COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -2.232  -1.117   2.835  1.00  0.00           S  
HETATM    2  C   UNL     1      -4.939   1.366  -1.268  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.735  -1.757   0.365  1.00  0.00           N  
HETATM    4  O   UNL     1      -4.045   2.457  -1.040  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.911   2.191  -0.338  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.329  -1.355  -3.190  1.00  0.00           N  
HETATM    7  O   UNL     1      -2.847  -3.662   0.103  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.663   0.906   0.118  1.00  0.00           C  
HETATM    9  N   UNL     1       4.038   0.018   0.800  1.00  0.00           N  
HETATM   10  O   UNL     1      -2.232   4.468  -0.529  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.511   0.636   0.833  1.00  0.00           C  
HETATM   12  N   UNL     1       6.457   0.170  -0.692  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.243  -0.762   1.328  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.621  -2.842   2.336  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.414  -2.796   0.835  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.494  -1.614  -1.007  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.191  -1.594  -1.497  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.004  -1.450  -2.862  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.107  -1.332  -3.686  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.552  -1.489  -1.898  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.604   1.646   1.095  1.00  0.00           C  
HETATM   22  C   UNL     1       0.651   1.347   1.874  1.00  0.00           C  
HETATM   23  C   UNL     1       1.729   0.824   0.923  1.00  0.00           C  
HETATM   24  C   UNL     1       3.003   0.520   1.714  1.00  0.00           C  
HETATM   25  C   UNL     1       5.342  -0.061   1.474  1.00  0.00           C  
HETATM   26  C   UNL     1       6.373  -0.661   0.516  1.00  0.00           C  
HETATM   27  C   UNL     1       7.493  -0.332  -1.606  1.00  0.00           C  
HETATM   28  C   UNL     1       5.154   0.249  -1.366  1.00  0.00           C  
HETATM   29  C   UNL     1       4.123   0.850  -0.408  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.845   2.930   0.642  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.996   3.206  -0.079  1.00  0.00           C  
HETATM   32  H   UNL     1      -5.275   0.967  -0.311  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.800   1.715  -1.838  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.425   0.585  -1.827  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.370   0.115  -0.085  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.723   5.022   0.094  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.180  -0.905   1.522  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.931  -3.546   2.801  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.653  -3.094   2.581  1.00  0.00           H  
HETATM   40  H   UNL     1       0.653  -1.688  -0.830  1.00  0.00           H  
HETATM   41  H   UNL     1       0.993  -1.430  -3.277  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.967  -1.219  -4.751  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.566  -1.503  -1.529  1.00  0.00           H  
HETATM   44  H   UNL     1       1.004   2.257   2.358  1.00  0.00           H  
HETATM   45  H   UNL     1       0.437   0.592   2.631  1.00  0.00           H  
HETATM   46  H   UNL     1       1.376  -0.087   0.438  1.00  0.00           H  
HETATM   47  H   UNL     1       1.943   1.579   0.166  1.00  0.00           H  
HETATM   48  H   UNL     1       2.789  -0.235   2.471  1.00  0.00           H  
HETATM   49  H   UNL     1       3.356   1.431   2.198  1.00  0.00           H  
HETATM   50  H   UNL     1       5.659   0.939   1.770  1.00  0.00           H  
HETATM   51  H   UNL     1       5.256  -0.692   2.359  1.00  0.00           H  
HETATM   52  H   UNL     1       6.069  -1.672   0.242  1.00  0.00           H  
HETATM   53  H   UNL     1       7.347  -0.694   1.004  1.00  0.00           H  
HETATM   54  H   UNL     1       7.581   0.340  -2.460  1.00  0.00           H  
HETATM   55  H   UNL     1       8.447  -0.380  -1.081  1.00  0.00           H  
HETATM   56  H   UNL     1       7.219  -1.328  -1.953  1.00  0.00           H  
HETATM   57  H   UNL     1       5.239   0.880  -2.251  1.00  0.00           H  
HETATM   58  H   UNL     1       4.837  -0.751  -1.662  1.00  0.00           H  
HETATM   59  H   UNL     1       3.148   0.882  -0.896  1.00  0.00           H  
HETATM   60  H   UNL     1       4.426   1.860  -0.134  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.135   3.718   0.848  1.00  0.00           H  
CONECT    1   14   13                                                 
CONECT    2    4   32   33   34                                       
CONECT    3   16   15   13                                            
CONECT    4    2    5                                                 
CONECT    5    4   31   31    8                                       
CONECT    6   19   19   20                                            
CONECT    7   15   15                                                 
CONECT    8    5   11   11   35                                       
CONECT    9   29   25   24                                            
CONECT   10   31   36                                                 
CONECT   11    8    8   21   13                                       
CONECT   12   27   26   28                                            
CONECT   13    1    3   11   37                                       
CONECT   14    1   15   38   39                                       
CONECT   15    3    7    7   14                                       
CONECT   16    3   17   20   20                                       
CONECT   17   16   18   18   40                                       
CONECT   18   17   17   19   41                                       
CONECT   19    6    6   18   42                                       
CONECT   20    6   16   16   43                                       
CONECT   21   11   30   30   22                                       
CONECT   22   21   23   44   45                                       
CONECT   23   22   24   46   47                                       
CONECT   24    9   23   48   49                                       
CONECT   25    9   26   50   51                                       
CONECT   26   12   25   52   53                                       
CONECT   27   12   54   55   56                                       
CONECT   28   12   29   57   58                                       
CONECT   29    9   28   59   60                                       
CONECT   30   21   21   31   61                                       
CONECT   31    5    5   10   30                                       
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
