COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.071  -1.441  -0.161  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.697  -1.433   0.518  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.229  -0.226   0.132  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.018   0.783  -0.790  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.881  -0.670   0.074  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.152  -0.971   0.579  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.753   0.364  -0.855  1.00  0.00           C  
HETATM    8  C   UNL     1       4.480  -1.046  -0.695  1.00  0.00           C  
HETATM    9  C   UNL     1       3.663   0.219  -0.762  1.00  0.00           C  
HETATM   10  C   UNL     1       4.641  -3.424  -0.918  1.00  0.00           C  
HETATM   11  C   UNL     1       5.978  -3.366  -0.573  1.00  0.00           C  
HETATM   12  C   UNL     1       6.563  -2.149  -0.277  1.00  0.00           C  
HETATM   13  C   UNL     1       5.816  -0.988  -0.344  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.361  -1.924   0.505  1.00  0.00           C  
HETATM   15  C   UNL     1       2.666   3.247   0.946  1.00  0.00           C  
HETATM   16  C   UNL     1       2.530   4.149  -0.284  1.00  0.00           C  
HETATM   17  C   UNL     1       1.059   4.222  -0.699  1.00  0.00           C  
HETATM   18  C   UNL     1       0.562   2.822  -1.069  1.00  0.00           C  
HETATM   19  C   UNL     1       0.675   1.905   0.153  1.00  0.00           C  
HETATM   20  C   UNL     1       0.317   0.495  -0.239  1.00  0.00           C  
HETATM   21  C   UNL     1       3.892  -2.264  -0.979  1.00  0.00           C  
HETATM   22  N   UNL     1       2.059   1.943   0.646  1.00  0.00           N  
HETATM   23  N   UNL     1      -6.809   1.045  -1.249  1.00  0.00           N  
HETATM   24  O   UNL     1       1.928  -0.432   1.158  1.00  0.00           O  
HETATM   25  O   UNL     1      -0.789  -0.080   0.260  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.479  -1.133   0.025  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.820  -2.330   1.327  1.00  0.00           O  
HETATM   28  O   UNL     1       1.025  -0.118  -1.002  1.00  0.00           O  
HETATM   29  O   UNL     1       3.917   0.887   1.809  1.00  0.00           O  
HETATM   30  S   UNL     1       2.917   0.544   0.859  1.00  0.00           S  
HETATM   31  H   UNL     1      -0.246  -2.090   0.131  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.190  -1.469  -1.245  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.224  -0.427   0.503  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.857   1.366  -1.141  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.289  -1.764   1.300  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.779   0.609  -1.253  1.00  0.00           H  
HETATM   37  H   UNL     1       4.307   1.053  -1.039  1.00  0.00           H  
HETATM   38  H   UNL     1       2.876   0.104  -1.507  1.00  0.00           H  
HETATM   39  H   UNL     1       4.182  -4.376  -1.140  1.00  0.00           H  
HETATM   40  H   UNL     1       6.564  -4.272  -0.525  1.00  0.00           H  
HETATM   41  H   UNL     1       7.608  -2.103  -0.007  1.00  0.00           H  
HETATM   42  H   UNL     1       6.275  -0.036  -0.122  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.526  -2.973   0.260  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.275  -1.812   1.586  1.00  0.00           H  
HETATM   45  H   UNL     1       3.721   3.112   1.186  1.00  0.00           H  
HETATM   46  H   UNL     1       2.154   3.703   1.794  1.00  0.00           H  
HETATM   47  H   UNL     1       2.890   5.150  -0.044  1.00  0.00           H  
HETATM   48  H   UNL     1       3.119   3.738  -1.104  1.00  0.00           H  
HETATM   49  H   UNL     1       0.467   4.610   0.130  1.00  0.00           H  
HETATM   50  H   UNL     1       0.956   4.883  -1.559  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.480   2.878  -1.386  1.00  0.00           H  
HETATM   52  H   UNL     1       1.169   2.423  -1.881  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.003   2.251   0.934  1.00  0.00           H  
HETATM   54  H   UNL     1       2.847  -2.310  -1.249  1.00  0.00           H  
CONECT    1   25   14   31   32                                       
CONECT    2    5   26   27   27                                       
CONECT    3    4    4    6   33                                       
CONECT    4    3    3   23   34                                       
CONECT    5    6    6    7    2                                       
CONECT    6    3    5    5   35                                       
CONECT    7   23   23    5   36                                       
CONECT    8   13    9   21   21                                       
CONECT    9   30    8   37   38                                       
CONECT   10   11   11   21   39                                       
CONECT   11   12   10   10   40                                       
CONECT   12   13   13   11   41                                       
CONECT   13   12   12    8   42                                       
CONECT   14   26    1   43   44                                       
CONECT   15   16   22   45   46                                       
CONECT   16   17   15   47   48                                       
CONECT   17   16   18   49   50                                       
CONECT   18   17   19   51   52                                       
CONECT   19   18   22   20   53                                       
CONECT   20   19   25   28   28                                       
CONECT   21    8    8   10   54                                       
CONECT   22   15   19   30                                            
CONECT   23    4    7    7                                            
CONECT   24   30   30                                                 
CONECT   25   20    1                                                 
CONECT   26    2   14                                                 
CONECT   27    2    2                                                 
CONECT   28   20   20                                                 
CONECT   29   30   30                                                 
CONECT   30   24   24   22   29                                       
CONECT   30   29    9                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
