.00           H  
HETATM   79  H   UNK A   1       5.490  -9.368   3.686  1.00  0.00           H  
HETATM   80  H   UNK A   1       4.432 -10.042   2.424  1.00  0.00           H  
HETATM   81  H   UNK A   1       6.356 -10.142   0.863  1.00  0.00           H  
HETATM   82  H   UNK A   1       7.415  -9.469   2.125  1.00  0.00           H  
HETATM   83  H   UNK A   1      -1.141   4.228   2.777  1.00  0.00           H  
HETATM   84  H   UNK A   1      -1.270   3.175   4.205  1.00  0.00           H  
HETATM   85  H   UNK A   1       3.338   2.909   4.366  1.00  0.00           H  
HETATM   86  H   UNK A   0       4.572   3.417   0.187  1.00  0.00           H  
HETATM   87  H   UNK A   0       5.472   4.844   0.754  1.00  0.00           H  
HETATM   88  H   UNK A   0       7.343   3.381   1.467  1.00  0.00           H  
HETATM   89  H   UNK A   0       6.443   1.954   0.899  1.00  0.00           H  
HETATM   90  H   UNK A   0       6.425   2.880  -1.401  1.00  0.00           H  
HETATM   91  H   UNK A   0       7.325   4.307  -0.833  1.00  0.00           H  
HETATM   92  H   UNK A   0       9.196   2.843  -0.121  1.00  0.00           H  
HETATM   93  H   UNK A   0       8.295   1.416  -0.688  1.00  0.00           H  
HETATM   94  H   UNK A   0      12.884   2.694  -5.596  1.00  0.00           H  
HETATM   95  H   UNK A   0      11.983   1.268  -6.164  1.00  0.00           H  
HETATM   96  H   UNK A   0      14.754   1.231  -4.884  1.00  0.00           H  
HETATM   97  H   UNK A   0      13.854  -0.196  -5.451  1.00  0.00           H  
HETATM   98  H   UNK A   0      13.836   0.730  -7.751  1.00  0.00           H  
HETATM   99  H   UNK A   0      14.736   2.157  -7.184  1.00  0.00           H  
HETATM  100  H   UNK A   0      16.607   0.693  -6.471  1.00  0.00           H  
HETATM  101  H   UNK A   0      15.707  -0.733  -7.039  1.00  0.00           H  
HETATM  102  H   UNK A   0      15.689   0.193  -9.339  1.00  0.00           H  
HETATM  103  H   UNK A   0      16.589   1.620  -8.771  1.00  0.00           H  
HETATM  104  H   UNK A   1     -12.598   0.592  -0.114  1.00  0.00           H  
HETATM  105  H   UNK A   1     -12.306   1.690  -1.484  1.00  0.00           H  
HETATM  106  H   UNK A   1       2.633  -5.275   3.900  1.00  0.00           H  
HETATM  107  H   UNK A   1       1.574  -5.948   2.637  1.00  0.00           H  
HETATM  108  H   UNK A   1     -19.534  -0.711  -2.639  1.00  0.00           H  
HETATM  109  H   UNK A   1     -19.241   0.387  -4.010  1.00  0.00           H  
HETATM  110  H   UNK A   1     -17.647  -2.138  -3.379  1.00  0.00           H  
HETATM  111  H   UNK A   1     -17.354  -1.041  -4.749  1.00  0.00           H  
HETATM  112  H   UNK A   1     -16.929   0.821  -3.168  1.00  0.00           H  
HETATM  113  H   UNK A   1     -17.222  -0.276  -1.797  1.00  0.00           H  
HETATM  114  H   UNK A   1     -15.335  -1.704  -2.537  1.00  0.00           H  
HETATM  115  H   UNK A   1     -15.042  -0.607  -3.908  1.00  0.00           H  
HETATM  116  H   UNK A   1     -14.617   1.255  -2.326  1.00  0.00           H  
HETATM  117  H   UNK A   1     -14.910   0.158  -0.956  1.00  0.00           H  
HETATM  118  H   UNK A   1     -12.730  -0.172  -3.066  1.00  0.00           H  
HETATM  119  H   UNK A   1     -13.023  -1.270  -1.695  1.00  0.00           H  
HETATM  120  H   UNK A   1       2.069  -4.002   1.183  1.00  0.00           H  
HETATM  121  H   UNK A   1       3.128  -3.328   2.446  1.00  0.00           H  
HETATM  122  H   UNK A   1       3.498  -6.049   1.077  1.00  0.00           H  
HETATM  123  H   UNK A   1       4.557  -5.375   2.339  1.00  0.00           H  
HETATM  124  H   UNK A   1       3.003  -7.995   2.530  1.00  0.00           H  
HETATM  125  H   UNK A   1       4.062  -7.322   3.793  1.00  0.00           H  
HETATM  126  H   UNK A   0       8.278   2.342  -2.989  1.00  0.00           H  
HETATM  127  H   UNK A   0       9.178   3.769  -2.421  1.00  0.00           H  
HETATM  128  H   UNK A   0      11.048   2.306  -1.708  1.00  0.00           H  
HETATM  129  H   UNK A   0      10.148   0.879  -2.276  1.00  0.00           H  
HETATM  130  H   UNK A   0      10.131   1.805  -4.576  1.00  0.00           H  
HETATM  131  H   UNK A   0      11.031   3.232  -4.009  1.00  0.00           H  
HETATM  132  H   UNK A   0      12.001   0.341  -3.864  1.00  0.00           H  
HETATM  133  H   UNK A   0      12.901   1.768  -3.296  1.00  0.00           H  
HETATM  134  H   UNK A   1      -1.402   2.200   1.317  1.00  0.00           H  
HETATM  135  H   UNK A   1     -21.978  -1.910  -6.433  1.00  0.00           H  
HETATM  136  H   UNK A   1     -22.271  -3.007  -5.062  1.00  0.00           H  
HETATM  137  H   UNK A   1     -23.378  -1.646  -5.366  1.00  0.00           H  
HETATM  138  H   UNK A   1     -21.553  -0.048  -4.851  1.00  0.00           H  
HETATM  139  H   UNK A   1     -21.846  -1.145  -3.481  1.00  0.00           H  
HETATM  140  H   UNK A   1     -19.666  -1.475  -5.591  1.00  0.00           H  
HETATM  141  H   UNK A   1     -19.959  -2.573  -4.221  1.00  0.00           H  
HETATM  142  H   UNK A   1       6.919 -11.415   3.579  1.00  0.00           H  
HETATM  143  H   UNK A   1       5.860 -12.089   2.317  1.00  0.00           H  
HETATM  144  H   UNK A   1       8.112 -13.124   2.235  1.00  0.00           H  
HETATM  145  H   UNK A   1       7.785 -12.189   0.756  1.00  0.00           H  
HETATM  146  H   UNK A   1       8.844 -11.515   2.018  1.00  0.00           H  
HETATM  147  H   UNK A   1       1.211   4.045   5.071  1.00  0.00           H  
HETATM  148  H   UNK A   1       1.340   5.099   3.643  1.00  0.00           H  
HETATM  149  H   UNK A   0      18.460   0.156  -8.059  1.00  0.00           H  
HETATM  150  H   UNK A   0      17.560  -1.271  -8.626  1.00  0.00           H  
HETATM  151  H   UNK A   0      18.115  -0.047  -9.793  1.00  0.00           H  
HETATM  152  H   UNK A   1       3.122   4.695   2.065  1.00  0.00           H  
HETATM  153  O   UNK A   1       3.414   4.902   6.287  1.00  0.00           O  
HETATM  154  H   UNK A   1       3.849   5.555   6.852  1.00  0.00           H  
CONECT    1   26    2   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   41   41   42                                       
CONECT    7   42   43   69   70                                       
CONECT    8    9   44   71   72                                       
CONECT    9   10    8   73   74                                       
CONECT   10   34    9   75   76                                       
CONECT   11   12   36   77   78                                       
CONECT   12   13   11   79   80                                       
CONECT   13   48   12   81   82                                       
CONECT   14   43   58   83   84                                       
CONECT   15   50   53   52   85                                       
CONECT   16   53   17   56   56                                       
CONECT   17   18   16   86   87                                       
CONECT   18   19   17   88   89                                       
CONECT   19   20   18   90   91                                       
CONECT   20   37   19   92   93                                       
CONECT   21   22   40   94   95                                       
CONECT   22   23   21   96   97                                       
CONECT   23   24   22   98   99                                       
CONECT   24   25   23  100  101                                       
CONECT   25   51   24  102  103                                       
CONECT   26    1   33  104  105                                       
CONECT   27   35   34  106  107                                       
CONECT   28   47   29  108  109                                       
CONECT   29   28   30  110  111                                       
CONECT   30   29   31  112  113                                       
CONECT   31   30   32  114  115                                       
CONECT   32   31   33  116  117                                       
CONECT   33   32   26  118  119                                       
CONECT   34   27   10  120  121                                       
CONECT   35   36   27  122  123                                       
CONECT   36   11   35  124  125                                       
CONECT   37   38   20  126  127                                       
CONECT   38   39   37  128  129                                       
CONECT   39   40   38  130  131                                       
CONECT   40   21   39  132  133                                       
CONECT   41    6    6                                                 
CONECT   42    6    7                                                 
CONECT   43   54    7   14  134                                       
CONECT   44   55   55    8   54                                       
CONECT   45   46  135  136  137                                       
CONECT   46   45   47  138  139                                       
CONECT   47   46   28  140  141                                       
CONECT   48   49   13  142  143                                       
CONECT   49   48  144  145  146                                       
CONECT   50   58   15  147  148                                       
CONECT   51   25  149  150  151                                       
CONECT   52   57   57   15  153                                       
CONECT   53   15   16  152                                            
CONECT   54   44   43                                                 
CONECT   55   44   44                                                 
CONECT   56   16   16                                                 
CONECT   57   52   52                                                 
CONECT   58   14   50                                                 
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    7                                                      
CONECT   70    7                                                      
CONECT   71    8                                                      
CONECT   72    8                                                      
CONECT   73    9                                                      
CONECT   74    9                                                      
CONECT   75   10                                                      
CONECT   76   10                                                      
CONECT   77   11                                                      
CONECT   78   11                                                      
CONECT   79   12                                                      
CONECT   80   12                                                      
CONECT   81   13                                                      
CONECT   82   13                                                      
CONECT   83   14                                                      
CONECT   84   14                                                      
CONECT   85   15                                                      
CONECT   86   17                                                      
CONECT   87   17                                                      
CONECT   88   18                                                      
CONECT   89   18                                                      
CONECT   90   19                                                      
CONECT   91   19                                                      
CONECT   92   20                                                      
CONECT   93   20                                                      
CONECT   94   21                                                      
CONECT   95   21                                                      
CONECT   96   22                                                      
CONECT   97   22                                                      
CONECT   98   23                                                      
CONECT   99   23                                                      
CONECT  100   24                                                      
CONECT  101   24                                                      
CONECT  102   25                                                      
CONECT  103   25                                                      
CONECT  104   26                                                      
CONECT  105   26                                                      
CONECT  106   27                                                      
CONECT  107   27                                                      
CONECT  108   28                                                      
CONECT  109   28                                                      
CONECT  110   29                                                      
CONECT  111   29                                                      
CONECT  112   30                                                      
CONECT  113   30                                                      
CONECT  114   31                                                      
CONECT  115   31                                                      
CONECT  116   32                                                      
CONECT  117   32                                                      
CONECT  118   33                                                      
CONECT  119   33                                                      
CONECT  120   34                                                      
CONECT  121   34                                                      
CONECT  122   35                                                      
CONECT  123   35                                                      
CONECT  124   36                                                      
CONECT  125   36                                                      
CONECT  126   37                                                      
CONECT  127   37                                                      
CONECT  128   38                                                      
CONECT  129   38                                                      
CONECT  130   39                                                      
CONECT  131   39                                                      
CONECT  132   40                                                      
CONECT  133   40                                                      
CONECT  134   43                                                      
CONECT  135   45                                                      
CONECT  136   45                                                      
CONECT  137   45                                                      
CONECT  138   46                                                      
CONECT  139   46                                                      
CONECT  140   47                                                      
CONECT  141   47                                                      
CONECT  142   48                                                      
CONECT  143   48                                                      
CONECT  144   49                                                      
CONECT  145   49                                                      
CONECT  146   49                                                      
CONECT  147   50                                                      
CONECT  148   50                                                      
CONECT  149   51                                                      
CONECT  150   51                                                      
CONECT  151   51                                                      
CONECT  152   53                                                      
CONECT  153   52  154                                                 
CONECT  154  153                                                      
MASTER        0    0    0    0    0    0    0    0  154    0  154    0
END
