COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.319  -0.155  -2.376  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.056  -0.409  -3.709  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.761  -0.336  -4.185  1.00  0.00           C  
HETATM    4  C   UNL     1       0.285  -0.005  -3.329  1.00  0.00           C  
HETATM    5  C   UNL     1       0.019   0.245  -1.987  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.286   0.173  -1.519  1.00  0.00           C  
HETATM    7  S   UNL     1       1.916   0.076  -3.979  1.00  0.00           S  
HETATM    8  C   UNL     1       2.887  -0.072  -2.522  1.00  0.00           C  
HETATM    9  C   UNL     1       4.218  -0.462  -2.640  1.00  0.00           C  
HETATM   10  C   UNL     1       5.012  -0.589  -1.517  1.00  0.00           C  
HETATM   11  C   UNL     1       4.486  -0.328  -0.265  1.00  0.00           C  
HETATM   12  C   UNL     1       3.166   0.059  -0.138  1.00  0.00           C  
HETATM   13  C   UNL     1       2.360   0.190  -1.264  1.00  0.00           C  
HETATM   14  N   UNL     1       1.034   0.584  -1.093  1.00  0.00           N  
HETATM   15  C   UNL     1       0.690   1.387   0.082  1.00  0.00           C  
HETATM   16  C   UNL     1       0.307   0.461   1.238  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.051   1.300   2.466  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.419   0.410   3.576  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.750   1.273   4.717  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.026   0.413   5.950  1.00  0.00           C  
HETATM   21  N   UNL     1       0.186  -0.328   6.315  1.00  0.00           N  
HETATM   22  C   UNL     1       0.518  -1.191   5.175  1.00  0.00           C  
HETATM   23  C   UNL     1       0.793  -0.331   3.942  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.180  -1.218   7.425  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.732  -0.235  -1.858  1.00  0.00           C  
HETATM   26  F   UNL     1      -4.593  -0.581  -2.905  1.00  0.00           F  
HETATM   27  F   UNL     1      -3.806  -1.206  -0.854  1.00  0.00           F  
HETATM   28  F   UNL     1      -4.108   1.006  -1.336  1.00  0.00           F  
HETATM   29  H   UNL     1      -2.863  -0.666  -4.379  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.560  -0.535  -5.227  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.494   0.371  -0.478  1.00  0.00           H  
HETATM   32  H   UNL     1       4.633  -0.666  -3.616  1.00  0.00           H  
HETATM   33  H   UNL     1       6.043  -0.892  -1.616  1.00  0.00           H  
HETATM   34  H   UNL     1       5.107  -0.427   0.612  1.00  0.00           H  
HETATM   35  H   UNL     1       2.758   0.262   0.840  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.151   2.038  -0.155  1.00  0.00           H  
HETATM   37  H   UNL     1       1.548   1.994   0.372  1.00  0.00           H  
HETATM   38  H   UNL     1       1.148  -0.189   1.476  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.550  -0.145   0.949  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.893   1.950   2.229  1.00  0.00           H  
HETATM   41  H   UNL     1       0.806   1.906   2.756  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.636   1.863   4.480  1.00  0.00           H  
HETATM   43  H   UNL     1       0.085   1.942   4.921  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.829  -0.290   5.730  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.323   1.053   6.780  1.00  0.00           H  
HETATM   46  H   UNL     1       1.404  -1.781   5.412  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.318  -1.860   4.971  1.00  0.00           H  
HETATM   48  H   UNL     1       1.091  -0.971   3.111  1.00  0.00           H  
HETATM   49  H   UNL     1       1.596   0.372   4.162  1.00  0.00           H  
HETATM   50  H   UNL     1       0.692  -1.793   7.734  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.538  -0.622   8.265  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.968  -1.898   7.101  1.00  0.00           H  
CONECT    1    2    2    6   25                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5    7                                       
CONECT    5    4    6    6   14                                       
CONECT    6    1    5    5   31                                       
CONECT    7    4    8                                                 
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   32                                       
CONECT   10    9   11   11   33                                       
CONECT   11   10   10   12   34                                       
CONECT   12   11   13   13   35                                       
CONECT   13    8   12   12   14                                       
CONECT   14    5   13   15                                            
CONECT   15   14   16   36   37                                       
CONECT   16   15   17   38   39                                       
CONECT   17   16   18   40   41                                       
CONECT   18   17   19   23                                            
CONECT   19   18   20   42   43                                       
CONECT   20   19   21   44   45                                       
CONECT   21   20   22   24                                            
CONECT   22   21   23   46   47                                       
CONECT   23   18   22   48   49                                       
CONECT   24   21   50   51   52                                       
CONECT   25    1   26   27   28                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
