COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.920  -1.843   0.874  1.00  0.00           C  
HETATM    2  C   UNL     1       7.471  -2.079  -0.379  1.00  0.00           C  
HETATM    3  C   UNL     1       7.073  -1.318  -1.461  1.00  0.00           C  
HETATM    4  N   UNL     1       2.887   0.496  -0.103  1.00  0.00           N  
HETATM    5  C   UNL     1       6.127  -0.323  -1.298  1.00  0.00           C  
HETATM    6  C   UNL     1       2.134  -0.089   1.015  1.00  0.00           C  
HETATM    7  C   UNL     1       0.750   0.570   1.072  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.535   1.089  -0.164  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.156   2.411  -0.042  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.103   3.383   0.243  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.440   3.029   0.407  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.824   1.705   0.285  1.00  0.00           C  
HETATM   13  O   UNL     1       4.411   1.561   1.520  1.00  0.00           O  
HETATM   14  S   UNL     1      -1.329  -0.143  -0.525  1.00  0.00           S  
HETATM   15  C   UNL     1       5.970  -0.842   1.034  1.00  0.00           C  
HETATM   16  C   UNL     1       5.576  -0.085  -0.052  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.422  -0.399  -1.920  1.00  0.00           O  
HETATM   18  N   UNL     1       0.159   0.539  -0.273  1.00  0.00           N  
HETATM   19  C   UNL     1       2.296   0.465  -1.448  1.00  0.00           C  
HETATM   20  C   UNL     1       0.913   1.124  -1.391  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.479  -1.154   0.462  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.871   0.729   0.004  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.279  -0.692  -0.127  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.985  -1.397  -1.293  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.365  -2.718  -1.414  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.039  -3.347  -0.379  1.00  0.00           C  
HETATM   27  O   UNL     1      -5.411  -4.649  -0.502  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.336  -2.647   0.788  1.00  0.00           C  
HETATM   29  O   UNL     1      -5.997  -3.265   1.803  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.952  -1.324   0.917  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.367   3.983   0.687  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.726   4.684   0.363  1.00  0.00           O  
HETATM   33  S   UNL     1       4.372   1.184   0.150  1.00  0.00           S  
HETATM   34  O   UNL     1       4.575   2.103  -0.914  1.00  0.00           O  
HETATM   35  N   UNL     1       7.316  -2.613   1.970  1.00  0.00           N  
HETATM   36  H   UNL     1       8.210  -2.855  -0.507  1.00  0.00           H  
HETATM   37  H   UNL     1       7.501  -1.501  -2.435  1.00  0.00           H  
HETATM   38  H   UNL     1       5.818   0.271  -2.146  1.00  0.00           H  
HETATM   39  H   UNL     1       2.022  -1.162   0.859  1.00  0.00           H  
HETATM   40  H   UNL     1       2.664   0.093   1.949  1.00  0.00           H  
HETATM   41  H   UNL     1       0.111   0.021   1.764  1.00  0.00           H  
HETATM   42  H   UNL     1       0.850   1.603   1.404  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.120   2.688  -0.168  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.861   1.429   0.412  1.00  0.00           H  
HETATM   45  H   UNL     1       5.539  -0.656   2.007  1.00  0.00           H  
HETATM   46  H   UNL     1       2.935   1.014  -2.141  1.00  0.00           H  
HETATM   47  H   UNL     1       2.199  -0.568  -1.781  1.00  0.00           H  
HETATM   48  H   UNL     1       0.382   0.942  -2.326  1.00  0.00           H  
HETATM   49  H   UNL     1       1.025   2.197  -1.235  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.460  -0.910  -2.101  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.136  -3.264  -2.318  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.748  -5.279  -0.190  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.418  -3.697   2.444  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.177  -0.781   1.823  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.773   4.379  -0.096  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.754   5.179  -0.467  1.00  0.00           H  
HETATM   57  H   UNL     1       7.977  -3.314   1.856  1.00  0.00           H  
HETATM   58  H   UNL     1       6.931  -2.447   2.844  1.00  0.00           H  
CONECT    1   15   35    2    2                                       
CONECT    2    1    1    3   36                                       
CONECT    3    2    5    5   37                                       
CONECT    4   19   33    6                                            
CONECT    5    3    3   16   38                                       
CONECT    6    4    7   39   40                                       
CONECT    7    6   18   41   42                                       
CONECT    8   14    9    9   22                                       
CONECT    9    8    8   10   43                                       
CONECT   10    9   32   11   11                                       
CONECT   11   10   10   31   12                                       
CONECT   12   11   22   22   44                                       
CONECT   13   33   33                                                 
CONECT   14   17   17   18    8                                       
CONECT   14   21   21                                                 
CONECT   15   16   16    1   45                                       
CONECT   16   33   15   15    5                                       
CONECT   17   14   14                                                 
CONECT   18   14   20    7                                            
CONECT   19   20    4   46   47                                       
CONECT   20   18   19   48   49                                       
CONECT   21   14   14                                                 
CONECT   22   12   12    8   23                                       
CONECT   23   22   30   30   24                                       
CONECT   24   25   25   23   50                                       
CONECT   25   26   24   24   51                                       
CONECT   26   28   28   27   25                                       
CONECT   27   26   52                                                 
CONECT   28   30   29   26   26                                       
CONECT   29   28   53                                                 
CONECT   30   23   23   28   54                                       
CONECT   31   11   55                                                 
CONECT   32   10   56                                                 
CONECT   33    4   13   13   16                                       
CONECT   33   34   34                                                 
CONECT   34   33   33                                                 
CONECT   35    1   57   58                                            
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    9                                                      
CONECT   44   12                                                      
CONECT   45   15                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   35                                                      
CONECT   58   35                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
