COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.111  -3.069  -1.412  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.742  -0.499   0.701  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.064   1.650  -1.332  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.294   1.290  -0.808  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.221  -0.231   0.701  1.00  0.00           C  
HETATM    6  C   UNL     1       8.514   0.799   0.010  1.00  0.00           C  
HETATM    7  C   UNL     1       7.026   1.039   0.006  1.00  0.00           C  
HETATM    8  C   UNL     1       6.530   2.290  -0.315  1.00  0.00           C  
HETATM    9  C   UNL     1       5.168   2.514  -0.320  1.00  0.00           C  
HETATM   10  C   UNL     1       4.294   1.481  -0.002  1.00  0.00           C  
HETATM   11  C   UNL     1       1.879   0.146   0.464  1.00  0.00           C  
HETATM   12  C   UNL     1       1.711  -2.130  -0.272  1.00  0.00           C  
HETATM   13  C   UNL     1       0.186  -2.112  -0.138  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.210  -1.125   0.965  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.464  -0.256   0.290  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.982   0.124   0.173  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.909   1.069  -0.848  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.371   0.351   0.208  1.00  0.00           C  
HETATM   19  C   UNL     1       0.361   0.256   0.628  1.00  0.00           C  
HETATM   20  C   UNL     1       4.796   0.226   0.321  1.00  0.00           C  
HETATM   21  C   UNL     1       6.159   0.008   0.318  1.00  0.00           C  
HETATM   22  F   UNL     1      -8.423   1.857  -1.288  1.00  0.00           F  
HETATM   23  N   UNL     1      -1.670  -1.044   1.050  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.653  -1.419   1.678  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.414  -1.713   1.859  1.00  0.00           N  
HETATM   26  O   UNL     1       2.179  -0.810  -0.555  1.00  0.00           O  
HETATM   27  O   UNL     1       3.536  -3.175  -1.463  1.00  0.00           O  
HETATM   28  O   UNL     1      -0.398  -1.703  -1.376  1.00  0.00           O  
HETATM   29  O   UNL     1       0.059   1.169   1.685  1.00  0.00           O  
HETATM   30  S   UNL     1       2.555   1.763  -0.006  1.00  0.00           S  
HETATM   31  H   UNL     1       1.679  -4.055  -1.240  1.00  0.00           H  
HETATM   32  H   UNL     1       1.742  -2.671  -2.357  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.008   2.382  -2.123  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.282  -0.963   1.493  1.00  0.00           H  
HETATM   35  H   UNL     1       8.913   1.011   1.001  1.00  0.00           H  
HETATM   36  H   UNL     1       8.714  -0.241  -0.247  1.00  0.00           H  
HETATM   37  H   UNL     1       8.989   1.452  -0.721  1.00  0.00           H  
HETATM   38  H   UNL     1       7.210   3.092  -0.562  1.00  0.00           H  
HETATM   39  H   UNL     1       4.781   3.491  -0.571  1.00  0.00           H  
HETATM   40  H   UNL     1       2.324  -0.174   1.406  1.00  0.00           H  
HETATM   41  H   UNL     1       2.154  -2.481   0.660  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.169  -3.110   0.121  1.00  0.00           H  
HETATM   43  H   UNL     1       0.193  -1.462   1.920  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.149   0.427  -0.486  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.950   1.346  -1.260  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.333   0.077   0.617  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.081   0.615  -0.302  1.00  0.00           H  
HETATM   48  H   UNL     1       4.120  -0.579   0.569  1.00  0.00           H  
HETATM   49  H   UNL     1       6.550  -0.969   0.564  1.00  0.00           H  
HETATM   50  H   UNL     1       3.862  -3.756  -2.164  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.184  -2.282  -2.121  1.00  0.00           H  
HETATM   52  H   UNL     1       0.396   2.064   1.540  1.00  0.00           H  
CONECT    1   12   27   31   32                                       
CONECT    2   24   15   15   16                                       
CONECT    3   17   17    4   33                                       
CONECT    4   18   18    3   22                                       
CONECT    5   16   16   18   34                                       
CONECT    6    7   35   36   37                                       
CONECT    7    6    8    8   21                                       
CONECT    8    7    7    9   38                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   20   30                                       
CONECT   11   30   19   26   40                                       
CONECT   12   26   13    1   41                                       
CONECT   13   14   12   28   42                                       
CONECT   14   19   23   13   43                                       
CONECT   15   23    2    2   44                                       
CONECT   16    2    5    5   17                                       
CONECT   17   16    3    3   45                                       
CONECT   18    5    4    4   46                                       
CONECT   19   29   11   14   47                                       
CONECT   20   21   21   10   48                                       
CONECT   21    7   20   20   49                                       
CONECT   22    4                                                      
CONECT   23   25   14   15                                            
CONECT   24   25   25    2                                            
CONECT   25   24   24   23                                            
CONECT   26   11   12                                                 
CONECT   27    1   50                                                 
CONECT   28   13   51                                                 
CONECT   29   19   52                                                 
CONECT   30   10   11                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
