COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.756  -1.027  -0.024  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.943  -0.199  -0.036  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.690   1.136  -0.032  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.175   0.881  -0.040  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.913   0.755   1.046  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.613   0.465  -0.568  1.00  0.00           C  
HETATM    7  C   UNL     1       5.817  -1.351   0.013  1.00  0.00           C  
HETATM    8  C   UNL     1       4.927  -0.275   0.015  1.00  0.00           C  
HETATM    9  C   UNL     1       5.445   1.115   0.030  1.00  0.00           C  
HETATM   10  C   UNL     1       1.617  -2.063  -0.020  1.00  0.00           C  
HETATM   11  C   UNL     1       5.341  -2.648  -0.001  1.00  0.00           C  
HETATM   12  C   UNL     1       5.045   3.482   0.057  1.00  0.00           C  
HETATM   13  C   UNL     1       7.296   2.643   0.057  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.688  -1.275  -0.031  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.435   0.060  -0.028  1.00  0.00           C  
HETATM   16  S   UNL     1      -6.142   0.722  -1.494  1.00  0.00           S  
HETATM   17  C   UNL     1      -7.323   0.513   0.802  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.935   0.237  -0.969  1.00  0.00           C  
HETATM   19  C   UNL     1      -9.899   0.069  -0.018  1.00  0.00           C  
HETATM   20  N   UNL     1      -9.607   0.120   1.271  1.00  0.00           N  
HETATM   21  C   UNL     1      -8.387   0.331   1.707  1.00  0.00           C  
HETATM   22  O   UNL     1       6.213  -3.692  -0.009  1.00  0.00           O  
HETATM   23  O   UNL     1       3.503  -4.163  -0.022  1.00  0.00           O  
HETATM   24  C   UNL     1       3.072  -1.814  -0.012  1.00  0.00           C  
HETATM   25  C   UNL     1       3.557  -0.505   0.002  1.00  0.00           C  
HETATM   26  C   UNL     1       3.969  -2.889  -0.008  1.00  0.00           C  
HETATM   27  C   UNL     1       4.559   2.191   0.037  1.00  0.00           C  
HETATM   28  C   UNL     1       6.412   3.710   0.070  1.00  0.00           C  
HETATM   29  C   UNL     1       6.819   1.349   0.043  1.00  0.00           C  
HETATM   30  F   UNL     1       6.883   4.976   0.089  1.00  0.00           F  
HETATM   31  O   UNL     1       1.196  -3.204  -0.022  1.00  0.00           O  
HETATM   32  H   UNL     1       1.091  -0.117  -0.018  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.218  -0.771   0.850  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.210  -0.762  -0.930  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.422   1.700   0.862  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.415   1.709  -0.918  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.499   0.827   2.041  1.00  0.00           H  
HETATM   38  H   UNL     1       6.882  -1.169   0.018  1.00  0.00           H  
HETATM   39  H   UNL     1       4.359   4.316   0.067  1.00  0.00           H  
HETATM   40  H   UNL     1       8.361   2.826   0.067  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.956  -1.839  -0.925  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.963  -1.848   0.854  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.160   0.632  -0.914  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.168   0.624   0.866  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.188   0.195  -2.017  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.920  -0.106  -0.324  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.198   0.364   2.770  1.00  0.00           H  
HETATM   48  H   UNL     1       6.463  -4.002   0.873  1.00  0.00           H  
HETATM   49  H   UNL     1       3.365  -4.541   0.858  1.00  0.00           H  
HETATM   50  H   UNL     1       2.869   0.327   0.004  1.00  0.00           H  
HETATM   51  H   UNL     1       3.494   2.014   0.027  1.00  0.00           H  
HETATM   52  H   UNL     1       7.509   0.518   0.041  1.00  0.00           H  
CONECT    1   10   14   32                                            
CONECT    2   15    3   33   34                                       
CONECT    3    2    4   35   36                                       
CONECT    4    3   16    5    5                                       
CONECT    5    4    4   17   37                                       
CONECT    6   16   17   17   18                                       
CONECT    7    8   11   11   38                                       
CONECT    8    9   25   25    7                                       
CONECT    9   27   27   29    8                                       
CONECT   10   31   31   24    1                                       
CONECT   11    7    7   26   22                                       
CONECT   12   28   28   27   39                                       
CONECT   13   28   29   29   40                                       
CONECT   14   15    1   41   42                                       
CONECT   15    2   14   43   44                                       
CONECT   16    4    6                                                 
CONECT   17    5    6    6   21                                       
CONECT   18    6   19   19   45                                       
CONECT   19   18   18   20   46                                       
CONECT   20   21   21   19                                            
CONECT   21   17   20   20   47                                       
CONECT   22   11   48                                                 
CONECT   23   26   49                                                 
CONECT   24   25   10   26   26                                       
CONECT   25    8    8   24   50                                       
CONECT   26   24   24   11   23                                       
CONECT   27   12    9    9   51                                       
CONECT   28   30   12   12   13                                       
CONECT   29   13   13    9   52                                       
CONECT   30   28                                                      
CONECT   31   10   10                                                 
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
