COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.634  -1.872  -0.275  1.00  0.00           C  
HETATM    2  C   UNL     1       6.684  -1.459  -1.098  1.00  0.00           C  
HETATM    3  C   UNL     1       6.758  -0.148  -1.524  1.00  0.00           C  
HETATM    4  C   UNL     1       5.794   0.764  -1.140  1.00  0.00           C  
HETATM    5  C   UNL     1       4.738   0.365  -0.318  1.00  0.00           C  
HETATM    6  C   UNL     1       3.708   1.343   0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       1.929   2.213   1.039  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.526   2.059   0.972  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.906  -0.732  -0.913  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.065   0.813   0.925  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.178  -1.121  -0.156  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.611  -1.640  -0.388  1.00  0.00           C  
HETATM   13  O   UNL     1       6.501  -4.159  -0.198  1.00  0.00           O  
HETATM   14  C   UNL     1       5.557  -3.275   0.180  1.00  0.00           C  
HETATM   15  O   UNL     1       4.643  -3.633   0.896  1.00  0.00           O  
HETATM   16  C   UNL     1       4.661  -0.955   0.121  1.00  0.00           C  
HETATM   17  C   UNL     1       3.667   2.655  -0.263  1.00  0.00           C  
HETATM   18  C   UNL     1       2.523   3.205   0.348  1.00  0.00           C  
HETATM   19  C   UNL     1       0.665   2.342   1.850  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.092   3.082   0.185  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.628   4.213   0.207  1.00  0.00           O  
HETATM   22  N   UNL     1      -2.147   2.791  -0.588  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.662   1.577  -0.625  1.00  0.00           C  
HETATM   24  S   UNL     1      -4.040   0.965  -1.559  1.00  0.00           S  
HETATM   25  N   UNL     1      -2.763  -0.665   0.001  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.160   0.549   0.111  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.522  -0.194   1.689  1.00  0.00           N  
HETATM   28  C   UNL     1      -6.339  -1.251  -1.144  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.394  -2.978   0.321  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.232  -2.849   1.309  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.960  -2.459   0.553  1.00  0.00           C  
HETATM   32  O   UNL     1       2.645   1.088   0.878  1.00  0.00           O  
HETATM   33  H   UNL     1       7.441  -2.167  -1.402  1.00  0.00           H  
HETATM   34  H   UNL     1       7.572   0.166  -2.160  1.00  0.00           H  
HETATM   35  H   UNL     1       5.855   1.788  -1.480  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.712  -1.436  -1.721  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.412  -0.353   0.581  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.845  -0.872   0.349  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.439  -1.732  -1.092  1.00  0.00           H  
HETATM   40  H   UNL     1       6.408  -5.065   0.125  1.00  0.00           H  
HETATM   41  H   UNL     1       3.846  -1.269   0.757  1.00  0.00           H  
HETATM   42  H   UNL     1       4.375   3.174  -0.892  1.00  0.00           H  
HETATM   43  H   UNL     1       2.186   4.229   0.276  1.00  0.00           H  
HETATM   44  H   UNL     1       0.688   1.628   2.674  1.00  0.00           H  
HETATM   45  H   UNL     1       0.590   3.354   2.249  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.089  -1.386  -0.209  1.00  0.00           H  
HETATM   47  H   UNL     1       0.242  -0.014   2.258  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.904  -1.086   1.658  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.494  -0.297  -1.649  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.106  -2.019  -1.881  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.300  -3.255   0.860  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.160  -3.746  -0.416  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.466  -2.080   2.046  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.077  -3.802   1.814  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.727  -3.227  -0.184  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.133  -2.367   1.257  1.00  0.00           H  
CONECT    1   16   16    2   14                                       
CONECT    2    3    3    1   33                                       
CONECT    3    4    2    2   34                                       
CONECT    4    5    5    3   35                                       
CONECT    5    6    4    4   16                                       
CONECT    6   17   17    5   32                                       
CONECT    7   18   18   32   19                                       
CONECT    8   19   20   10   10                                       
CONECT    9   25   24   11   36                                       
CONECT   10    8    8   27   26                                       
CONECT   11   31    9   28   37                                       
CONECT   12   29   28   38   39                                       
CONECT   13   14   40                                                 
CONECT   14   15   15    1   13                                       
CONECT   15   14   14                                                 
CONECT   16    5    1    1   41                                       
CONECT   17   18    6    6   42                                       
CONECT   18   17    7    7   43                                       
CONECT   19    7    8   44   45                                       
CONECT   20   21   21    8   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   23                                            
CONECT   23   22   22   26   24                                       
CONECT   24   23    9                                                 
CONECT   25   26    9   46                                            
CONECT   26   10   23   25                                            
CONECT   27   10   47   48                                            
CONECT   28   11   12   49   50                                       
CONECT   29   30   12   51   52                                       
CONECT   30   31   29   53   54                                       
CONECT   31   30   11   55   56                                       
CONECT   32    6    7                                                 
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
