COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.247   1.701   1.543  1.00  0.00           C  
HETATM    2  C   UNL     1       0.810  -2.883  -2.472  1.00  0.00           C  
HETATM    3  C   UNL     1       0.910  -1.531  -2.218  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.364   0.553   0.696  1.00  0.00           C  
HETATM    5  C   UNL     1       1.159  -1.084  -0.920  1.00  0.00           C  
HETATM    6  C   UNL     1       1.196  -3.359  -0.152  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.502  -0.275   0.748  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.347   0.220  -0.220  1.00  0.00           C  
HETATM    9  C   UNL     1       0.301   2.547  -0.539  1.00  0.00           C  
HETATM   10  C   UNL     1       3.708   4.188   0.688  1.00  0.00           C  
HETATM   11  C   UNL     1       1.268   0.366  -0.641  1.00  0.00           C  
HETATM   12  C   UNL     1       0.157   1.196  -0.812  1.00  0.00           C  
HETATM   13  C   UNL     1       3.751   2.885   0.476  1.00  0.00           C  
HETATM   14  C   UNL     1       5.028   2.116   0.698  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.504   1.219  -2.652  1.00  0.00           C  
HETATM   16  C   UNL     1       3.580  -3.609   1.525  1.00  0.00           C  
HETATM   17  C   UNL     1       2.913  -5.888   2.000  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.162   0.638  -1.279  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.155   2.612   2.215  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.564  -1.331  -0.060  1.00  0.00           N  
HETATM   21  N   UNL     1      -6.534   0.002   1.622  1.00  0.00           N  
HETATM   22  C   UNL     1       0.950  -3.796  -1.441  1.00  0.00           C  
HETATM   23  C   UNL     1       1.304  -2.009   0.114  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.584  -1.605  -0.897  1.00  0.00           C  
HETATM   25  C   UNL     1       1.522   3.038  -0.116  1.00  0.00           C  
HETATM   26  C   UNL     1       2.486   0.908  -0.216  1.00  0.00           C  
HETATM   27  C   UNL     1       1.347  -4.359   0.965  1.00  0.00           C  
HETATM   28  N   UNL     1      -3.503  -0.857  -0.986  1.00  0.00           N  
HETATM   29  N   UNL     1       2.614   2.239   0.049  1.00  0.00           N  
HETATM   30  N   UNL     1      -2.211   0.996  -0.322  1.00  0.00           N  
HETATM   31  N   UNL     1       2.758  -4.746   1.089  1.00  0.00           N  
HETATM   32  O   UNL     1       3.450   0.173  -0.070  1.00  0.00           O  
HETATM   33  S   UNL     1       2.046   4.676   0.312  1.00  0.00           S  
HETATM   34  H   UNL     1       0.617  -3.230  -3.476  1.00  0.00           H  
HETATM   35  H   UNL     1       0.797  -0.819  -3.023  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.538   3.215  -0.661  1.00  0.00           H  
HETATM   37  H   UNL     1       4.516   4.823   1.022  1.00  0.00           H  
HETATM   38  H   UNL     1       5.809   2.799   1.032  1.00  0.00           H  
HETATM   39  H   UNL     1       4.864   1.351   1.457  1.00  0.00           H  
HETATM   40  H   UNL     1       5.334   1.642  -0.235  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.458   0.815  -2.990  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.574   2.305  -2.580  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.723   0.952  -3.365  1.00  0.00           H  
HETATM   44  H   UNL     1       4.629  -3.904   1.541  1.00  0.00           H  
HETATM   45  H   UNL     1       3.446  -2.778   0.833  1.00  0.00           H  
HETATM   46  H   UNL     1       3.273  -3.303   2.525  1.00  0.00           H  
HETATM   47  H   UNL     1       2.537  -5.619   2.987  1.00  0.00           H  
HETATM   48  H   UNL     1       2.350  -6.739   1.616  1.00  0.00           H  
HETATM   49  H   UNL     1       3.968  -6.154   2.073  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.091  -0.448  -1.351  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.479   0.774   2.207  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.313  -0.574   1.650  1.00  0.00           H  
HETATM   53  H   UNL     1       0.866  -4.853  -1.644  1.00  0.00           H  
HETATM   54  H   UNL     1       1.497  -1.670   1.121  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.672  -2.470  -1.536  1.00  0.00           H  
HETATM   56  H   UNL     1       1.009  -3.913   1.901  1.00  0.00           H  
HETATM   57  H   UNL     1       0.746  -5.242   0.746  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.107   1.779   0.241  1.00  0.00           H  
CONECT    1   19   19   19    4                                       
CONECT    2    3   22   22   34                                       
CONECT    3    5    5    2   35                                       
CONECT    4    8    1    7    7                                       
CONECT    5   11   23    3    3                                       
CONECT    6   23   23   27   22                                       
CONECT    7    4    4   20   21                                       
CONECT    8   30   28   28    4                                       
CONECT    9   25   25   12   36                                       
CONECT   10   13   13   33   37                                       
CONECT   11   26   12   12    5                                       
CONECT   12    9   11   11   18                                       
CONECT   13   14   10   10   29                                       
CONECT   14   13   38   39   40                                       
CONECT   15   18   41   42   43                                       
CONECT   16   31   44   45   46                                       
CONECT   17   31   47   48   49                                       
CONECT   18   12   15   30   50                                       
CONECT   19    1    1    1                                            
CONECT   20   24   24    7                                            
CONECT   21    7   51   52                                            
CONECT   22    6    2    2   53                                       
CONECT   23    5    6    6   54                                       
CONECT   24   28   20   20   55                                       
CONECT   25   33   29    9    9                                       
CONECT   26   29   32   32   11                                       
CONECT   27   31    6   56   57                                       
CONECT   28    8    8   24                                            
CONECT   29   13   25   26                                            
CONECT   30   18    8   58                                            
CONECT   31   17   16   27                                            
CONECT   32   26   26                                                 
CONECT   33   10   25                                                 
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
