COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.314   1.447   0.361  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.845   0.139   0.333  1.00  0.00           C  
HETATM    3  C   UNL     1       6.748  -0.938  -0.539  1.00  0.00           C  
HETATM    4  C   UNL     1       6.260   0.322  -0.247  1.00  0.00           C  
HETATM    5  O   UNL     1       0.833   2.398  -0.238  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.364   2.600   0.554  1.00  0.00           C  
HETATM    7  C   UNL     1       4.968   0.474   0.221  1.00  0.00           C  
HETATM    8  C   UNL     1       4.442   1.844   0.554  1.00  0.00           C  
HETATM    9  C   UNL     1       3.295   2.239  -0.373  1.00  0.00           C  
HETATM   10  C   UNL     1       5.942  -2.049  -0.374  1.00  0.00           C  
HETATM   11  C   UNL     1       4.645  -1.898   0.080  1.00  0.00           C  
HETATM   12  C   UNL     1       4.166  -0.641   0.390  1.00  0.00           C  
HETATM   13  C   UNL     1       0.058  -2.416  -0.629  1.00  0.00           C  
HETATM   14  C   UNL     1       1.200  -3.002   0.207  1.00  0.00           C  
HETATM   15  C   UNL     1       2.484  -2.873  -0.610  1.00  0.00           C  
HETATM   16  C   UNL     1       3.747  -3.106   0.208  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.736  -0.901   0.173  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.245  -2.327   0.152  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.029  -0.664   0.035  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.672   1.661   0.215  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.515   0.567   0.049  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.882   0.768  -0.106  1.00  0.00           N  
HETATM   23  S   UNL     1      -5.892  -0.529  -0.305  1.00  0.00           S  
HETATM   24  C   UNL     1      -6.380  -0.986   1.381  1.00  0.00           C  
HETATM   25  O   UNL     1      -7.002  -0.002  -1.020  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.064  -1.534  -0.874  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.429   2.127  -0.092  1.00  0.00           C  
HETATM   28  C   UNL     1       1.318  -2.253   1.532  1.00  0.00           C  
HETATM   29  C   UNL     1       2.007   2.319   0.408  1.00  0.00           C  
HETATM   30  O   UNL     1       2.031   2.315   1.615  1.00  0.00           O  
HETATM   31  C   UNL     1       3.591   3.618  -0.977  1.00  0.00           C  
HETATM   32  N   UNL     1       3.150   1.266  -1.461  1.00  0.00           N  
HETATM   33  H   UNL     1       0.214  -0.046   0.428  1.00  0.00           H  
HETATM   34  H   UNL     1       7.761  -1.056  -0.894  1.00  0.00           H  
HETATM   35  H   UNL     1       6.890   1.189  -0.382  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.854   3.525   0.241  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.103   2.679   1.610  1.00  0.00           H  
HETATM   38  H   UNL     1       4.101   1.855   1.591  1.00  0.00           H  
HETATM   39  H   UNL     1       5.252   2.572   0.449  1.00  0.00           H  
HETATM   40  H   UNL     1       6.326  -3.033  -0.600  1.00  0.00           H  
HETATM   41  H   UNL     1       3.162  -0.512   0.764  1.00  0.00           H  
HETATM   42  H   UNL     1       0.349  -1.423  -0.981  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.091  -3.055  -1.507  1.00  0.00           H  
HETATM   44  H   UNL     1       0.997  -4.057   0.403  1.00  0.00           H  
HETATM   45  H   UNL     1       2.450  -3.600  -1.431  1.00  0.00           H  
HETATM   46  H   UNL     1       2.521  -1.873  -1.056  1.00  0.00           H  
HETATM   47  H   UNL     1       4.283  -3.970  -0.216  1.00  0.00           H  
HETATM   48  H   UNL     1       3.549  -3.319   1.247  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.003  -2.940  -0.359  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.147  -2.703   1.163  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.074   2.663   0.229  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.887  -0.144   1.854  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.054  -1.842   1.345  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.493  -1.246   1.958  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.440   2.524  -1.107  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.445   2.106   0.301  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.807   2.763   0.539  1.00  0.00           H  
HETATM   58  H   UNL     1       0.384  -2.346   2.086  1.00  0.00           H  
HETATM   59  H   UNL     1       2.133  -2.679   2.118  1.00  0.00           H  
HETATM   60  H   UNL     1       1.522  -1.201   1.337  1.00  0.00           H  
HETATM   61  H   UNL     1       4.522   3.575  -1.543  1.00  0.00           H  
HETATM   62  H   UNL     1       2.776   3.907  -1.640  1.00  0.00           H  
HETATM   63  H   UNL     1       3.686   4.353  -0.177  1.00  0.00           H  
HETATM   64  H   UNL     1       2.393   1.522  -2.077  1.00  0.00           H  
HETATM   65  H   UNL     1       4.013   1.164  -1.973  1.00  0.00           H  
CONECT    1   20    6    2    2                                       
CONECT    2    1    1   17   33                                       
CONECT    3    4   10   10   34                                       
CONECT    4    3    7    7   35                                       
CONECT    5    6   29                                                 
CONECT    6    1    5   36   37                                       
CONECT    7    4    4    8   12                                       
CONECT    8    7    9   38   39                                       
CONECT    9    8   29   31   32                                       
CONECT   10    3    3   11   40                                       
CONECT   11   10   12   12   16                                       
CONECT   12    7   11   11   41                                       
CONECT   13   18   14   42   43                                       
CONECT   14   13   15   28   44                                       
CONECT   15   14   16   45   46                                       
CONECT   16   11   15   47   48                                       
CONECT   17    2   19   19   18                                       
CONECT   18   13   17   49   50                                       
CONECT   19   17   17   21                                            
CONECT   20    1   21   21   51                                       
CONECT   21   19   20   20   22                                       
CONECT   22   21   27   23                                            
CONECT   23   22   24   25   25                                       
CONECT   23   26   26                                                 
CONECT   24   23   52   53   54                                       
CONECT   25   23   23                                                 
CONECT   26   23   23                                                 
CONECT   27   22   55   56   57                                       
CONECT   28   14   58   59   60                                       
CONECT   29    5    9   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    9   61   62   63                                       
CONECT   32    9   64   65                                            
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
