COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.108   0.924  -0.494  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.596  -0.115   0.723  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.791  -1.234   0.444  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.006  -2.357   0.175  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.311   0.975   0.032  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.251   2.092  -0.197  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.750   2.338  -1.477  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.011   4.187  -0.626  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.648   2.903   0.867  1.00  0.00           C  
HETATM   10  C   UNL     1       2.677   2.175  -2.127  1.00  0.00           C  
HETATM   11  C   UNL     1       3.155   1.909   0.291  1.00  0.00           C  
HETATM   12  C   UNL     1       4.488   1.663  -0.016  1.00  0.00           C  
HETATM   13  C   UNL     1       5.402   1.462   0.999  1.00  0.00           C  
HETATM   14  C   UNL     1       4.993   1.505   2.319  1.00  0.00           C  
HETATM   15  C   UNL     1       3.667   1.749   2.628  1.00  0.00           C  
HETATM   16  C   UNL     1       2.747   1.951   1.618  1.00  0.00           C  
HETATM   17  C   UNL     1       0.808   2.282  -0.414  1.00  0.00           C  
HETATM   18  C   UNL     1       0.809  -0.158   0.371  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.383  -1.054   0.768  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.924  -0.390   1.380  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.139  -1.513   1.111  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.355  -2.636   0.841  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.222  -3.481  -0.095  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.626   3.383  -1.684  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.525   3.945   0.647  1.00  0.00           C  
HETATM   26  C   UNL     1       1.744  -0.903  -0.592  1.00  0.00           C  
HETATM   27  C   UNL     1       1.113  -0.780  -1.987  1.00  0.00           C  
HETATM   28  C   UNL     1       0.084   0.362  -1.924  1.00  0.00           C  
HETATM   29  N   UNL     1       2.228   2.118  -0.733  1.00  0.00           N  
HETATM   30  N   UNL     1       1.844  -2.313  -0.207  1.00  0.00           N  
HETATM   31  N   UNL     1       4.379  -2.424   0.611  1.00  0.00           N  
HETATM   32  O   UNL     1       3.057  -4.442   0.088  1.00  0.00           O  
HETATM   33  O   UNL     1       3.712  -2.852  -1.727  1.00  0.00           O  
HETATM   34  S   UNL     1       3.273  -3.126  -0.403  1.00  0.00           S  
HETATM   35  H   UNL     1      -3.952  -0.693  -0.489  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.287  -2.178   0.235  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.167  -1.817  -0.758  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.503  -3.301  -0.035  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.450   1.712  -2.304  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.698   5.004  -0.793  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.269   2.715   1.861  1.00  0.00           H  
HETATM   42  H   UNL     1       3.012   3.185  -2.360  1.00  0.00           H  
HETATM   43  H   UNL     1       3.501   1.476  -2.272  1.00  0.00           H  
HETATM   44  H   UNL     1       1.851   1.905  -2.785  1.00  0.00           H  
HETATM   45  H   UNL     1       4.808   1.629  -1.047  1.00  0.00           H  
HETATM   46  H   UNL     1       6.438   1.271   0.762  1.00  0.00           H  
HETATM   47  H   UNL     1       5.710   1.346   3.111  1.00  0.00           H  
HETATM   48  H   UNL     1       3.351   1.781   3.660  1.00  0.00           H  
HETATM   49  H   UNL     1       1.712   2.142   1.860  1.00  0.00           H  
HETATM   50  H   UNL     1       0.352   2.968  -1.127  1.00  0.00           H  
HETATM   51  H   UNL     1       0.706   2.684   0.594  1.00  0.00           H  
HETATM   52  H   UNL     1       1.334   0.256   1.232  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.242  -1.452   1.772  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.505  -1.865   0.050  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.763  -0.931   2.313  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.428   0.554   1.589  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.979  -2.054   2.043  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.643  -0.569   1.320  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.194  -3.177   1.774  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.859  -1.693   1.051  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.382  -2.940  -1.028  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.718  -4.424  -0.304  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.182  -3.679   0.380  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.013   3.574  -2.674  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.833   4.573   1.470  1.00  0.00           H  
HETATM   66  H   UNL     1       2.732  -0.442  -0.586  1.00  0.00           H  
HETATM   67  H   UNL     1       1.885  -0.557  -2.724  1.00  0.00           H  
HETATM   68  H   UNL     1       0.606  -1.709  -2.247  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.915  -0.004  -2.161  1.00  0.00           H  
HETATM   70  H   UNL     1       0.371   1.140  -2.632  1.00  0.00           H  
HETATM   71  H   UNL     1       1.072  -2.770   0.162  1.00  0.00           H  
HETATM   72  H   UNL     1       5.288  -2.760   0.644  1.00  0.00           H  
HETATM   73  H   UNL     1       4.117  -1.677   1.171  1.00  0.00           H  
CONECT    1   18   28   17    5                                       
CONECT    2   19   20    5    5                                       
CONECT    3   20   21   35   36                                       
CONECT    4   22   21   37   38                                       
CONECT    5    2    2    1    6                                       
CONECT    6    5    9    9    7                                       
CONECT    7    6   24   24   39                                       
CONECT    8   25   25   24   40                                       
CONECT    9    6    6   25   41                                       
CONECT   10   29   42   43   44                                       
CONECT   11   29   16   16   12                                       
CONECT   12   11   13   13   45                                       
CONECT   13   12   12   14   46                                       
CONECT   14   15   15   13   47                                       
CONECT   15   16   14   14   48                                       
CONECT   16   11   11   15   49                                       
CONECT   17    1   29   50   51                                       
CONECT   18   26   19    1   52                                       
CONECT   19   18    2   53   54                                       
CONECT   20    3    2   55   56                                       
CONECT   21    3    4   57   58                                       
CONECT   22   23    4   59   60                                       
CONECT   23   22   61   62   63                                       
CONECT   24    7    7    8   64                                       
CONECT   25    9    8    8   65                                       
CONECT   26   30   18   27   66                                       
CONECT   27   26   28   67   68                                       
CONECT   28   27    1   69   70                                       
CONECT   29   10   17   11                                            
CONECT   30   34   26   71                                            
CONECT   31   34   72   73                                            
CONECT   32   34   34                                                 
CONECT   33   34   34                                                 
CONECT   34   32   32   33   33                                       
CONECT   34   31   30                                                 
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   28                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
