COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   3       5.482   0.035  -2.603  1.00  0.00           C  
HETATM    2  C   UNK A   2       3.557   1.545   0.847  1.00  0.00           C  
HETATM    3  C   UNK A   3       6.772  -2.613   1.474  1.00  0.00           C  
HETATM    4  C   UNK A   1       6.059   4.036   1.313  1.00  0.00           C  
HETATM    5  C   UNK A   3       9.340  -0.740  -1.531  1.00  0.00           C  
HETATM    6  C   UNK A   3       1.698   1.511  -0.767  1.00  0.00           C  
HETATM    7  C   UNK A   2       4.400   2.246   1.873  1.00  0.00           C  
HETATM    8  C   UNK A   1       6.995   3.750   0.187  1.00  0.00           C  
HETATM    9  C   UNK A   3       2.140   0.677  -1.960  1.00  0.00           C  
HETATM   10  C   UNK A   2       5.539   1.338   2.342  1.00  0.00           C  
HETATM   11  C   UNK A   1       8.101   2.795   0.626  1.00  0.00           C  
HETATM   12  C   UNK A   3       2.575  -0.731  -1.572  1.00  0.00           C  
HETATM   13  C   UNK A   2       4.947   0.188   3.152  1.00  0.00           C  
HETATM   14  C   UNK A   1       9.091   2.570  -0.517  1.00  0.00           C  
HETATM   15  C   UNK A   3       3.462  -1.344  -2.667  1.00  0.00           C  
HETATM   16  C   UNK A   2       5.733  -1.101   3.056  1.00  0.00           C  
HETATM   17  C   UNK A   1       9.917   1.302  -0.265  1.00  0.00           C  
HETATM   18  C   UNK A   3       6.897  -3.695   2.518  1.00  0.00           C  
HETATM   19  C   UNK A   3       5.115   0.902  -3.779  1.00  0.00           C  
HETATM   20  C   UNK A   3      10.671  -0.821  -2.225  1.00  0.00           C  
HETATM   21  C   UNK A   3       0.840   0.709   0.170  1.00  0.00           C  
ATOM     22  CA  SER A   4      -1.279  -0.339   0.761  1.00  0.00           C  
ATOM     23  CB  SER A   4      -1.889   0.588   1.815  1.00  0.00           C  
ATOM     24  C   SER A   4      -2.382  -1.008  -0.017  1.00  0.00           C  
HETATM   25  C   UNK A   5      -4.353  -2.436  -0.137  1.00  0.00           C  
HETATM   26  C   UNK A   5      -3.847  -3.737  -0.707  1.00  0.00           C  
HETATM   27  C   UNK A   5      -5.537  -2.712   0.791  1.00  0.00           C  
HETATM   28  C   UNK A   5      -7.276  -1.623   2.281  1.00  0.00           C  
HETATM   29  C   UNK A   5      -8.361  -0.566   2.135  1.00  0.00           C  
HETATM   30  C   UNK A   5      -8.028   0.533   1.101  1.00  0.00           C  
HETATM   31  C   UNK A   5      -6.050  -1.392   1.369  1.00  0.00           C  
HETATM   32  C   UNK A   5      -9.563   2.193   0.215  1.00  0.00           C  
HETATM   33  C   UNK A   5      -9.946  -0.081  -0.289  1.00  0.00           C  
HETATM   34  C   UNK A   5     -11.414   1.604  -1.120  1.00  0.00           C  
HETATM   35  C   UNK A   5     -11.041   0.245  -1.012  1.00  0.00           C  
HETATM   36  C   UNK A   5     -11.011   3.975  -0.598  1.00  0.00           C  
HETATM   37  C   UNK A   5     -13.282   1.014  -2.344  1.00  0.00           C  
HETATM   38 FE   UNK A   3       6.872  -1.188  -0.728  1.00  0.00          Fe  
HETATM   39  S   UNK A   5      -6.780  -0.328   0.048  1.00  0.00           S  
HETATM   40  N   UNK A   3       2.807   2.162  -0.074  1.00  0.00           N  
HETATM   41  N   UNK A   2       4.831   3.561   1.478  1.00  0.00           N  
HETATM   42  N   UNK A   3       4.863  -1.096  -2.353  1.00  0.00           N  
HETATM   43  N   UNK A   2       6.066  -1.519   1.706  1.00  0.00           N  
HETATM   44  N   UNK A   3       9.110   0.120  -0.567  1.00  0.00           N  
ATOM     45  N   SER A   4      -0.442   0.443  -0.152  1.00  0.00           N  
HETATM   46  N   UNK A   5      -3.280  -1.785   0.620  1.00  0.00           N  
HETATM   47  N   UNK A   5     -10.647   2.560  -0.496  1.00  0.00           N  
HETATM   48  N   UNK A   5      -9.213   0.898   0.321  1.00  0.00           N  
HETATM   49  N   UNK A   5     -14.127   0.330  -1.548  1.00  0.00           N  
HETATM   50  N   UNK A   5     -12.486   1.955  -1.824  1.00  0.00           N  
HETATM   51  N   UNK A   1       6.228   3.180  -0.931  1.00  0.00           N  
HETATM   52  O   UNK A   3       6.418   0.331  -1.934  1.00  0.00           O  
HETATM   53  O   UNK A   2       3.581   0.332   0.869  1.00  0.00           O  
HETATM   54  O   UNK A   3       7.306  -2.740   0.419  1.00  0.00           O  
HETATM   55  O   UNK A   1       6.470   4.794   2.181  1.00  0.00           O  
HETATM   56  O   UNK A   3       8.467  -1.496  -1.865  1.00  0.00           O  
HETATM   57  O   UNK A   3       5.682  -2.064  -1.725  1.00  0.00           O  
HETATM   58  O   UNK A   2       5.673  -0.822   0.550  1.00  0.00           O  
HETATM   59  O   UNK A   3       7.969  -0.135   0.213  1.00  0.00           O  
HETATM   60  O   UNK A   3       1.300   0.300   1.215  1.00  0.00           O  
ATOM     61  OG  SER A   4      -2.779   1.509   1.181  1.00  0.00           O  
ATOM     62  O   SER A   4      -2.461  -0.848  -1.217  1.00  0.00           O  
HETATM   63  O   UNK A   5      -4.662  -4.509  -1.442  1.00  0.00           O  
HETATM   64  O   UNK A   5      -2.708  -4.084  -0.501  1.00  0.00           O  
HETATM   65  O   UNK A   5      -5.119  -3.568   1.856  1.00  0.00           O  
HETATM   66  O   UNK A   5      -8.893   3.042   0.768  1.00  0.00           O  
HETATM   67  O   UNK A   5     -13.242   0.774  -3.538  1.00  0.00           O  
HETATM   68  O   UNK A   5      -9.573  -1.209   1.736  1.00  0.00           O  
HETATM   69  O   UNK A   5      -6.836  -1.634   3.641  1.00  0.00           O  
HETATM   70  H   UNK A   3       1.052   2.320  -1.167  1.00  0.00           H  
HETATM   71  H   UNK A   2       3.742   2.378   2.769  1.00  0.00           H  
HETATM   72  H   UNK A   1       7.440   4.689  -0.149  1.00  0.00           H  
HETATM   73  H   UNK A   3       2.960   1.197  -2.465  1.00  0.00           H  
HETATM   74  H   UNK A   3       1.308   0.603  -2.671  1.00  0.00           H  
HETATM   75  H   UNK A   2       6.217   1.914   2.977  1.00  0.00           H  
HETATM   76  H   UNK A   2       6.086   0.956   1.486  1.00  0.00           H  
HETATM   77  H   UNK A   1       8.637   3.225   1.479  1.00  0.00           H  
HETATM   78  H   UNK A   1       7.674   1.843   0.937  1.00  0.00           H  
HETATM   79  H   UNK A   3       1.690  -1.375  -1.451  1.00  0.00           H  
HETATM   80  H   UNK A   3       3.128  -0.730  -0.643  1.00  0.00           H  
HETATM   81  H   UNK A   2       3.917   0.010   2.836  1.00  0.00           H  
HETATM   82  H   UNK A   2       4.915   0.498   4.207  1.00  0.00           H  
HETATM   83  H   UNK A   1       8.553   2.460  -1.460  1.00  0.00           H  
HETATM   84  H   UNK A   1       9.765   3.427  -0.585  1.00  0.00           H  
HETATM   85  H   UNK A   3       3.187  -0.928  -3.633  1.00  0.00           H  
HETATM   86  H   UNK A   3       3.282  -2.424  -2.688  1.00  0.00           H  
HETATM   87  H   UNK A   2       5.145  -1.897   3.531  1.00  0.00           H  
HETATM   88  H   UNK A   2       6.664  -0.990   3.627  1.00  0.00           H  
HETATM   89  H   UNK A   1      10.820   1.340  -0.865  1.00  0.00           H  
HETATM   90  H   UNK A   1      10.199   1.276   0.795  1.00  0.00           H  
HETATM   91  H   UNK A   3       7.948  -3.831   2.776  1.00  0.00           H  
HETATM   92  H   UNK A   3       6.497  -4.629   2.123  1.00  0.00           H  
HETATM   93  H   UNK A   3       6.338  -3.408   3.409  1.00  0.00           H  
HETATM   94  H   UNK A   3       5.404   1.933  -3.575  1.00  0.00           H  
HETATM   95  H   UNK A   3       4.039   0.853  -3.946  1.00  0.00           H  
HETATM   96  H   UNK A   3       5.637   0.548  -4.668  1.00  0.00           H  
HETATM   97  H   UNK A   3      10.539  -0.622  -3.289  1.00  0.00           H  
HETATM   98  H   UNK A   3      11.090  -1.819  -2.092  1.00  0.00           H  
HETATM   99  H   UNK A   3      11.349  -0.082  -1.798  1.00  0.00           H  
ATOM    100  HA  SER A   4      -0.670  -1.097   1.254  1.00  0.00           H  
ATOM    101  HB1 SER A   4      -1.094   1.139   2.318  1.00  0.00           H  
ATOM    102  HB2 SER A   4      -2.439  -0.004   2.546  1.00  0.00           H  
HETATM  103  H   UNK A   5      -4.672  -1.784  -0.950  1.00  0.00           H  
HETATM  104  H   UNK A   5      -6.335  -3.197   0.227  1.00  0.00           H  
HETATM  105  H   UNK A   5      -7.705  -2.597   2.047  1.00  0.00           H  
HETATM  106  H   UNK A   5      -8.521  -0.095   3.105  1.00  0.00           H  
HETATM  107  H   UNK A   5      -7.595   1.408   1.585  1.00  0.00           H  
HETATM  108  H   UNK A   5      -5.258  -0.866   1.902  1.00  0.00           H  
HETATM  109  H   UNK A   5      -9.650  -1.115  -0.194  1.00  0.00           H  
HETATM  110  H   UNK A   5     -11.625  -0.523  -1.497  1.00  0.00           H  
HETATM  111  H   UNK A   5     -10.693   4.499   0.303  1.00  0.00           H  
HETATM  112  H   UNK A   5     -12.091   4.066  -0.709  1.00  0.00           H  
HETATM  113  H   UNK A   5     -10.519   4.415  -1.466  1.00  0.00           H  
HETATM  114  H   UNK A   3       3.012   3.095  -0.300  1.00  0.00           H  
HETATM  115  H   UNK A   2       4.106   4.215   1.316  1.00  0.00           H  
ATOM    116  H   SER A   4      -0.810   0.770  -0.987  1.00  0.00           H  
HETATM  117  H   UNK A   5      -3.217  -1.914   1.579  1.00  0.00           H  
HETATM  118  H   UNK A   5     -14.704  -0.352  -1.925  1.00  0.00           H  
HETATM  119  H   UNK A   5     -14.159   0.520  -0.597  1.00  0.00           H  
HETATM  120  H   UNK A   1       5.519   3.856  -1.171  1.00  0.00           H  
HETATM  121  H   UNK A   1       6.858   3.128  -1.718  1.00  0.00           H  
ATOM    122  H   SER A   4      -3.141   2.073   1.878  1.00  0.00           H  
HETATM  123  H   UNK A   5      -4.338  -5.344  -1.807  1.00  0.00           H  
HETATM  124  H   UNK A   5      -4.414  -3.103   2.328  1.00  0.00           H  
HETATM  125  H   UNK A   5      -9.807  -1.827   2.442  1.00  0.00           H  
HETATM  126  H   UNK A   5      -7.621  -1.780   4.187  1.00  0.00           H  
CONECT    1   19   42   52   52                                       
CONECT    2    7   40   53   53                                       
CONECT    3   18   43   54   54                                       
CONECT    4    8   41   55   55                                       
CONECT    5   20   44   56   56                                       
CONECT    6    9   21   40   70                                       
CONECT    7    2   10   41   71                                       
CONECT    8    4   11   51   72                                       
CONECT    9    6   12   73   74                                       
CONECT   10    7   13   75   76                                       
CONECT   11    8   14   77   78                                       
CONECT   12    9   15   79   80                                       
CONECT   13   10   16   81   82                                       
CONECT   14   11   17   83   84                                       
CONECT   15   12   42   85   86                                       
CONECT   16   13   43   87   88                                       
CONECT   17   14   44   89   90                                       
CONECT   18    3   91   92   93                                       
CONECT   19    1   94   95   96                                       
CONECT   20    5   97   98   99                                       
CONECT   21    6   45   60   60                                       
CONECT   22   23   24   45  100                                       
CONECT   23   22   61  101  102                                       
CONECT   24   22   46   62   62                                       
CONECT   25   26   27   46  103                                       
CONECT   26   25   63   64   64                                       
CONECT   27   25   31   65  104                                       
CONECT   28   29   31   69  105                                       
CONECT   29   28   30   68  106                                       
CONECT   30   29   39   48  107                                       
CONECT   31   27   28   39  108                                       
CONECT   32   47   48   66   66                                       
CONECT   33   35   35   48  109                                       
CONECT   34   35   47   50   50                                       
CONECT   35   33   33   34  110                                       
CONECT   36   47  111  112  113                                       
CONECT   37   49   50   67   67                                       
CONECT   38   52   54   56   57                                       
CONECT   38   58   59                                                 
CONECT   39   30   31                                                 
CONECT   40    2    6  114                                            
CONECT   41    4    7  115                                            
CONECT   42    1   15   57                                            
CONECT   43    3   16   58                                            
CONECT   44    5   17   59                                            
CONECT   45   21   22  116                                            
CONECT   46   24   25  117                                            
CONECT   47   32   34   36                                            
CONECT   48   30   32   33                                            
CONECT   49   37  118  119                                            
CONECT   50   34   34   37                                            
CONECT   51    8  120  121                                            
CONECT   52    1    1   38                                            
CONECT   53    2    2                                                 
CONECT   54    3    3   38                                            
CONECT   55    4    4                                                 
CONECT   56    5    5   38                                            
CONECT   57   38   42                                                 
CONECT   58   38   43                                                 
CONECT   59   38   44                                                 
CONECT   60   21   21                                                 
CONECT   61   23  122                                                 
CONECT   62   24   24                                                 
CONECT   63   26  123                                                 
CONECT   64   26   26                                                 
CONECT   65   27  124                                                 
CONECT   66   32   32                                                 
CONECT   67   37   37                                                 
CONECT   68   29  125                                                 
CONECT   69   28  126                                                 
CONECT   70    6                                                      
CONECT   71    7                                                      
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   15                                                      
CONECT   87   16                                                      
CONECT   88   16                                                      
CONECT   89   17                                                      
CONECT   90   17                                                      
CONECT   91   18                                                      
CONECT   92   18                                                      
CONECT   93   18                                                      
CONECT   94   19                                                      
CONECT   95   19                                                      
CONECT   96   19                                                      
CONECT   97   20                                                      
CONECT   98   20                                                      
CONECT   99   20                                                      
CONECT  100   22                                                      
CONECT  101   23                                                      
CONECT  102   23                                                      
CONECT  103   25                                                      
CONECT  104   27                                                      
CONECT  105   28                                                      
CONECT  106   29                                                      
CONECT  107   30                                                      
CONECT  108   31                                                      
CONECT  109   33                                                      
CONECT  110   35                                                      
CONECT  111   36                                                      
CONECT  112   36                                                      
CONECT  113   36                                                      
CONECT  114   40                                                      
CONECT  115   41                                                      
CONECT  116   45                                                      
CONECT  117   46                                                      
CONECT  118   49                                                      
CONECT  119   49                                                      
CONECT  120   51                                                      
CONECT  121   51                                                      
CONECT  122   61                                                      
CONECT  123   63                                                      
CONECT  124   65                                                      
CONECT  125   68                                                      
CONECT  126   69                                                      
MASTER        0    0    0    0    0    0    0    0  126    0  126    0
END
