COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.216  -0.184  -1.699  1.00  0.00           O  
HETATM    2  O   UNL     1      -8.984   1.484   1.612  1.00  0.00           O  
HETATM    3  C   UNL     1      -7.885   1.295   1.121  1.00  0.00           C  
HETATM    4  N   UNL     1      -7.123   2.339   0.737  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.909   2.128   0.195  1.00  0.00           C  
HETATM    6  O   UNL     1      -5.232   3.079  -0.147  1.00  0.00           O  
HETATM    7  C   UNL     1      -7.395  -0.023   0.955  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.174  -0.205   0.408  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.433   0.881   0.026  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.108   0.684  -0.567  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.174   0.050   0.468  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.870  -0.216  -0.156  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.019  -1.109  -1.314  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.964  -0.464  -2.331  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.186  -1.423  -3.502  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.978  -0.779  -4.502  1.00  0.00           O  
HETATM   17  P   UNL     1      -0.786  -0.854   0.963  1.00  0.00           P  
HETATM   18  S   UNL     1      -1.463  -2.453   1.640  1.00  0.00           S  
HETATM   19  O   UNL     1      -0.579   0.193   2.167  1.00  0.00           O  
HETATM   20  O   UNL     1       0.627  -1.132   0.243  1.00  0.00           O  
HETATM   21  C   UNL     1       1.723  -1.770   0.900  1.00  0.00           C  
HETATM   22  C   UNL     1       2.906  -1.876  -0.065  1.00  0.00           C  
HETATM   23  C   UNL     1       4.107  -2.577   0.618  1.00  0.00           C  
HETATM   24  O   UNL     1       4.006  -3.997   0.495  1.00  0.00           O  
HETATM   25  C   UNL     1       5.306  -2.035  -0.198  1.00  0.00           C  
HETATM   26  C   UNL     1       4.769  -0.743  -0.845  1.00  0.00           C  
HETATM   27  O   UNL     1       3.419  -0.565  -0.386  1.00  0.00           O  
HETATM   28  N   UNL     1       5.592   0.398  -0.437  1.00  0.00           N  
HETATM   29  C   UNL     1       6.322   1.076  -1.375  1.00  0.00           C  
HETATM   30  C   UNL     1       7.081   2.128  -0.999  1.00  0.00           C  
HETATM   31  C   UNL     1       7.891   2.888  -2.017  1.00  0.00           C  
HETATM   32  C   UNL     1       7.103   2.509   0.365  1.00  0.00           C  
HETATM   33  O   UNL     1       7.779   3.454   0.728  1.00  0.00           O  
HETATM   34  N   UNL     1       6.370   1.814   1.258  1.00  0.00           N  
HETATM   35  C   UNL     1       5.619   0.773   0.855  1.00  0.00           C  
HETATM   36  O   UNL     1       4.958   0.159   1.670  1.00  0.00           O  
HETATM   37  H   UNL     1      -7.450   3.244   0.851  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.989  -0.871   1.261  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.783  -1.202   0.273  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.704   1.645  -0.883  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.044   0.734   1.307  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.606  -0.885   0.823  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.045  -1.272  -1.775  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.431  -2.064  -0.987  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.526   0.464  -2.698  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.224  -1.706  -3.928  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.704  -2.315  -3.148  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.159  -1.330  -5.276  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.228   1.050   1.887  1.00  0.00           H  
HETATM   50  H   UNL     1       2.016  -1.183   1.771  1.00  0.00           H  
HETATM   51  H   UNL     1       1.424  -2.768   1.219  1.00  0.00           H  
HETATM   52  H   UNL     1       2.613  -2.406  -0.971  1.00  0.00           H  
HETATM   53  H   UNL     1       4.185  -2.283   1.665  1.00  0.00           H  
HETATM   54  H   UNL     1       4.735  -4.480   0.907  1.00  0.00           H  
HETATM   55  H   UNL     1       6.145  -1.811   0.461  1.00  0.00           H  
HETATM   56  H   UNL     1       5.603  -2.752  -0.962  1.00  0.00           H  
HETATM   57  H   UNL     1       4.781  -0.840  -1.931  1.00  0.00           H  
HETATM   58  H   UNL     1       6.293   0.771  -2.410  1.00  0.00           H  
HETATM   59  H   UNL     1       7.292   3.702  -2.425  1.00  0.00           H  
HETATM   60  H   UNL     1       8.782   3.296  -1.541  1.00  0.00           H  
HETATM   61  H   UNL     1       8.186   2.215  -2.822  1.00  0.00           H  
HETATM   62  H   UNL     1       6.380   2.069   2.194  1.00  0.00           H  
CONECT    1   10   14                                                 
CONECT    2    3    3                                                 
CONECT    3    2    2    4    7                                       
CONECT    4    5    3   37                                            
CONECT    5    6    6    9    4                                       
CONECT    6    5    5                                                 
CONECT    7    3    8    8   38                                       
CONECT    8    9    7    7   39                                       
CONECT    9   10    5    8                                            
CONECT   10    1   11    9   40                                       
CONECT   11   10   12   41   42                                       
CONECT   12   17   11   13                                            
CONECT   13   12   14   43   44                                       
CONECT   14    1   13   15   45                                       
CONECT   15   16   14   46   47                                       
CONECT   16   15   48                                                 
CONECT   17   19   18   18   20                                       
CONECT   17   12                                                      
CONECT   18   17   17                                                 
CONECT   19   17   49                                                 
CONECT   20   17   21                                                 
CONECT   21   20   22   50   51                                       
CONECT   22   21   27   23   52                                       
CONECT   23   22   24   25   53                                       
CONECT   24   23   54                                                 
CONECT   25   23   26   55   56                                       
CONECT   26   27   25   28   57                                       
CONECT   27   22   26                                                 
CONECT   28   26   35   29                                            
CONECT   29   28   30   30   58                                       
CONECT   30   32   31   29   29                                       
CONECT   31   30   59   60   61                                       
CONECT   32   34   33   33   30                                       
CONECT   33   32   32                                                 
CONECT   34   35   32   62                                            
CONECT   35   28   36   36   34                                       
CONECT   36   35   35                                                 
CONECT   37    4                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   29                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
CONECT   61   31                                                      
CONECT   62   34                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
