COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.481   1.780   0.436  1.00  0.00           C  
HETATM    2  N   UNL     1       1.044   1.950   0.022  1.00  0.00           N  
HETATM    3  O   UNL     1       0.860  -0.248  -0.249  1.00  0.00           O  
HETATM    4  C   UNL     1       5.084  -0.337   0.052  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.933  -1.011  -0.260  1.00  0.00           N  
HETATM    6  C   UNL     1       6.105  -1.379  -0.036  1.00  0.00           C  
HETATM    7  C   UNL     1       5.935  -2.426  -1.107  1.00  0.00           C  
HETATM    8  C   UNL     1       5.092  -3.578  -0.577  1.00  0.00           C  
HETATM    9  C   UNL     1       4.065  -3.036   0.430  1.00  0.00           C  
HETATM   10  C   UNL     1       3.121  -2.024  -0.225  1.00  0.00           C  
HETATM   11  C   UNL     1       3.697  -0.640  -0.067  1.00  0.00           C  
HETATM   12  C   UNL     1       3.035   0.540   0.018  1.00  0.00           C  
HETATM   13  C   UNL     1       1.581   0.718  -0.078  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.347   2.108   0.047  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.922   3.308  -0.368  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.791   5.530  -1.207  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.298   3.458  -0.341  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.099   2.420   0.096  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.530   1.229   0.508  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.097  -0.717  -1.046  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.412  -1.400  -0.596  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.139  -2.869  -0.190  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.135  -3.499  -1.111  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.798  -3.395  -0.385  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.058  -2.164  -0.661  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.158   1.069   0.479  1.00  0.00           C  
HETATM   27  N   UNL     1       3.960   1.548   0.209  1.00  0.00           N  
HETATM   28  C   UNL     1       5.197   1.018   0.237  1.00  0.00           C  
HETATM   29  O   UNL     1       7.053  -1.400   0.722  1.00  0.00           O  
HETATM   30  O   UNL     1      -0.133   4.329  -0.797  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.773   0.504   1.498  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.748  -0.903   1.902  1.00  0.00           O  
HETATM   33  S   UNL     1      -3.558  -0.090   1.064  1.00  0.00           S  
HETATM   34  H   UNL     1       6.712   1.833   1.500  1.00  0.00           H  
HETATM   35  H   UNL     1       7.291   1.270  -0.086  1.00  0.00           H  
HETATM   36  H   UNL     1       6.371   2.789   0.038  1.00  0.00           H  
HETATM   37  H   UNL     1       1.622   2.728   0.077  1.00  0.00           H  
HETATM   38  H   UNL     1       5.440  -1.983  -1.971  1.00  0.00           H  
HETATM   39  H   UNL     1       6.914  -2.801  -1.405  1.00  0.00           H  
HETATM   40  H   UNL     1       4.571  -4.058  -1.405  1.00  0.00           H  
HETATM   41  H   UNL     1       5.738  -4.304  -0.083  1.00  0.00           H  
HETATM   42  H   UNL     1       3.479  -3.866   0.825  1.00  0.00           H  
HETATM   43  H   UNL     1       4.592  -2.550   1.251  1.00  0.00           H  
HETATM   44  H   UNL     1       3.016  -2.257  -1.284  1.00  0.00           H  
HETATM   45  H   UNL     1       2.144  -2.071   0.258  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.463   5.310  -2.036  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.364   5.933  -0.372  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.048   6.261  -1.525  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.746   4.387  -0.662  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.173   2.539   0.117  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.252   0.362  -1.032  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.896  -1.016  -2.075  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.827  -0.860   0.255  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.129  -1.380  -1.418  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.755  -2.893   0.830  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.071  -3.433  -0.235  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.388  -4.545  -1.287  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.095  -2.955  -2.055  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.980  -3.456   0.688  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.177  -4.242  -0.678  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.831  -2.103  -1.725  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.134  -2.145  -0.083  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.716   0.136   0.797  1.00  0.00           H  
HETATM   64  H   UNL     1       3.751   2.490   0.308  1.00  0.00           H  
CONECT    1   28   34   35   36                                       
CONECT    2   13   14   37                                            
CONECT    3   13   13                                                 
CONECT    4   28   28    6   11                                       
CONECT    5   20   25   33                                            
CONECT    6   29   29    4    7                                       
CONECT    7    6    8   38   39                                       
CONECT    8    7    9   40   41                                       
CONECT    9   10    8   42   43                                       
CONECT   10   11    9   44   45                                       
CONECT   11    4   12   12   10                                       
CONECT   12   27   13   11   11                                       
CONECT   13    3    3   12    2                                       
CONECT   14   26   26    2   15                                       
CONECT   15   14   30   17   17                                       
CONECT   16   30   46   47   48                                       
CONECT   17   15   15   18   49                                       
CONECT   18   19   19   17   50                                       
CONECT   19   33   26   18   18                                       
CONECT   20   21    5   51   52                                       
CONECT   21   20   22   53   54                                       
CONECT   22   21   23   55   56                                       
CONECT   23   22   24   57   58                                       
CONECT   24   23   25   59   60                                       
CONECT   25    5   24   61   62                                       
CONECT   26   14   14   19   63                                       
CONECT   27   28   12   64                                            
CONECT   28    1   27    4    4                                       
CONECT   29    6    6                                                 
CONECT   30   15   16                                                 
CONECT   31   33   33                                                 
CONECT   32   33   33                                                 
CONECT   33    5   32   32   19                                       
CONECT   33   31   31                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
