COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       9.667  -3.273  -1.360  1.00  0.00           O  
HETATM    2  P   UNL     1       9.442  -2.926   0.195  1.00  0.00           P  
HETATM    3  O   UNL     1       9.006  -4.259   0.985  1.00  0.00           O  
HETATM    4  O   UNL     1      10.701  -2.401   0.770  1.00  0.00           O  
HETATM    5  O   UNL     1       8.284  -1.816   0.336  1.00  0.00           O  
HETATM    6  P   UNL     1       8.217  -0.230   0.065  1.00  0.00           P  
HETATM    7  O   UNL     1       8.982   0.549   1.248  1.00  0.00           O  
HETATM    8  O   UNL     1       8.865   0.078  -1.229  1.00  0.00           O  
HETATM    9  O   UNL     1       6.678   0.241   0.019  1.00  0.00           O  
HETATM   10  C   UNL     1       6.281   1.575  -0.307  1.00  0.00           C  
HETATM   11  C   UNL     1       4.779   1.678  -0.259  1.00  0.00           C  
HETATM   12  C   UNL     1       4.134   2.298  -1.216  1.00  0.00           C  
HETATM   13  C   UNL     1       4.899   3.016  -2.298  1.00  0.00           C  
HETATM   14  C   UNL     1       2.627   2.294  -1.235  1.00  0.00           C  
HETATM   15  C   UNL     1       2.105   3.563  -0.559  1.00  0.00           C  
HETATM   16  C   UNL     1       0.598   3.559  -0.578  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.071   3.608   0.547  1.00  0.00           C  
HETATM   18  C   UNL     1       0.660   3.535   1.863  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.573   3.736   0.525  1.00  0.00           C  
HETATM   20  N   UNL     1      -2.178   2.406   0.628  1.00  0.00           N  
HETATM   21  C   UNL     1      -3.519   2.274   0.629  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.225   3.257   0.544  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.142   0.906   0.734  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.667   1.037   0.712  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.299  -0.352   0.820  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.823  -0.222   0.798  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.455  -1.611   0.905  1.00  0.00           C  
HETATM   28  S   UNL     1      -8.151  -2.586  -0.624  1.00  0.00           S  
HETATM   29  C   UNL     1      -9.654  -3.629  -0.444  1.00  0.00           C  
HETATM   30  C   UNL     1     -10.672  -2.653   0.178  1.00  0.00           C  
HETATM   31  C   UNL     1      -9.993  -1.510   0.947  1.00  0.00           C  
HETATM   32  N   UNL     1     -10.414  -0.297   0.228  1.00  0.00           N  
HETATM   33  C   UNL     1     -11.207  -0.648  -0.794  1.00  0.00           C  
HETATM   34  O   UNL     1     -11.699   0.159  -1.558  1.00  0.00           O  
HETATM   35  N   UNL     1     -11.411  -1.973  -0.897  1.00  0.00           N  
HETATM   36  H   UNL     1       8.881  -3.623  -1.803  1.00  0.00           H  
HETATM   37  H   UNL     1       9.658  -4.972   0.944  1.00  0.00           H  
HETATM   38  H   UNL     1       8.609   0.394   2.126  1.00  0.00           H  
HETATM   39  H   UNL     1       6.717   2.269   0.412  1.00  0.00           H  
HETATM   40  H   UNL     1       6.631   1.823  -1.309  1.00  0.00           H  
HETATM   41  H   UNL     1       4.233   1.241   0.565  1.00  0.00           H  
HETATM   42  H   UNL     1       5.173   2.308  -3.080  1.00  0.00           H  
HETATM   43  H   UNL     1       4.277   3.803  -2.722  1.00  0.00           H  
HETATM   44  H   UNL     1       5.802   3.456  -1.874  1.00  0.00           H  
HETATM   45  H   UNL     1       2.277   2.261  -2.267  1.00  0.00           H  
HETATM   46  H   UNL     1       2.260   1.419  -0.699  1.00  0.00           H  
HETATM   47  H   UNL     1       2.455   3.596   0.473  1.00  0.00           H  
HETATM   48  H   UNL     1       2.473   4.438  -1.095  1.00  0.00           H  
HETATM   49  H   UNL     1       0.070   3.516  -1.519  1.00  0.00           H  
HETATM   50  H   UNL     1       0.979   4.535   2.157  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.004   3.126   2.625  1.00  0.00           H  
HETATM   52  H   UNL     1       1.533   2.891   1.758  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.897   4.349   1.367  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.884   4.206  -0.408  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.614   1.620   0.696  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.818   0.293  -0.107  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.831   0.436   1.667  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.991   1.649   1.554  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.978   1.506  -0.221  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.975  -0.965  -0.021  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.988  -0.822   1.753  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.148   0.391   1.639  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.134   0.248  -0.135  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.079  -2.139   1.781  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.000  -3.980  -1.416  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.464  -4.470   0.223  1.00  0.00           H  
HETATM   67  H   UNL     1     -11.358  -3.190   0.833  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.347  -1.486   1.978  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.159   0.610   0.457  1.00  0.00           H  
HETATM   70  H   UNL     1     -11.955  -2.408  -1.573  1.00  0.00           H  
CONECT    1    2   36                                                 
CONECT    2    1    4    4    5                                       
CONECT    2    3                                                      
CONECT    3    2   37                                                 
CONECT    4    2    2                                                 
CONECT    5    2    6                                                 
CONECT    6    5    8    8    9                                       
CONECT    6    7                                                      
CONECT    7    6   38                                                 
CONECT    8    6    6                                                 
CONECT    9    6   10                                                 
CONECT   10    9   11   39   40                                       
CONECT   11   10   12   12   41                                       
CONECT   12   11   11   13   14                                       
CONECT   13   12   42   43   44                                       
CONECT   14   12   15   45   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   15   17   17   49                                       
CONECT   17   16   16   19   18                                       
CONECT   18   17   50   51   52                                       
CONECT   19   17   20   53   54                                       
CONECT   20   19   21   55                                            
CONECT   21   20   23   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   56   57                                       
CONECT   24   23   25   58   59                                       
CONECT   25   24   26   60   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   26   28   31   64                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   65   66                                       
CONECT   30   29   35   31   67                                       
CONECT   31   27   30   32   68                                       
CONECT   32   31   33   69                                            
CONECT   33   32   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   30   33   70                                            
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    7                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   35                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
