COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.169   4.039  -0.093  1.00  0.00           O  
HETATM    2  P   UNL     1       6.485   2.788   0.653  1.00  0.00           P  
HETATM    3  O   UNL     1       5.173   3.198   1.203  1.00  0.00           O  
HETATM    4  O   UNL     1       6.273   1.586  -0.397  1.00  0.00           O  
HETATM    5  C   UNL     1       5.984   0.245   0.002  1.00  0.00           C  
HETATM    6  C   UNL     1       5.845  -0.638  -1.240  1.00  0.00           C  
HETATM    7  C   UNL     1       4.707  -0.110  -2.117  1.00  0.00           C  
HETATM    8  C   UNL     1       7.153  -0.613  -2.032  1.00  0.00           C  
HETATM    9  C   UNL     1       5.534  -2.074  -0.813  1.00  0.00           C  
HETATM   10  O   UNL     1       6.654  -2.613  -0.107  1.00  0.00           O  
HETATM   11  C   UNL     1       4.324  -2.080   0.085  1.00  0.00           C  
HETATM   12  O   UNL     1       4.440  -2.364   1.258  1.00  0.00           O  
HETATM   13  N   UNL     1       3.112  -1.770  -0.416  1.00  0.00           N  
HETATM   14  C   UNL     1       1.952  -1.682   0.475  1.00  0.00           C  
HETATM   15  C   UNL     1       0.709  -1.318  -0.341  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.484  -1.227   0.575  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.353  -1.433   1.763  1.00  0.00           O  
HETATM   18  N   UNL     1      -1.696  -0.917   0.074  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.856  -0.829   0.965  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.099  -0.465   0.149  1.00  0.00           C  
HETATM   21  S   UNL     1      -5.532  -0.356   1.250  1.00  0.00           S  
HETATM   22  C   UNL     1      -6.747   0.051   0.115  1.00  0.00           C  
HETATM   23  O   UNL     1      -6.465   0.175  -1.058  1.00  0.00           O  
HETATM   24  C   UNL     1      -8.168   0.255   0.574  1.00  0.00           C  
HETATM   25  C   UNL     1      -9.047   0.607  -0.628  1.00  0.00           C  
HETATM   26  C   UNL     1     -10.489   0.815  -0.163  1.00  0.00           C  
HETATM   27  C   UNL     1     -11.368   1.167  -1.365  1.00  0.00           C  
HETATM   28  C   UNL     1     -12.810   1.374  -0.899  1.00  0.00           C  
HETATM   29  H   UNL     1       7.327   4.801   0.481  1.00  0.00           H  
HETATM   30  H   UNL     1       7.325   2.349   1.711  1.00  0.00           H  
HETATM   31  H   UNL     1       6.794  -0.131   0.626  1.00  0.00           H  
HETATM   32  H   UNL     1       5.051   0.228   0.566  1.00  0.00           H  
HETATM   33  H   UNL     1       4.979   0.868  -2.514  1.00  0.00           H  
HETATM   34  H   UNL     1       4.533  -0.801  -2.941  1.00  0.00           H  
HETATM   35  H   UNL     1       3.800  -0.020  -1.520  1.00  0.00           H  
HETATM   36  H   UNL     1       7.951  -1.046  -1.429  1.00  0.00           H  
HETATM   37  H   UNL     1       7.035  -1.193  -2.948  1.00  0.00           H  
HETATM   38  H   UNL     1       7.406   0.417  -2.285  1.00  0.00           H  
HETATM   39  H   UNL     1       5.335  -2.681  -1.696  1.00  0.00           H  
HETATM   40  H   UNL     1       6.888  -2.122   0.692  1.00  0.00           H  
HETATM   41  H   UNL     1       3.007  -1.606  -1.366  1.00  0.00           H  
HETATM   42  H   UNL     1       1.796  -2.643   0.965  1.00  0.00           H  
HETATM   43  H   UNL     1       2.129  -0.914   1.228  1.00  0.00           H  
HETATM   44  H   UNL     1       0.865  -0.357  -0.831  1.00  0.00           H  
HETATM   45  H   UNL     1       0.531  -2.086  -1.094  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.801  -0.753  -0.876  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.012  -1.790   1.455  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.678  -0.061   1.718  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.943   0.495  -0.341  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.276  -1.233  -0.604  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.536  -0.661   1.036  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.202   1.068   1.299  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.679   1.523  -1.091  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.012  -0.206  -1.354  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.857  -0.101   0.300  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.523   1.627   0.563  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.000   2.083  -1.828  1.00  0.00           H  
HETATM   58  H   UNL     1     -11.333   0.354  -2.091  1.00  0.00           H  
HETATM   59  H   UNL     1     -13.436   1.625  -1.756  1.00  0.00           H  
HETATM   60  H   UNL     1     -13.178   0.458  -0.437  1.00  0.00           H  
HETATM   61  H   UNL     1     -12.844   2.187  -0.174  1.00  0.00           H  
CONECT    1    2   29                                                 
CONECT    2    1    3    3    4                                       
CONECT    2   30                                                      
CONECT    3    2    2                                                 
CONECT    4    2    5                                                 
CONECT    5    4    6   31   32                                       
CONECT    6    5    7    8    9                                       
CONECT    7    6   33   34   35                                       
CONECT    8    6   36   37   38                                       
CONECT    9    6   10   11   39                                       
CONECT   10    9   40                                                 
CONECT   11    9   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   41                                            
CONECT   14   13   15   42   43                                       
CONECT   15   14   16   44   45                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   46                                            
CONECT   19   18   20   47   48                                       
CONECT   20   19   21   49   50                                       
CONECT   21   20   22                                                 
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   51   52                                       
CONECT   25   24   26   53   54                                       
CONECT   26   25   27   55   56                                       
CONECT   27   26   28   57   58                                       
CONECT   28   27   59   60   61                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
