COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.770   1.238   1.257  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.421   2.507   0.834  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.131   2.767   0.408  1.00  0.00           C  
HETATM    4  C   UNL     1       0.813   1.760   0.402  1.00  0.00           C  
HETATM    5  C   UNL     1       0.465   0.482   0.826  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.831   0.226   1.259  1.00  0.00           C  
HETATM    7  C   UNL     1       3.494  -1.284   0.334  1.00  0.00           C  
HETATM    8  C   UNL     1       4.830  -1.032  -0.226  1.00  0.00           C  
HETATM    9  C   UNL     1       5.236   0.344  -0.581  1.00  0.00           C  
HETATM   10  C   UNL     1       6.548   0.609  -0.978  1.00  0.00           C  
HETATM   11  C   UNL     1       6.920   1.896  -1.307  1.00  0.00           C  
HETATM   12  C   UNL     1       5.995   2.924  -1.243  1.00  0.00           C  
HETATM   13  C   UNL     1       4.693   2.669  -0.851  1.00  0.00           C  
HETATM   14  C   UNL     1       4.307   1.385  -0.525  1.00  0.00           C  
HETATM   15  C   UNL     1       3.134  -2.626   0.792  1.00  0.00           C  
HETATM   16  C   UNL     1       3.266  -2.986   2.249  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.914  -0.690  -0.237  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.393  -1.791   0.430  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.024  -2.918  -0.276  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.171  -2.961  -1.654  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.686  -1.880  -2.334  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.069  -0.733  -1.632  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.627   0.425  -2.352  1.00  0.00           C  
HETATM   24  N   UNL     1       1.417  -0.538   0.827  1.00  0.00           N  
HETATM   25  N   UNL     1       2.619  -0.298   0.425  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.286   0.444   0.472  1.00  0.00           N  
HETATM   27  O   UNL     1       5.602  -1.957  -0.399  1.00  0.00           O  
HETATM   28  O   UNL     1       2.729  -3.450  -0.002  1.00  0.00           O  
HETATM   29  O   UNL     1      -4.954   1.421  -1.739  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.774   0.379  -3.691  1.00  0.00           O  
HETATM   31  O   UNL     1      -3.339  -0.222   2.651  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.954   2.161   2.214  1.00  0.00           O  
HETATM   33  S   UNL     1      -3.415   0.913   1.800  1.00  0.00           S  
HETATM   34  H   UNL     1      -2.157   3.298   0.837  1.00  0.00           H  
HETATM   35  H   UNL     1       0.139   3.760   0.078  1.00  0.00           H  
HETATM   36  H   UNL     1       1.819   1.963   0.068  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.105  -0.765   1.590  1.00  0.00           H  
HETATM   38  H   UNL     1       7.270  -0.192  -1.027  1.00  0.00           H  
HETATM   39  H   UNL     1       7.934   2.102  -1.614  1.00  0.00           H  
HETATM   40  H   UNL     1       6.292   3.930  -1.502  1.00  0.00           H  
HETATM   41  H   UNL     1       3.977   3.476  -0.803  1.00  0.00           H  
HETATM   42  H   UNL     1       3.289   1.187  -0.223  1.00  0.00           H  
HETATM   43  H   UNL     1       3.039  -4.044   2.384  1.00  0.00           H  
HETATM   44  H   UNL     1       4.285  -2.788   2.581  1.00  0.00           H  
HETATM   45  H   UNL     1       2.570  -2.387   2.836  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.274  -1.765   1.503  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.619  -3.771   0.247  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.879  -3.848  -2.197  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.798  -1.919  -3.407  1.00  0.00           H  
HETATM   50  H   UNL     1       1.175  -1.427   1.130  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.056   0.962   0.189  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.143   1.163  -4.120  1.00  0.00           H  
CONECT    1    6   33    2    2                                       
CONECT    2    1    1    3   34                                       
CONECT    3    4    4    2   35                                       
CONECT    4    5    3    3   36                                       
CONECT    5   24    6    6    4                                       
CONECT    6    5    5    1   37                                       
CONECT    7   15    8   25   25                                       
CONECT    8   27   27    7    9                                       
CONECT    9    8   14   14   10                                       
CONECT   10    9   11   11   38                                       
CONECT   11   10   10   12   39                                       
CONECT   12   13   13   11   40                                       
CONECT   13   14   12   12   41                                       
CONECT   14    9    9   13   42                                       
CONECT   15   16   28   28    7                                       
CONECT   16   15   43   44   45                                       
CONECT   17   18   18   26   22                                       
CONECT   18   19   17   17   46                                       
CONECT   19   18   20   20   47                                       
CONECT   20   19   19   21   48                                       
CONECT   21   20   22   22   49                                       
CONECT   22   17   21   21   23                                       
CONECT   23   22   29   29   30                                       
CONECT   24   25    5   50                                            
CONECT   25    7    7   24                                            
CONECT   26   33   17   51                                            
CONECT   27    8    8                                                 
CONECT   28   15   15                                                 
CONECT   29   23   23                                                 
CONECT   30   23   52                                                 
CONECT   31   33   33                                                 
CONECT   32   33   33                                                 
CONECT   33   32   32    1   31                                       
CONECT   33   31   26                                                 
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
