COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.458   0.464   0.227  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.632  -2.266   0.114  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.536  -0.674   0.210  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.889  -1.985   0.374  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.821  -2.848   0.312  1.00  0.00           C  
HETATM    6  C   UNL     1       1.914  -2.059   0.600  1.00  0.00           C  
HETATM    7  C   UNL     1       2.943  -1.159   0.398  1.00  0.00           C  
HETATM    8  C   UNL     1       0.702  -1.092  -1.226  1.00  0.00           C  
HETATM    9  C   UNL     1       0.795  -2.026  -0.211  1.00  0.00           C  
HETATM   10  C   UNL     1       1.722  -0.182  -1.425  1.00  0.00           C  
HETATM   11  C   UNL     1       2.849  -0.217  -0.616  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.862   2.792   0.070  1.00  0.00           C  
HETATM   13  C   UNL     1       1.620   0.835  -2.533  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.309  -2.438   0.600  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.163  -2.824   2.499  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.777  -3.235  -2.435  1.00  0.00           C  
HETATM   17  C   UNL     1       6.904   1.604   2.022  1.00  0.00           C  
HETATM   18  C   UNL     1       8.283   2.562   0.173  1.00  0.00           C  
HETATM   19  C   UNL     1       7.866   0.101   0.273  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.075  -3.782   1.309  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.385  -3.988  -1.162  1.00  0.00           C  
HETATM   22  C   UNL     1       4.984   0.582   0.060  1.00  0.00           C  
HETATM   23  C   UNL     1       6.003   1.662  -0.307  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.325  -3.009   0.012  1.00  0.00           C  
HETATM   25  C   UNL     1       7.264   1.482   0.540  1.00  0.00           C  
HETATM   26  N   UNL     1      -6.201   2.738   0.254  1.00  0.00           N  
HETATM   27  N   UNL     1      -6.637   4.073   0.189  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.591   4.797  -0.019  1.00  0.00           N  
HETATM   29  N   UNL     1      -4.543   4.058  -0.085  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.989   1.715   0.053  1.00  0.00           N  
HETATM   31  O   UNL     1      -5.650   0.279   0.394  1.00  0.00           O  
HETATM   32  O   UNL     1       5.441   2.952  -0.058  1.00  0.00           O  
HETATM   33  O   UNL     1       3.854   0.677  -0.810  1.00  0.00           O  
HETATM   34  S   UNL     1      -1.795  -0.573  -0.014  1.00  0.00           S  
HETATM   35  H   UNL     1      -2.934  -3.917   0.416  1.00  0.00           H  
HETATM   36  H   UNL     1       1.987  -2.793   1.389  1.00  0.00           H  
HETATM   37  H   UNL     1       3.819  -1.188   1.029  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.173  -1.068  -1.859  1.00  0.00           H  
HETATM   39  H   UNL     1       1.137   1.736  -2.155  1.00  0.00           H  
HETATM   40  H   UNL     1       2.619   1.082  -2.892  1.00  0.00           H  
HETATM   41  H   UNL     1       1.031   0.423  -3.352  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.783  -2.639  -0.361  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.309  -3.346   1.202  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.861  -1.656   1.121  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.182  -2.444   2.584  1.00  0.00           H  
HETATM   46  H   UNL     1       0.104  -3.354   3.412  1.00  0.00           H  
HETATM   47  H   UNL     1       0.524  -1.991   2.347  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.662  -2.629  -2.240  1.00  0.00           H  
HETATM   49  H   UNL     1       0.045  -2.589  -2.742  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.994  -3.951  -3.228  1.00  0.00           H  
HETATM   51  H   UNL     1       7.803   1.476   2.626  1.00  0.00           H  
HETATM   52  H   UNL     1       6.476   2.588   2.213  1.00  0.00           H  
HETATM   53  H   UNL     1       6.178   0.834   2.284  1.00  0.00           H  
HETATM   54  H   UNL     1       8.540   2.476  -0.883  1.00  0.00           H  
HETATM   55  H   UNL     1       7.855   3.546   0.363  1.00  0.00           H  
HETATM   56  H   UNL     1       9.182   2.434   0.776  1.00  0.00           H  
HETATM   57  H   UNL     1       8.122   0.014  -0.783  1.00  0.00           H  
HETATM   58  H   UNL     1       8.764  -0.027   0.877  1.00  0.00           H  
HETATM   59  H   UNL     1       7.139  -0.668   0.535  1.00  0.00           H  
HETATM   60  H   UNL     1       0.918  -4.232   1.278  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.826  -4.565   1.416  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.126  -4.760  -0.953  1.00  0.00           H  
HETATM   63  H   UNL     1       0.592  -4.451  -1.300  1.00  0.00           H  
HETATM   64  H   UNL     1       5.442  -0.401  -0.045  1.00  0.00           H  
HETATM   65  H   UNL     1       4.660   0.723   1.092  1.00  0.00           H  
HETATM   66  H   UNL     1       6.259   1.575  -1.363  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.744   1.948   0.400  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.040   1.862  -0.083  1.00  0.00           H  
HETATM   69  H   UNL     1       5.189   3.099   0.864  1.00  0.00           H  
CONECT    1   31   31   30    3                                       
CONECT    2   34   24    5    5                                       
CONECT    3    1   34    4    4                                       
CONECT    4    3    3    5   14                                       
CONECT    5    2    2    4   35                                       
CONECT    6    9    9    7   36                                       
CONECT    7   11   11    6   37                                       
CONECT    8   10   10    9   38                                       
CONECT    9    8   24    6    6                                       
CONECT   10   13    8    8   11                                       
CONECT   11   10   33    7    7                                       
CONECT   12   26   30   29   29                                       
CONECT   13   10   39   40   41                                       
CONECT   14    4   42   43   44                                       
CONECT   15   20   45   46   47                                       
CONECT   16   21   48   49   50                                       
CONECT   17   25   51   52   53                                       
CONECT   18   25   54   55   56                                       
CONECT   19   25   57   58   59                                       
CONECT   20   24   15   60   61                                       
CONECT   21   16   24   62   63                                       
CONECT   22   23   33   64   65                                       
CONECT   23   32   25   22   66                                       
CONECT   24   21    9    2   20                                       
CONECT   25   19   23   18   17                                       
CONECT   26   27   12   67                                            
CONECT   27   26   28   28                                            
CONECT   28   27   27   29                                            
CONECT   29   12   12   28                                            
CONECT   30   12    1   68                                            
CONECT   31    1    1                                                 
CONECT   32   23   69                                                 
CONECT   33   11   22                                                 
CONECT   34    3    2                                                 
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   21                                                      
CONECT   63   21                                                      
CONECT   64   22                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   26                                                      
CONECT   68   30                                                      
CONECT   69   32                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
