COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -5.192  -1.534   0.381  1.00  0.00           P  
HETATM    2  N   UNL     1      -4.250  -4.224   3.621  1.00  0.00           N  
HETATM    3  O   UNL     1      -4.277  -0.227   0.164  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.398  -2.601   1.288  1.00  0.00           O  
HETATM    5  O   UNL     1      -5.534  -2.193  -1.047  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.450  -1.149   1.060  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.257  -3.732   1.444  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.558  -4.789   2.301  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.034   0.676  -0.643  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.217   1.946  -0.888  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.891   2.610   0.451  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.123   1.691   1.272  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.003   3.159   2.920  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.723   2.061   2.499  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.926   1.108   3.351  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.600   1.771   4.690  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.791   0.803   5.556  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.465   1.467   6.895  1.00  0.00           C  
HETATM   19  C   UNL     1       0.343   0.499   7.761  1.00  0.00           C  
HETATM   20  C   UNL     1       0.669   1.162   9.100  1.00  0.00           C  
HETATM   21  C   UNL     1       1.478   0.194   9.965  1.00  0.00           C  
HETATM   22  C   UNL     1       1.804   0.858  11.305  1.00  0.00           C  
HETATM   23  C   UNL     1       2.613  -0.109  12.170  1.00  0.00           C  
HETATM   24  C   UNL     1       2.939   0.553  13.510  1.00  0.00           C  
HETATM   25  C   UNL     1       3.748  -0.414  14.375  1.00  0.00           C  
HETATM   26  C   UNL     1       4.074   0.249  15.715  1.00  0.00           C  
HETATM   27  C   UNL     1       4.883  -0.718  16.580  1.00  0.00           C  
HETATM   28  C   UNL     1       5.208  -0.055  17.920  1.00  0.00           C  
HETATM   29  C   UNL     1       6.018  -1.023  18.785  1.00  0.00           C  
HETATM   30  C   UNL     1       6.343  -0.359  20.125  1.00  0.00           C  
HETATM   31  C   UNL     1       7.153  -1.327  20.990  1.00  0.00           C  
HETATM   32  O   UNL     1      -2.982   1.604  -1.571  1.00  0.00           O  
HETATM   33  O   UNL     1      -3.928   1.857  -3.552  1.00  0.00           O  
HETATM   34  C   UNL     1      -2.939   1.587  -2.912  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.658   1.231  -3.621  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.880   1.287  -5.134  1.00  0.00           C  
HETATM   37  C   UNL     1      -0.578   0.926  -5.854  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.800   0.981  -7.366  1.00  0.00           C  
HETATM   39  C   UNL     1       0.500   0.620  -8.086  1.00  0.00           C  
HETATM   40  C   UNL     1       0.278   0.675  -9.599  1.00  0.00           C  
HETATM   41  C   UNL     1       1.579   0.314 -10.318  1.00  0.00           C  
HETATM   42  C   UNL     1       1.358   0.370 -11.831  1.00  0.00           C  
HETATM   43  C   UNL     1       2.659   0.009 -12.551  1.00  0.00           C  
HETATM   44  C   UNL     1       2.437   0.064 -14.064  1.00  0.00           C  
HETATM   45  C   UNL     1       3.738  -0.296 -14.783  1.00  0.00           C  
HETATM   46  C   UNL     1       3.517  -0.241 -16.296  1.00  0.00           C  
HETATM   47  C   UNL     1       4.818  -0.602 -17.016  1.00  0.00           C  
HETATM   48  C   UNL     1       4.596  -0.546 -18.529  1.00  0.00           C  
HETATM   49  C   UNL     1       5.897  -0.908 -19.248  1.00  0.00           C  
HETATM   50  C   UNL     1       5.676  -0.852 -20.761  1.00  0.00           C  
HETATM   51  C   UNL     1       6.977  -1.213 -21.481  1.00  0.00           C  
HETATM   52  H   UNL     1      -3.792  -4.952   4.149  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.564  -3.499   3.472  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.689  -2.429  -1.455  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.181  -3.422   1.931  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.486  -4.152   0.464  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.214  -5.652   2.419  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.634  -5.100   1.813  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.960   0.933  -0.130  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.265   0.203  -1.597  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.794   2.636  -1.504  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.818   2.867   0.963  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.310   3.515   0.276  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.999   0.851   2.838  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.508   0.203   3.525  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.527   2.028   5.203  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.019   2.676   4.516  1.00  0.00           H  
HETATM   68  H   UNL     1       0.135   0.546   5.043  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.373  -0.101   5.730  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.392   1.724   7.408  1.00  0.00           H  
HETATM   71  H   UNL     1       0.116   2.372   6.721  1.00  0.00           H  
HETATM   72  H   UNL     1       1.270   0.242   7.248  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.238  -0.405   7.935  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.257   1.419   9.613  1.00  0.00           H  
HETATM   75  H   UNL     1       1.251   2.067   8.926  1.00  0.00           H  
HETATM   76  H   UNL     1       2.405  -0.062   9.453  1.00  0.00           H  
HETATM   77  H   UNL     1       0.896  -0.710  10.140  1.00  0.00           H  
HETATM   78  H   UNL     1       0.877   1.115  11.818  1.00  0.00           H  
HETATM   79  H   UNL     1       2.385   1.763  11.131  1.00  0.00           H  
HETATM   80  H   UNL     1       3.540  -0.367  11.658  1.00  0.00           H  
HETATM   81  H   UNL     1       2.031  -1.014  12.345  1.00  0.00           H  
HETATM   82  H   UNL     1       2.012   0.810  14.023  1.00  0.00           H  
HETATM   83  H   UNL     1       3.520   1.458  13.335  1.00  0.00           H  
HETATM   84  H   UNL     1       4.675  -0.671  13.863  1.00  0.00           H  
HETATM   85  H   UNL     1       3.166  -1.319  14.550  1.00  0.00           H  
HETATM   86  H   UNL     1       3.147   0.506  16.228  1.00  0.00           H  
HETATM   87  H   UNL     1       4.655   1.154  15.540  1.00  0.00           H  
HETATM   88  H   UNL     1       5.810  -0.976  16.067  1.00  0.00           H  
HETATM   89  H   UNL     1       4.301  -1.623  16.755  1.00  0.00           H  
HETATM   90  H   UNL     1       4.282   0.201  18.432  1.00  0.00           H  
HETATM   91  H   UNL     1       5.790   0.849  17.745  1.00  0.00           H  
HETATM   92  H   UNL     1       6.945  -1.280  18.272  1.00  0.00           H  
HETATM   93  H   UNL     1       5.436  -1.928  18.960  1.00  0.00           H  
HETATM   94  H   UNL     1       5.417  -0.102  20.637  1.00  0.00           H  
HETATM   95  H   UNL     1       6.925   0.545  19.950  1.00  0.00           H  
HETATM   96  H   UNL     1       7.385  -0.855  21.944  1.00  0.00           H  
HETATM   97  H   UNL     1       6.571  -2.232  21.164  1.00  0.00           H  
HETATM   98  H   UNL     1       8.080  -1.585  20.477  1.00  0.00           H  
HETATM   99  H   UNL     1      -0.879   1.941  -3.342  1.00  0.00           H  
HETATM  100  H   UNL     1      -1.352   0.225  -3.335  1.00  0.00           H  
HETATM  101  H   UNL     1      -2.658   0.577  -5.413  1.00  0.00           H  
HETATM  102  H   UNL     1      -2.186   2.293  -5.420  1.00  0.00           H  
HETATM  103  H   UNL     1       0.199   1.635  -5.574  1.00  0.00           H  
HETATM  104  H   UNL     1      -0.273  -0.080  -5.568  1.00  0.00           H  
HETATM  105  H   UNL     1      -1.579   0.271  -7.646  1.00  0.00           H  
HETATM  106  H   UNL     1      -1.106   1.987  -7.652  1.00  0.00           H  
HETATM  107  H   UNL     1       1.279   1.330  -7.807  1.00  0.00           H  
HETATM  108  H   UNL     1       0.806  -0.386  -7.800  1.00  0.00           H  
HETATM  109  H   UNL     1      -0.499  -0.033  -9.878  1.00  0.00           H  
HETATM  110  H   UNL     1      -0.027   1.682  -9.885  1.00  0.00           H  
HETATM  111  H   UNL     1       2.358   1.024 -10.039  1.00  0.00           H  
HETATM  112  H   UNL     1       1.885  -0.691 -10.033  1.00  0.00           H  
HETATM  113  H   UNL     1       0.579  -0.339 -12.111  1.00  0.00           H  
HETATM  114  H   UNL     1       1.052   1.376 -12.117  1.00  0.00           H  
HETATM  115  H   UNL     1       3.438   0.718 -12.272  1.00  0.00           H  
HETATM  116  H   UNL     1       2.965  -0.997 -12.265  1.00  0.00           H  
HETATM  117  H   UNL     1       1.659  -0.645 -14.343  1.00  0.00           H  
HETATM  118  H   UNL     1       2.131   1.070 -14.350  1.00  0.00           H  
HETATM  119  H   UNL     1       4.517   0.413 -14.504  1.00  0.00           H  
HETATM  120  H   UNL     1       4.044  -1.303 -14.498  1.00  0.00           H  
HETATM  121  H   UNL     1       2.738  -0.950 -16.576  1.00  0.00           H  
HETATM  122  H   UNL     1       3.211   0.765 -16.582  1.00  0.00           H  
HETATM  123  H   UNL     1       5.597   0.107 -16.736  1.00  0.00           H  
HETATM  124  H   UNL     1       5.124  -1.608 -16.730  1.00  0.00           H  
HETATM  125  H   UNL     1       3.817  -1.256 -18.808  1.00  0.00           H  
HETATM  126  H   UNL     1       4.290   0.459 -18.814  1.00  0.00           H  
HETATM  127  H   UNL     1       6.676  -0.198 -18.969  1.00  0.00           H  
HETATM  128  H   UNL     1       6.203  -1.914 -18.962  1.00  0.00           H  
HETATM  129  H   UNL     1       4.897  -1.562 -21.040  1.00  0.00           H  
HETATM  130  H   UNL     1       5.370   0.153 -21.047  1.00  0.00           H  
HETATM  131  H   UNL     1       6.819  -1.174 -22.558  1.00  0.00           H  
HETATM  132  H   UNL     1       7.755  -0.504 -21.201  1.00  0.00           H  
HETATM  133  H   UNL     1       7.283  -2.220 -21.195  1.00  0.00           H  
CONECT    1    3    4    5    6                                       
CONECT    1    6                                                      
CONECT    2    8   52   53                                            
CONECT    3    1    9                                                 
CONECT    4    1    7                                                 
CONECT    5    1   54                                                 
CONECT    6    1    1                                                 
CONECT    7    4    8   55   56                                       
CONECT    8    2    7   57   58                                       
CONECT    9    3   10   59   60                                       
CONECT   10    9   11   32   61                                       
CONECT   11   10   12   62   63                                       
CONECT   12   11   14                                                 
CONECT   13   14   14                                                 
CONECT   14   12   13   13   15                                       
CONECT   15   14   16   64   65                                       
CONECT   16   15   17   66   67                                       
CONECT   17   16   18   68   69                                       
CONECT   18   17   19   70   71                                       
CONECT   19   18   20   72   73                                       
CONECT   20   19   21   74   75                                       
CONECT   21   20   22   76   77                                       
CONECT   22   21   23   78   79                                       
CONECT   23   22   24   80   81                                       
CONECT   24   23   25   82   83                                       
CONECT   25   24   26   84   85                                       
CONECT   26   25   27   86   87                                       
CONECT   27   26   28   88   89                                       
CONECT   28   27   29   90   91                                       
CONECT   29   28   30   92   93                                       
CONECT   30   29   31   94   95                                       
CONECT   31   30   96   97   98                                       
CONECT   32   10   34                                                 
CONECT   33   34   34                                                 
CONECT   34   32   33   33   35                                       
CONECT   35   34   36   99  100                                       
CONECT   36   35   37  101  102                                       
CONECT   37   36   38  103  104                                       
CONECT   38   37   39  105  106                                       
CONECT   39   38   40  107  108                                       
CONECT   40   39   41  109  110                                       
CONECT   41   40   42  111  112                                       
CONECT   42   41   43  113  114                                       
CONECT   43   42   44  115  116                                       
CONECT   44   43   45  117  118                                       
CONECT   45   44   46  119  120                                       
CONECT   46   45   47  121  122                                       
CONECT   47   46   48  123  124                                       
CONECT   48   47   49  125  126                                       
CONECT   49   48   50  127  128                                       
CONECT   50   49   51  129  130                                       
CONECT   51   50  131  132  133                                       
CONECT   52    2                                                      
CONECT   53    2                                                      
CONECT   54    5                                                      
CONECT   55    7                                                      
CONECT   56    7                                                      
CONECT   57    8                                                      
CONECT   58    8                                                      
CONECT   59    9                                                      
CONECT   60    9                                                      
CONECT   61   10                                                      
CONECT   62   11                                                      
CONECT   63   11                                                      
CONECT   64   15                                                      
CONECT   65   15                                                      
CONECT   66   16                                                      
CONECT   67   16                                                      
CONECT   68   17                                                      
CONECT   69   17                                                      
CONECT   70   18                                                      
CONECT   71   18                                                      
CONECT   72   19                                                      
CONECT   73   19                                                      
CONECT   74   20                                                      
CONECT   75   20                                                      
CONECT   76   21                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   22                                                      
CONECT   80   23                                                      
CONECT   81   23                                                      
CONECT   82   24                                                      
CONECT   83   24                                                      
CONECT   84   25                                                      
CONECT   85   25                                                      
CONECT   86   26                                                      
CONECT   87   26                                                      
CONECT   88   27                                                      
CONECT   89   27                                                      
CONECT   90   28                                                      
CONECT   91   28                                                      
CONECT   92   29                                                      
CONECT   93   29                                                      
CONECT   94   30                                                      
CONECT   95   30                                                      
CONECT   96   31                                                      
CONECT   97   31                                                      
CONECT   98   31                                                      
CONECT   99   35                                                      
CONECT  100   35                                                      
CONECT  101   36                                                      
CONECT  102   36                                                      
CONECT  103   37                                                      
CONECT  104   37                                                      
CONECT  105   38                                                      
CONECT  106   38                                                      
CONECT  107   39                                                      
CONECT  108   39                                                      
CONECT  109   40                                                      
CONECT  110   40                                                      
CONECT  111   41                                                      
CONECT  112   41                                                      
CONECT  113   42                                                      
CONECT  114   42                                                      
CONECT  115   43                                                      
CONECT  116   43                                                      
CONECT  117   44                                                      
CONECT  118   44                                                      
CONECT  119   45                                                      
CONECT  120   45                                                      
CONECT  121   46                                                      
CONECT  122   46                                                      
CONECT  123   47                                                      
CONECT  124   47                                                      
CONECT  125   48                                                      
CONECT  126   48                                                      
CONECT  127   49                                                      
CONECT  128   49                                                      
CONECT  129   50                                                      
CONECT  130   50                                                      
CONECT  131   51                                                      
CONECT  132   51                                                      
CONECT  133   51                                                      
MASTER        0    0    0    0    0    0    0    0  133    0  133    0
END
