COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       3.361  -1.732   0.072  1.00  0.00           S  
HETATM    2  C   UNL     1       1.630  -1.916   0.344  1.00  0.00           C  
HETATM    3  C   UNL     1       1.035  -3.176   0.235  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.328  -3.324   0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.102  -2.229   0.770  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.515  -0.966   0.881  1.00  0.00           C  
HETATM    7  C   UNL     1       0.859  -0.815   0.671  1.00  0.00           C  
HETATM    8  O   UNL     1       1.793  -4.258  -0.081  1.00  0.00           O  
HETATM    9  C   UNL     1       1.121  -5.515  -0.176  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.343   0.206   1.223  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.879   1.101   1.904  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.734   0.293   0.739  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.569   1.321   1.188  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.871   1.400   0.733  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.352   0.457  -0.172  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.523  -0.568  -0.621  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.218  -0.648  -0.174  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.997  -1.487  -1.504  1.00  0.00           O  
HETATM   19  O   UNL     1      -6.634   0.537  -0.617  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.683   2.400   1.169  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.092  -2.511  -1.922  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.863   1.309  -1.798  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.124   3.332   2.097  1.00  0.00           C  
HETATM   24  C   UNL     1       3.628   0.043   0.334  1.00  0.00           C  
HETATM   25  O   UNL     1       2.936   0.783  -0.673  1.00  0.00           O  
HETATM   26  C   UNL     1       3.060   2.201  -0.544  1.00  0.00           C  
HETATM   27  C   UNL     1       2.259   2.886  -1.654  1.00  0.00           C  
HETATM   28  O   UNL     1       0.868   2.610  -1.477  1.00  0.00           O  
HETATM   29  C   UNL     1       4.534   2.596  -0.660  1.00  0.00           C  
HETATM   30  O   UNL     1       5.025   2.235  -1.953  1.00  0.00           O  
HETATM   31  C   UNL     1       5.338   1.859   0.415  1.00  0.00           C  
HETATM   32  O   UNL     1       6.726   2.165   0.268  1.00  0.00           O  
HETATM   33  C   UNL     1       5.126   0.351   0.254  1.00  0.00           C  
HETATM   34  O   UNL     1       5.813  -0.343   1.297  1.00  0.00           O  
HETATM   35  H   UNL     1      -0.783  -4.299   0.363  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.162  -2.348   0.935  1.00  0.00           H  
HETATM   37  H   UNL     1       1.317   0.159   0.760  1.00  0.00           H  
HETATM   38  H   UNL     1       1.840  -6.293  -0.434  1.00  0.00           H  
HETATM   39  H   UNL     1       0.657  -5.752   0.781  1.00  0.00           H  
HETATM   40  H   UNL     1       0.353  -5.459  -0.948  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.196   2.053   1.890  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.574  -1.441  -0.525  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.595  -3.176  -2.624  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.228  -2.057  -2.407  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.763  -3.082  -1.054  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.292   0.887  -2.624  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.925   1.290  -2.043  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.548   2.338  -1.626  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.803   2.803   2.994  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.268   3.829   1.641  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.876   4.075   2.363  1.00  0.00           H  
HETATM   52  H   UNL     1       3.251   0.326   1.317  1.00  0.00           H  
HETATM   53  H   UNL     1       2.675   2.512   0.427  1.00  0.00           H  
HETATM   54  H   UNL     1       2.424   3.962  -1.610  1.00  0.00           H  
HETATM   55  H   UNL     1       2.584   2.508  -2.623  1.00  0.00           H  
HETATM   56  H   UNL     1       0.299   3.014  -2.146  1.00  0.00           H  
HETATM   57  H   UNL     1       4.635   3.672  -0.518  1.00  0.00           H  
HETATM   58  H   UNL     1       5.955   2.457  -2.097  1.00  0.00           H  
HETATM   59  H   UNL     1       4.997   2.171   1.403  1.00  0.00           H  
HETATM   60  H   UNL     1       7.296   1.731   0.919  1.00  0.00           H  
HETATM   61  H   UNL     1       5.512   0.031  -0.714  1.00  0.00           H  
HETATM   62  H   UNL     1       5.721  -1.305   1.256  1.00  0.00           H  
CONECT    1   24    2                                                 
CONECT    2    1    7    7    3                                       
CONECT    3    2    8    4    4                                       
CONECT    4    3    3    5   35                                       
CONECT    5    6    6    4   36                                       
CONECT    6    7   10    5    5                                       
CONECT    7    2    2    6   37                                       
CONECT    8    3    9                                                 
CONECT    9    8   38   39   40                                       
CONECT   10   11   11    6   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   13   17                                       
CONECT   13   12   12   14   41                                       
CONECT   14   13   20   15   15                                       
CONECT   15   14   14   16   19                                       
CONECT   16   17   17   15   18                                       
CONECT   17   12   16   16   42                                       
CONECT   18   16   21                                                 
CONECT   19   15   22                                                 
CONECT   20   23   14                                                 
CONECT   21   18   43   44   45                                       
CONECT   22   19   46   47   48                                       
CONECT   23   20   49   50   51                                       
CONECT   24   25   33    1   52                                       
CONECT   25   26   24                                                 
CONECT   26   27   29   25   53                                       
CONECT   27   28   26   54   55                                       
CONECT   28   27   56                                                 
CONECT   29   30   26   31   57                                       
CONECT   30   29   58                                                 
CONECT   31   29   32   33   59                                       
CONECT   32   31   60                                                 
CONECT   33   31   24   34   61                                       
CONECT   34   33   62                                                 
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   13                                                      
CONECT   42   17                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
