COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.229   3.028   1.576  1.00  0.00           O  
HETATM    2  C   UNL     1       2.661   2.541   0.358  1.00  0.00           C  
HETATM    3  C   UNL     1       3.722   1.773  -0.458  1.00  0.00           C  
HETATM    4  N   UNL     1       3.521   0.349  -0.087  1.00  0.00           N  
HETATM    5  C   UNL     1       4.084  -0.546  -1.108  1.00  0.00           C  
HETATM    6  C   UNL     1       5.589  -0.461  -1.075  1.00  0.00           C  
HETATM    7  C   UNL     1       6.475  -1.137  -0.133  1.00  0.00           C  
HETATM    8  N   UNL     1       6.297  -1.964   0.901  1.00  0.00           N  
HETATM    9  C   UNL     1       7.331  -2.418   1.575  1.00  0.00           C  
HETATM   10  N   UNL     1       8.574  -2.088   1.272  1.00  0.00           N  
HETATM   11  C   UNL     1       8.845  -1.271   0.259  1.00  0.00           C  
HETATM   12  N   UNL     1      10.153  -0.934  -0.047  1.00  0.00           N  
HETATM   13  C   UNL     1       7.781  -0.759  -0.491  1.00  0.00           C  
HETATM   14  N   UNL     1       7.680   0.084  -1.573  1.00  0.00           N  
HETATM   15  C   UNL     1       6.369   0.247  -1.912  1.00  0.00           C  
HETATM   16  C   UNL     1       2.045   0.198  -0.004  1.00  0.00           C  
HETATM   17  C   UNL     1       1.558   1.505   0.658  1.00  0.00           C  
HETATM   18  C   UNL     1       0.230   1.950   0.041  1.00  0.00           C  
HETATM   19  S   UNL     1      -1.080   0.795   0.530  1.00  0.00           S  
HETATM   20  C   UNL     1      -2.550   1.477  -0.284  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.763   0.601   0.035  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.003   1.177  -0.651  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.198   0.314  -0.337  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.308  -1.004  -0.537  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.472  -1.389  -0.146  1.00  0.00           N  
HETATM   26  N   UNL     1      -8.142  -0.387   0.305  1.00  0.00           N  
HETATM   27  C   UNL     1      -7.369   0.719   0.209  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.507  -0.436   0.836  1.00  0.00           C  
HETATM   29  C   UNL     1     -10.436  -1.069  -0.202  1.00  0.00           C  
HETATM   30  C   UNL     1     -12.790  -1.753  -0.685  1.00  0.00           C  
HETATM   31  C   UNL     1     -11.861  -1.120   0.353  1.00  0.00           C  
HETATM   32  H   UNL     1       3.929   3.683   1.450  1.00  0.00           H  
HETATM   33  H   UNL     1       2.256   3.367  -0.226  1.00  0.00           H  
HETATM   34  H   UNL     1       3.556   1.915  -1.526  1.00  0.00           H  
HETATM   35  H   UNL     1       4.725   2.101  -0.184  1.00  0.00           H  
HETATM   36  H   UNL     1       3.773  -1.571  -0.904  1.00  0.00           H  
HETATM   37  H   UNL     1       3.725  -0.246  -2.092  1.00  0.00           H  
HETATM   38  H   UNL     1       7.158  -3.085   2.407  1.00  0.00           H  
HETATM   39  H   UNL     1      10.883  -1.295   0.480  1.00  0.00           H  
HETATM   40  H   UNL     1      10.339  -0.337  -0.789  1.00  0.00           H  
HETATM   41  H   UNL     1       8.430   0.499  -2.029  1.00  0.00           H  
HETATM   42  H   UNL     1       6.010   0.859  -2.726  1.00  0.00           H  
HETATM   43  H   UNL     1       1.617   0.094  -1.000  1.00  0.00           H  
HETATM   44  H   UNL     1       1.785  -0.661   0.615  1.00  0.00           H  
HETATM   45  H   UNL     1       1.450   1.368   1.733  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.017   2.951   0.394  1.00  0.00           H  
HETATM   47  H   UNL     1       0.319   1.960  -1.045  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.729   2.490   0.077  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.392   1.499  -1.363  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.585  -0.412  -0.327  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.922   0.579   1.113  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.182   2.190  -0.290  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.845   1.199  -1.730  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.633   1.723   0.505  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.520  -1.034   1.748  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.847   0.575   1.060  1.00  0.00           H  
HETATM   57  H   UNL     1     -10.422  -0.471  -1.113  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.096  -2.080  -0.425  1.00  0.00           H  
HETATM   59  H   UNL     1     -13.805  -1.790  -0.290  1.00  0.00           H  
HETATM   60  H   UNL     1     -12.776  -1.155  -1.597  1.00  0.00           H  
HETATM   61  H   UNL     1     -12.450  -2.764  -0.909  1.00  0.00           H  
HETATM   62  H   UNL     1     -11.874  -1.718   1.265  1.00  0.00           H  
HETATM   63  H   UNL     1     -12.200  -0.109   0.576  1.00  0.00           H  
CONECT    1    2   32                                                 
CONECT    2    3    1   17   33                                       
CONECT    3    4    2   34   35                                       
CONECT    4    5    3   16                                            
CONECT    5    6    4   36   37                                       
CONECT    6   15   15    5    7                                       
CONECT    7   13    6    8    8                                       
CONECT    8    7    7    9                                            
CONECT    9   10   10    8   38                                       
CONECT   10   11    9    9                                            
CONECT   11   12   13   13   10                                       
CONECT   12   11   39   40                                            
CONECT   13   14   11   11    7                                       
CONECT   14   15   13   41                                            
CONECT   15   14    6    6   42                                       
CONECT   16    4   17   43   44                                       
CONECT   17   16    2   18   45                                       
CONECT   18   17   19   46   47                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   48   49                                       
CONECT   21   20   22   50   51                                       
CONECT   22   21   23   52   53                                       
CONECT   23   22   27   27   24                                       
CONECT   24   23   25   25                                            
CONECT   25   24   24   26                                            
CONECT   26   27   25   28                                            
CONECT   27   23   23   26   54                                       
CONECT   28   26   29   55   56                                       
CONECT   29   31   28   57   58                                       
CONECT   30   31   59   60   61                                       
CONECT   31   30   29   62   63                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
