COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.572   1.535  -0.199  1.00  0.00           C  
HETATM    2  C   UNL     1       2.726   3.704  -0.908  1.00  0.00           C  
HETATM    3  C   UNL     1       5.085   4.065  -0.708  1.00  0.00           C  
HETATM    4  C   UNL     1       2.285   0.012   0.383  1.00  0.00           C  
HETATM    5  C   UNL     1       5.784  -0.605  -0.715  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.682  -2.469  -0.308  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.327  -3.169  -0.191  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.030  -3.462   1.281  1.00  0.00           C  
HETATM    9  C   UNL     1       3.895   4.269  -1.383  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.127  -1.107  -0.151  1.00  0.00           C  
HETATM   11  C   UNL     1       5.103   3.306   0.447  1.00  0.00           C  
HETATM   12  C   UNL     1       4.531  -0.893   0.115  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.986   2.049  -0.585  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.397   1.634  -0.256  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.003   2.099   0.896  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.004   1.048   0.028  1.00  0.00           C  
HETATM   17  C   UNL     1       1.208   1.006   0.029  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.362  -4.483  -0.975  1.00  0.00           C  
HETATM   19  C   UNL     1       1.471   2.324   0.761  1.00  0.00           C  
HETATM   20  C   UNL     1       2.745   2.940   0.244  1.00  0.00           C  
HETATM   21  C   UNL     1       3.934   2.741   0.921  1.00  0.00           C  
HETATM   22  C   UNL     1       6.860  -1.599  -0.362  1.00  0.00           C  
HETATM   23  C   UNL     1       6.964  -2.796  -1.052  1.00  0.00           C  
HETATM   24  C   UNL     1       7.970  -3.680  -0.693  1.00  0.00           C  
HETATM   25  C   UNL     1       8.830  -3.341   0.334  1.00  0.00           C  
HETATM   26  C   UNL     1       7.760  -1.325   0.651  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.297   1.718   1.199  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.985   0.873   0.349  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.379   0.408  -0.804  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.088   0.794  -1.109  1.00  0.00           C  
HETATM   31  N   UNL     1      -3.181  -0.261  -0.605  1.00  0.00           N  
HETATM   32  N   UNL     1       3.485   0.073  -0.228  1.00  0.00           N  
HETATM   33  N   UNL     1       8.701  -2.192   0.970  1.00  0.00           N  
HETATM   34  O   UNL     1      -4.290  -2.310  -0.733  1.00  0.00           O  
HETATM   35  O   UNL     1      -4.832  -0.784   0.784  1.00  0.00           O  
HETATM   36  O   UNL     1       2.072  -0.842   1.217  1.00  0.00           O  
HETATM   37  S   UNL     1      -0.408   0.349   0.528  1.00  0.00           S  
HETATM   38  H   UNL     1      -1.383   1.621  -1.269  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.440   2.509   0.272  1.00  0.00           H  
HETATM   40  H   UNL     1       1.797   3.862  -1.436  1.00  0.00           H  
HETATM   41  H   UNL     1       5.998   4.506  -1.079  1.00  0.00           H  
HETATM   42  H   UNL     1       5.544  -0.690  -1.775  1.00  0.00           H  
HETATM   43  H   UNL     1       6.136   0.404  -0.502  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.894  -2.261  -1.357  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.461  -3.115   0.098  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.657  -1.533   0.250  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.808  -4.107   1.688  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.064  -3.961   1.365  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.005  -2.526   1.839  1.00  0.00           H  
HETATM   50  H   UNL     1       3.880   4.869  -2.280  1.00  0.00           H  
HETATM   51  H   UNL     1       6.030   3.154   0.979  1.00  0.00           H  
HETATM   52  H   UNL     1       4.178  -1.902  -0.097  1.00  0.00           H  
HETATM   53  H   UNL     1       4.771  -0.808   1.175  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.857   2.068  -1.667  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.795   3.042  -0.178  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.465   2.759   1.561  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.194   0.963   1.098  1.00  0.00           H  
HETATM   58  H   UNL     1       1.214   1.180  -1.047  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.574  -4.275  -2.024  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.396  -4.982  -0.891  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.141  -5.128  -0.568  1.00  0.00           H  
HETATM   62  H   UNL     1       0.640   3.008   0.587  1.00  0.00           H  
HETATM   63  H   UNL     1       1.567   2.134   1.830  1.00  0.00           H  
HETATM   64  H   UNL     1       3.949   2.144   1.821  1.00  0.00           H  
HETATM   65  H   UNL     1       6.277  -3.035  -1.851  1.00  0.00           H  
HETATM   66  H   UNL     1       8.080  -4.623  -1.209  1.00  0.00           H  
HETATM   67  H   UNL     1       9.616  -4.023   0.620  1.00  0.00           H  
HETATM   68  H   UNL     1       7.689  -0.392   1.190  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.770   2.080   2.100  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.996   0.575   0.585  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.919  -0.248  -1.470  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.615   0.431  -2.010  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.618  -0.518  -1.352  1.00  0.00           H  
HETATM   74  H   UNL     1       3.655   0.756  -0.895  1.00  0.00           H  
CONECT    1   37   16   38   39                                       
CONECT    2   20   20    9   40                                       
CONECT    3    9    9   11   41                                       
CONECT    4   32   17   36   36                                       
CONECT    5   22   12   42   43                                       
CONECT    6    7   44   45   46                                       
CONECT    7   18    6   34    8                                       
CONECT    8    7   47   48   49                                       
CONECT    9    2    3    3   50                                       
CONECT   10   35   35   31   34                                       
CONECT   11   21   21    3   51                                       
CONECT   12   32    5   52   53                                       
CONECT   13   14   16   54   55                                       
CONECT   14   30   13   15   15                                       
CONECT   15   14   14   27   56                                       
CONECT   16   13    1   31   57                                       
CONECT   17   37   19    4   58                                       
CONECT   18    7   59   60   61                                       
CONECT   19   17   20   62   63                                       
CONECT   20   19    2    2   21                                       
CONECT   21   20   11   11   64                                       
CONECT   22   23   23   26    5                                       
CONECT   23   24   22   22   65                                       
CONECT   24   25   25   23   66                                       
CONECT   25   24   24   33   67                                       
CONECT   26   33   33   22   68                                       
CONECT   27   28   28   15   69                                       
CONECT   28   29   27   27   70                                       
CONECT   29   30   30   28   71                                       
CONECT   30   29   29   14   72                                       
CONECT   31   16   10   73                                            
CONECT   32   12    4   74                                            
CONECT   33   25   26   26                                            
CONECT   34   10    7                                                 
CONECT   35   10   10                                                 
CONECT   36    4    4                                                 
CONECT   37    1   17                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   19                                                      
CONECT   64   21                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
