COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.129   0.529   0.258  1.00  0.00           N  
HETATM    2  C   UNL     1       0.152   0.679  -0.057  1.00  0.00           C  
HETATM    3  C   UNL     1       2.122   2.074  -0.083  1.00  0.00           C  
HETATM    4  C   UNL     1       4.340   1.132  -0.150  1.00  0.00           C  
HETATM    5  C   UNL     1       2.642   3.323  -0.417  1.00  0.00           C  
HETATM    6  C   UNL     1       2.419   5.643  -0.890  1.00  0.00           C  
HETATM    7  C   UNL     1       6.652   0.781  -0.366  1.00  0.00           C  
HETATM    8  C   UNL     1       5.166  -1.128   0.244  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.264  -1.547  -2.615  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.464  -0.629  -1.689  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.147   0.367   0.937  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.819   1.406   1.549  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.119   2.353   2.275  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.745   2.261   2.392  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.066   1.224   1.783  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.765   0.272   1.053  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.744  -0.640   0.106  1.00  0.00           C  
HETATM   18  C   UNL     1       2.967   0.986   0.052  1.00  0.00           C  
HETATM   19  C   UNL     1       4.846   2.377  -0.487  1.00  0.00           C  
HETATM   20  C   UNL     1       4.004   3.467  -0.617  1.00  0.00           C  
HETATM   21  C   UNL     1       6.345   2.261  -0.647  1.00  0.00           C  
HETATM   22  C   UNL     1       6.341  -2.070   0.294  1.00  0.00           C  
HETATM   23  C   UNL     1       6.945  -4.408   0.476  1.00  0.00           C  
HETATM   24  C   UNL     1       5.344  -3.447   2.018  1.00  0.00           C  
HETATM   25  C   UNL     1       0.339  -1.523  -0.717  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.015  -1.723  -0.396  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.203  -3.669  -1.160  1.00  0.00           C  
HETATM   28  C   UNL     1       0.829  -2.806  -1.208  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.663   0.826  -2.117  1.00  0.00           C  
HETATM   30  N   UNL     1      -3.082  -0.782   0.440  1.00  0.00           N  
HETATM   31  N   UNL     1       0.746   1.920   0.121  1.00  0.00           N  
HETATM   32  N   UNL     1       5.355   0.170  -0.063  1.00  0.00           N  
HETATM   33  N   UNL     1       5.874  -3.417   0.648  1.00  0.00           N  
HETATM   34  N   UNL     1       0.881  -0.315  -0.534  1.00  0.00           N  
HETATM   35  N   UNL     1      -1.312  -3.039  -0.677  1.00  0.00           N  
HETATM   36  O   UNL     1       1.814   4.395  -0.545  1.00  0.00           O  
HETATM   37  O   UNL     1       4.049  -1.538   0.481  1.00  0.00           O  
HETATM   38  O   UNL     1      -7.398  -0.442   0.139  1.00  0.00           O  
HETATM   39  O   UNL     1      -5.592  -2.084   0.544  1.00  0.00           O  
HETATM   40  S   UNL     1      -6.040  -0.842   0.018  1.00  0.00           S  
HETATM   41  H   UNL     1       2.927   5.549  -1.849  1.00  0.00           H  
HETATM   42  H   UNL     1       1.649   6.412  -0.960  1.00  0.00           H  
HETATM   43  H   UNL     1       3.141   5.921  -0.122  1.00  0.00           H  
HETATM   44  H   UNL     1       7.101   0.315  -1.243  1.00  0.00           H  
HETATM   45  H   UNL     1       7.316   0.690   0.493  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.917  -1.419  -3.641  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.121  -2.584  -2.311  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.322  -1.292  -2.555  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.406  -0.884  -1.750  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.893   1.481   1.459  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.648   3.165   2.752  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.201   3.002   2.960  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.992   1.153   1.875  1.00  0.00           H  
HETATM   54  H   UNL     1       2.562   0.020   0.316  1.00  0.00           H  
HETATM   55  H   UNL     1       4.410   4.432  -0.881  1.00  0.00           H  
HETATM   56  H   UNL     1       6.861   2.899   0.070  1.00  0.00           H  
HETATM   57  H   UNL     1       6.633   2.522  -1.666  1.00  0.00           H  
HETATM   58  H   UNL     1       6.825  -2.098  -0.682  1.00  0.00           H  
HETATM   59  H   UNL     1       7.053  -1.724   1.043  1.00  0.00           H  
HETATM   60  H   UNL     1       7.786  -4.149   1.120  1.00  0.00           H  
HETATM   61  H   UNL     1       6.573  -5.396   0.746  1.00  0.00           H  
HETATM   62  H   UNL     1       7.272  -4.413  -0.564  1.00  0.00           H  
HETATM   63  H   UNL     1       4.506  -2.755   2.099  1.00  0.00           H  
HETATM   64  H   UNL     1       5.005  -4.456   2.254  1.00  0.00           H  
HETATM   65  H   UNL     1       6.127  -3.154   2.717  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.160  -4.706  -1.459  1.00  0.00           H  
HETATM   67  H   UNL     1       1.832  -3.023  -1.548  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.317   0.954  -3.142  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.721   1.081  -2.056  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.094   1.481  -1.457  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.544  -1.613   0.248  1.00  0.00           H  
HETATM   72  H   UNL     1       0.207   2.681   0.387  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.179  -3.454  -0.550  1.00  0.00           H  
CONECT    1   17   17    2                                            
CONECT    2    1   31   34   34                                       
CONECT    3    5    5   18   31                                       
CONECT    4   19   32   18   18                                       
CONECT    5   20   36    3    3                                       
CONECT    6   36   41   42   43                                       
CONECT    7   21   32   44   45                                       
CONECT    8   22   32   37   37                                       
CONECT    9   10   46   47   48                                       
CONECT   10   40    9   29   49                                       
CONECT   11   12   12   16   40                                       
CONECT   12   13   11   11   50                                       
CONECT   13   14   14   12   51                                       
CONECT   14   13   13   15   52                                       
CONECT   15   14   16   16   53                                       
CONECT   16   15   15   11   30                                       
CONECT   17   30    1    1   26                                       
CONECT   18    4    4    3   54                                       
CONECT   19   21   20   20    4                                       
CONECT   20   19   19    5   55                                       
CONECT   21    7   19   56   57                                       
CONECT   22   33    8   58   59                                       
CONECT   23   33   60   61   62                                       
CONECT   24   33   63   64   65                                       
CONECT   25   26   26   34   28                                       
CONECT   26   17   35   25   25                                       
CONECT   27   35   28   28   66                                       
CONECT   28   25   27   27   67                                       
CONECT   29   10   68   69   70                                       
CONECT   30   16   17   71                                            
CONECT   31    3    2   72                                            
CONECT   32    7    4    8                                            
CONECT   33   24   22   23                                            
CONECT   34    2    2   25                                            
CONECT   35   26   27   73                                            
CONECT   36    6    5                                                 
CONECT   37    8    8                                                 
CONECT   38   40   40                                                 
CONECT   39   40   40                                                 
CONECT   40   11   39   39   38                                       
CONECT   40   38   10                                                 
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   35                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
