COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.855   3.092  -0.539  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.720   2.720  -0.751  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.586   3.712  -0.729  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.883   5.114  -0.194  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.047   4.139   0.638  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.582   3.593  -1.878  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.473   1.419  -1.001  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.488   0.364  -1.130  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.287   0.262   0.144  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.277  -0.646   0.248  1.00  0.00           N  
HETATM   11  C   UNL     1      -6.054  -0.744   1.487  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.291   0.557   2.210  1.00  0.00           C  
HETATM   13  N   UNL     1      -6.283   1.660   1.563  1.00  0.00           N  
HETATM   14  C   UNL     1      -7.163  -1.796   1.543  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.871  -2.003   2.337  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.038   0.998   1.076  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.741  -0.962  -1.387  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.140   0.820  -1.196  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.323  -0.676  -0.827  1.00  0.00           C  
HETATM   20  S   UNL     1      -0.077  -1.703  -1.654  1.00  0.00           S  
HETATM   21  O   UNL     1      -0.208  -3.061  -1.257  1.00  0.00           O  
HETATM   22  O   UNL     1       0.031  -1.348  -3.025  1.00  0.00           O  
HETATM   23  C   UNL     1       1.454  -1.190  -0.950  1.00  0.00           C  
HETATM   24  C   UNL     1       2.086  -1.988  -0.014  1.00  0.00           C  
HETATM   25  C   UNL     1       1.463  -3.296   0.403  1.00  0.00           C  
HETATM   26  F   UNL     1       2.205  -3.853   1.450  1.00  0.00           F  
HETATM   27  F   UNL     1       0.150  -3.073   0.829  1.00  0.00           F  
HETATM   28  F   UNL     1       1.457  -4.177  -0.684  1.00  0.00           F  
HETATM   29  C   UNL     1       3.286  -1.589   0.540  1.00  0.00           C  
HETATM   30  C   UNL     1       2.025   0.008  -1.338  1.00  0.00           C  
HETATM   31  C   UNL     1       3.227   0.412  -0.788  1.00  0.00           C  
HETATM   32  C   UNL     1       3.859  -0.384   0.155  1.00  0.00           C  
HETATM   33  O   UNL     1       5.040   0.011   0.698  1.00  0.00           O  
HETATM   34  C   UNL     1       5.571   1.262   0.256  1.00  0.00           C  
HETATM   35  C   UNL     1       6.895   1.536   0.972  1.00  0.00           C  
HETATM   36  F   UNL     1       7.804   0.515   0.679  1.00  0.00           F  
HETATM   37  F   UNL     1       7.414   2.761   0.539  1.00  0.00           F  
HETATM   38  F   UNL     1       6.676   1.585   2.353  1.00  0.00           F  
HETATM   39  H   UNL     1      -1.364   5.952  -0.660  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.899   5.319   0.143  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.513   3.703   1.521  1.00  0.00           H  
HETATM   42  H   UNL     1       0.022   4.335   0.719  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.116   3.606  -2.829  1.00  0.00           H  
HETATM   44  H   UNL     1       0.114   4.430  -1.841  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.032   2.657  -1.784  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.151   0.587  -1.966  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.828   0.921  -2.236  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.413   1.288  -0.533  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.212  -1.782  -0.845  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.697  -1.179  -2.455  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.476  -1.234  -0.497  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.064  -1.548   2.104  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.316  -2.415   0.659  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.173  -2.757   1.975  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.922  -1.890   3.420  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.435   2.497   2.029  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.293  -0.821   0.253  1.00  0.00           H  
HETATM   58  H   UNL     1       1.532   0.628  -2.072  1.00  0.00           H  
HETATM   59  H   UNL     1       3.779  -2.212   1.271  1.00  0.00           H  
HETATM   60  H   UNL     1       3.673   1.347  -1.092  1.00  0.00           H  
HETATM   61  H   UNL     1       5.741   1.224  -0.820  1.00  0.00           H  
HETATM   62  H   UNL     1       4.863   2.058   0.484  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.467   0.557   3.276  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    7                                       
CONECT    3    2    4    5    6                                       
CONECT    4    3    5   39   40                                       
CONECT    5    3    4   41   42                                       
CONECT    6    3   43   44   45                                       
CONECT    7    2    8   18                                            
CONECT    8    7    9   17   46                                       
CONECT    9    8   10   16   16                                       
CONECT   10    9   11   51                                            
CONECT   11   10   12   14   15                                       
CONECT   12   11   63   13   13                                       
CONECT   13   12   12   56                                            
CONECT   14   11   15   52   53                                       
CONECT   15   11   14   54   55                                       
CONECT   16    9    9                                                 
CONECT   17    8   19   49   50                                       
CONECT   18    7   19   47   48                                       
CONECT   19   17   18   20   57                                       
CONECT   20   19   21   21   22                                       
CONECT   20   22   23                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   20   24   30   30                                       
CONECT   24   23   25   29   29                                       
CONECT   25   24   26   27   28                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   24   24   32   59                                       
CONECT   30   23   23   31   58                                       
CONECT   31   30   32   32   60                                       
CONECT   32   29   31   31   33                                       
CONECT   33   32   34                                                 
CONECT   34   33   35   61   62                                       
CONECT   35   34   36   37   38                                       
CONECT   36   35                                                      
CONECT   37   35                                                      
CONECT   38   35                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    8                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   10                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   13                                                      
CONECT   57   19                                                      
CONECT   58   30                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   12                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
