COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.128   6.256  -0.144  1.00  0.00           C  
HETATM    2  C   UNL     1       7.733  -2.369   0.960  1.00  0.00           C  
HETATM    3  C   UNL     1       6.492  -3.448  -0.921  1.00  0.00           C  
HETATM    4  C   UNL     1       5.668  -3.696   1.425  1.00  0.00           C  
HETATM    5  O   UNL     1       1.630  -1.757  -0.192  1.00  0.00           O  
HETATM    6  C   UNL     1     -10.709   0.146   0.933  1.00  0.00           C  
HETATM    7  C   UNL     1     -11.077   1.176   0.089  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.367  -0.045   1.221  1.00  0.00           C  
HETATM    9  C   UNL     1       5.923   4.057   0.748  1.00  0.00           C  
HETATM   10  C   UNL     1       4.136   4.069  -0.849  1.00  0.00           C  
HETATM   11  C   UNL     1       5.863   2.678   0.809  1.00  0.00           C  
HETATM   12  C   UNL     1       4.079   2.690  -0.801  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.882   1.815  -0.195  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.490  -2.869  -0.636  1.00  0.00           C  
HETATM   15  C   UNL     1       4.126  -1.471   0.097  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.995  -0.459   0.141  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.489  -1.410  -0.946  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.970   0.647   0.930  1.00  0.00           C  
HETATM   19  N   UNL     1     -10.168   1.970  -0.443  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.133  -0.665  -0.696  1.00  0.00           N  
HETATM   21  N   UNL     1       5.963  -0.278   0.267  1.00  0.00           N  
HETATM   22  N   UNL     1       2.452   0.307  -0.187  1.00  0.00           N  
HETATM   23  N   UNL     1       0.168  -0.104  -0.444  1.00  0.00           N  
HETATM   24  O   UNL     1      -6.394  -0.233  -0.038  1.00  0.00           O  
HETATM   25  S   UNL     1      -0.747  -2.700  -0.438  1.00  0.00           S  
HETATM   26  C   UNL     1       1.424  -0.561  -0.271  1.00  0.00           C  
HETATM   27  C   UNL     1       5.061   4.752  -0.080  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.440   0.813   0.647  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.013  -1.648  -0.757  1.00  0.00           C  
HETATM   30  C   UNL     1       4.940   1.990   0.034  1.00  0.00           C  
HETATM   31  C   UNL     1       3.751  -0.167  -0.008  1.00  0.00           C  
HETATM   32  C   UNL     1       5.512  -1.506   0.271  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.892  -0.999  -0.531  1.00  0.00           C  
HETATM   34  N   UNL     1       4.877   0.591   0.093  1.00  0.00           N  
HETATM   35  C   UNL     1       6.348  -2.750   0.433  1.00  0.00           C  
HETATM   36  H   UNL     1       5.828   6.555  -0.924  1.00  0.00           H  
HETATM   37  H   UNL     1       4.139   6.654  -0.370  1.00  0.00           H  
HETATM   38  H   UNL     1       5.466   6.645   0.817  1.00  0.00           H  
HETATM   39  H   UNL     1       8.218  -1.695   0.254  1.00  0.00           H  
HETATM   40  H   UNL     1       7.630  -1.872   1.925  1.00  0.00           H  
HETATM   41  H   UNL     1       8.337  -3.268   1.077  1.00  0.00           H  
HETATM   42  H   UNL     1       6.977  -2.774  -1.627  1.00  0.00           H  
HETATM   43  H   UNL     1       7.096  -4.347  -0.803  1.00  0.00           H  
HETATM   44  H   UNL     1       5.505  -3.719  -1.296  1.00  0.00           H  
HETATM   45  H   UNL     1       6.272  -4.595   1.542  1.00  0.00           H  
HETATM   46  H   UNL     1       5.565  -3.199   2.389  1.00  0.00           H  
HETATM   47  H   UNL     1       4.681  -3.968   1.049  1.00  0.00           H  
HETATM   48  H   UNL     1     -11.459  -0.501   1.366  1.00  0.00           H  
HETATM   49  H   UNL     1     -12.121   1.334  -0.138  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.050  -0.841   1.878  1.00  0.00           H  
HETATM   51  H   UNL     1       6.641   4.593   1.351  1.00  0.00           H  
HETATM   52  H   UNL     1       3.467   4.614  -1.499  1.00  0.00           H  
HETATM   53  H   UNL     1       6.534   2.136   1.459  1.00  0.00           H  
HETATM   54  H   UNL     1       3.366   2.157  -1.412  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.167   2.484  -0.650  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.038  -3.799  -0.659  1.00  0.00           H  
HETATM   57  H   UNL     1       3.468  -2.327   0.057  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.821  -0.902   1.121  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.462   0.489   0.071  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.022  -2.358  -0.876  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.663  -0.966  -1.926  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.836   0.227   1.927  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.477   1.618   0.877  1.00  0.00           H  
HETATM   64  H   UNL     1       2.287   1.261  -0.250  1.00  0.00           H  
HETATM   65  H   UNL     1       0.004   0.850  -0.507  1.00  0.00           H  
CONECT    1   27   36   37   38                                       
CONECT    2   35   39   40   41                                       
CONECT    3   35   42   43   44                                       
CONECT    4   35   45   46   47                                       
CONECT    5   26   26                                                 
CONECT    6    8    8    7   48                                       
CONECT    7    6   19   19   49                                       
CONECT    8    6    6   28   50                                       
CONECT    9   27   27   11   51                                       
CONECT   10   27   12   12   52                                       
CONECT   11    9   30   30   53                                       
CONECT   12   10   10   30   54                                       
CONECT   13   28   28   19   55                                       
CONECT   14   29   29   25   56                                       
CONECT   15   31   31   32   57                                       
CONECT   16   17   24   58   59                                       
CONECT   17   16   29   60   61                                       
CONECT   18   24   28   62   63                                       
CONECT   19    7    7   13                                            
CONECT   20   33   33   29                                            
CONECT   21   34   32   32                                            
CONECT   22   31   26   64                                            
CONECT   23   26   33   65                                            
CONECT   24   16   18                                                 
CONECT   25   14   33                                                 
CONECT   26    5    5   22   23                                       
CONECT   27    1    9    9   10                                       
CONECT   28    8   13   13   18                                       
CONECT   29   14   14   17   20                                       
CONECT   30   11   11   12   34                                       
CONECT   31   15   15   22   34                                       
CONECT   32   15   21   21   35                                       
CONECT   33   20   20   23   25                                       
CONECT   34   21   30   31                                            
CONECT   35    2    3    4   32                                       
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
