COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.257   0.793   1.022  1.00  0.00           O  
HETATM    2  O   UNL     1       6.199   0.022  -1.205  1.00  0.00           O  
HETATM    3  O   UNL     1      -4.408   2.439   0.967  1.00  0.00           O  
HETATM    4  O   UNL     1       8.343   0.377  -0.290  1.00  0.00           O  
HETATM    5  C   UNL     1       4.860  -0.102  -1.010  1.00  0.00           C  
HETATM    6  C   UNL     1       4.071   1.026  -0.863  1.00  0.00           C  
HETATM    7  N   UNL     1       7.063  -1.510   0.654  1.00  0.00           N  
HETATM    8  C   UNL     1       2.702   0.910  -0.664  1.00  0.00           C  
HETATM    9  C   UNL     1       2.125  -0.343  -0.622  1.00  0.00           C  
HETATM   10  C   UNL     1       2.917  -1.474  -0.764  1.00  0.00           C  
HETATM   11  S   UNL     1       7.013   0.043   0.082  1.00  0.00           S  
HETATM   12  C   UNL     1       4.276  -1.360  -0.963  1.00  0.00           C  
HETATM   13  C   UNL     1       1.911   2.179  -0.488  1.00  0.00           C  
HETATM   14  C   UNL     1       0.414   1.927  -0.667  1.00  0.00           C  
HETATM   15  C   UNL     1       0.027   0.720   0.188  1.00  0.00           C  
HETATM   16  C   UNL     1       0.646  -0.529  -0.440  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.488   0.544   0.236  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.808  -0.666   1.125  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.181  -1.923   0.527  1.00  0.00           C  
HETATM   20  C   UNL     1       0.339  -1.744   0.431  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.236  -0.431   2.525  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.155   1.779   0.846  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.630   1.510   0.999  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.101   0.265   1.169  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.301  -0.813   1.227  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.788  -1.915   1.362  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.548   0.074   1.298  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.149  -0.145  -0.066  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.263  -1.425  -0.586  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.823  -1.579  -1.845  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.246  -0.459  -2.535  1.00  0.00           C  
HETATM   32  N   UNL     1      -7.122   0.744  -2.009  1.00  0.00           N  
HETATM   33  C   UNL     1      -6.599   0.928  -0.812  1.00  0.00           C  
HETATM   34  H   UNL     1       4.525   2.005  -0.904  1.00  0.00           H  
HETATM   35  H   UNL     1       6.701  -1.716   1.531  1.00  0.00           H  
HETATM   36  H   UNL     1       7.454  -2.214   0.113  1.00  0.00           H  
HETATM   37  H   UNL     1       2.463  -2.453  -0.722  1.00  0.00           H  
HETATM   38  H   UNL     1       4.885  -2.245  -1.077  1.00  0.00           H  
HETATM   39  H   UNL     1       2.090   2.576   0.511  1.00  0.00           H  
HETATM   40  H   UNL     1       2.241   2.910  -1.227  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.147   2.803  -0.342  1.00  0.00           H  
HETATM   42  H   UNL     1       0.199   1.720  -1.715  1.00  0.00           H  
HETATM   43  H   UNL     1       0.414   0.851   1.198  1.00  0.00           H  
HETATM   44  H   UNL     1       0.191  -0.691  -1.417  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.869   0.370  -0.770  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.406  -2.779   1.164  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.590  -2.094  -0.468  1.00  0.00           H  
HETATM   48  H   UNL     1       0.783  -2.634  -0.016  1.00  0.00           H  
HETATM   49  H   UNL     1       0.752  -1.591   1.428  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.683   0.466   2.954  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.462  -1.289   3.158  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.156  -0.302   2.459  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.718   1.985   1.823  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.006   2.636   0.190  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.745  -0.795   1.926  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.992   0.959   1.754  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.923  -2.282  -0.023  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.927  -2.562  -2.281  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.684  -0.570  -3.516  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.518   1.928  -0.413  1.00  0.00           H  
CONECT    1   11   11                                                 
CONECT    2    5   11                                                 
CONECT    3   23   23                                                 
CONECT    4   11   11                                                 
CONECT    5    2    6    6   12                                       
CONECT    6    5    5    8   34                                       
CONECT    7   11   35   36                                            
CONECT    8    6    9    9   13                                       
CONECT    9    8    8   10   16                                       
CONECT   10    9   12   12   37                                       
CONECT   11    1    1    2    4                                       
CONECT   11    4    7                                                 
CONECT   12    5   10   10   38                                       
CONECT   13    8   14   39   40                                       
CONECT   14   13   15   41   42                                       
CONECT   15   14   16   17   43                                       
CONECT   16    9   15   20   44                                       
CONECT   17   15   18   22   45                                       
CONECT   18   17   19   21   25                                       
CONECT   19   18   20   46   47                                       
CONECT   20   16   19   48   49                                       
CONECT   21   18   50   51   52                                       
CONECT   22   17   23   53   54                                       
CONECT   23    3    3   22   24                                       
CONECT   24   23   25   27                                            
CONECT   25   18   24   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   24   28   55   56                                       
CONECT   28   27   29   29   33                                       
CONECT   29   28   28   30   57                                       
CONECT   30   29   31   31   58                                       
CONECT   31   30   30   32   59                                       
CONECT   32   31   33   33                                            
CONECT   33   28   32   32   60                                       
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
