COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.191  -0.515  -0.432  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.499  -0.556  -1.628  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.128  -0.737  -1.603  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.485  -0.873  -0.373  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.242  -0.820   0.776  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.002  -1.071  -0.376  1.00  0.00           C  
HETATM    7  C   UNL     1       0.615  -0.980   1.028  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.289  -1.703   2.030  1.00  0.00           C  
HETATM    9  N   UNL     1      -3.553  -0.640   0.712  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.616  -0.957   2.141  1.00  0.00           C  
HETATM   11  C   UNL     1       0.349  -2.503  -0.835  1.00  0.00           C  
HETATM   12  C   UNL     1       1.766  -2.742  -0.270  1.00  0.00           C  
HETATM   13  C   UNL     1       1.936  -1.775   0.915  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.686  -0.320  -0.438  1.00  0.00           C  
HETATM   15  F   UNL     1      -6.136  -0.214  -1.758  1.00  0.00           F  
HETATM   16  S   UNL     1       0.778   0.145  -1.473  1.00  0.00           S  
HETATM   17  C   UNL     1       0.462   1.698  -0.703  1.00  0.00           C  
HETATM   18  O   UNL     1       2.193   0.015  -1.434  1.00  0.00           O  
HETATM   19  O   UNL     1       0.083   0.219  -2.710  1.00  0.00           O  
HETATM   20  C   UNL     1       1.417   2.269   0.118  1.00  0.00           C  
HETATM   21  C   UNL     1       1.170   3.487   0.722  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.033   4.136   0.505  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.989   3.563  -0.318  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.738   2.347  -0.925  1.00  0.00           C  
HETATM   25  F   UNL     1      -0.276   5.326   1.095  1.00  0.00           F  
HETATM   26  N   UNL     1       3.052  -0.861   0.661  1.00  0.00           N  
HETATM   27  C   UNL     1       4.321  -1.306   0.750  1.00  0.00           C  
HETATM   28  C   UNL     1       5.469  -0.365   0.489  1.00  0.00           C  
HETATM   29  O   UNL     1       4.539  -2.463   1.041  1.00  0.00           O  
HETATM   30  C   UNL     1       5.803   0.401   1.770  1.00  0.00           C  
HETATM   31  C   UNL     1       6.693  -1.167   0.041  1.00  0.00           C  
HETATM   32  O   UNL     1       5.103   0.559  -0.538  1.00  0.00           O  
HETATM   33  S   UNL     1       8.115  -0.054  -0.132  1.00  0.00           S  
HETATM   34  O   UNL     1       8.449   0.456   1.152  1.00  0.00           O  
HETATM   35  C   UNL     1       9.422  -1.195  -0.659  1.00  0.00           C  
HETATM   36  O   UNL     1       7.852   0.855  -1.192  1.00  0.00           O  
HETATM   37  C   UNL     1      -6.359  -1.518   0.235  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.036   0.958   0.325  1.00  0.00           C  
HETATM   39  F   UNL     1      -6.038  -2.687  -0.463  1.00  0.00           F  
HETATM   40  F   UNL     1      -5.908  -1.624   1.556  1.00  0.00           F  
HETATM   41  F   UNL     1      -7.746  -1.337   0.230  1.00  0.00           F  
HETATM   42  F   UNL     1      -7.424   1.139   0.320  1.00  0.00           F  
HETATM   43  F   UNL     1      -5.585   0.852   1.645  1.00  0.00           F  
HETATM   44  F   UNL     1      -5.421   2.053  -0.291  1.00  0.00           F  
HETATM   45  H   UNL     1      -4.021  -0.449  -2.567  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.563  -0.773  -2.523  1.00  0.00           H  
HETATM   47  H   UNL     1       0.783   0.056   1.322  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.472  -2.721   1.686  1.00  0.00           H  
HETATM   49  H   UNL     1       0.196  -1.729   3.005  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.440   0.034   2.559  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.289  -1.511   2.794  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.355  -3.222  -0.417  1.00  0.00           H  
HETATM   53  H   UNL     1       0.357  -2.564  -1.924  1.00  0.00           H  
HETATM   54  H   UNL     1       1.862  -3.773   0.072  1.00  0.00           H  
HETATM   55  H   UNL     1       2.513  -2.531  -1.035  1.00  0.00           H  
HETATM   56  H   UNL     1       2.114  -2.336   1.832  1.00  0.00           H  
HETATM   57  H   UNL     1       2.355   1.762   0.288  1.00  0.00           H  
HETATM   58  H   UNL     1       1.916   3.932   1.364  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.928   4.068  -0.488  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.481   1.902  -1.570  1.00  0.00           H  
HETATM   61  H   UNL     1       2.878   0.064   0.428  1.00  0.00           H  
HETATM   62  H   UNL     1       6.082  -0.304   2.553  1.00  0.00           H  
HETATM   63  H   UNL     1       6.633   1.081   1.581  1.00  0.00           H  
HETATM   64  H   UNL     1       4.931   0.972   2.089  1.00  0.00           H  
HETATM   65  H   UNL     1       6.918  -1.932   0.784  1.00  0.00           H  
HETATM   66  H   UNL     1       6.485  -1.642  -0.918  1.00  0.00           H  
HETATM   67  H   UNL     1       4.878   0.142  -1.381  1.00  0.00           H  
HETATM   68  H   UNL     1       9.134  -1.669  -1.597  1.00  0.00           H  
HETATM   69  H   UNL     1      10.351  -0.643  -0.801  1.00  0.00           H  
HETATM   70  H   UNL     1       9.568  -1.959   0.105  1.00  0.00           H  
CONECT    1    2   14    9    9                                       
CONECT    2    3    3    1   45                                       
CONECT    3    2    2    4   46                                       
CONECT    4    3    6    5    5                                       
CONECT    5    4    4    9   10                                       
CONECT    6   11   16    4    7                                       
CONECT    7    6   13    8   47                                       
CONECT    8    7   10   48   49                                       
CONECT    9    1    1    5                                            
CONECT   10    5    8   50   51                                       
CONECT   11   12    6   52   53                                       
CONECT   12   11   13   54   55                                       
CONECT   13   12   26    7   56                                       
CONECT   14   38    1   37   15                                       
CONECT   15   14                                                      
CONECT   16   19   19   18   18                                       
CONECT   16    6   17                                                 
CONECT   17   16   20   20   24                                       
CONECT   18   16   16                                                 
CONECT   19   16   16                                                 
CONECT   20   17   17   21   57                                       
CONECT   21   20   22   22   58                                       
CONECT   22   21   21   23   25                                       
CONECT   23   24   24   22   59                                       
CONECT   24   17   23   23   60                                       
CONECT   25   22                                                      
CONECT   26   27   13   61                                            
CONECT   27   28   26   29   29                                       
CONECT   28   31   32   27   30                                       
CONECT   29   27   27                                                 
CONECT   30   28   62   63   64                                       
CONECT   31   33   28   65   66                                       
CONECT   32   28   67                                                 
CONECT   33   36   36   34   34                                       
CONECT   33   31   35                                                 
CONECT   34   33   33                                                 
CONECT   35   33   68   69   70                                       
CONECT   36   33   33                                                 
CONECT   37   41   14   40   39                                       
CONECT   38   42   43   44   14                                       
CONECT   39   37                                                      
CONECT   40   37                                                      
CONECT   41   37                                                      
CONECT   42   38                                                      
CONECT   43   38                                                      
CONECT   44   38                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   35                                                      
CONECT   69   35                                                      
CONECT   70   35                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
