COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.766   2.778  -0.957  1.00  0.00           C  
HETATM    2  C   UNL     1       4.366   2.247   0.421  1.00  0.00           C  
HETATM    3  C   UNL     1       3.003   0.131   0.148  1.00  0.00           C  
HETATM    4  C   UNL     1       4.137  -0.814   0.054  1.00  0.00           C  
HETATM    5  C   UNL     1       3.960  -2.178   0.308  1.00  0.00           C  
HETATM    6  C   UNL     1       6.189  -2.526  -0.127  1.00  0.00           C  
HETATM    7  N   UNL     1       6.401  -1.248  -0.370  1.00  0.00           N  
HETATM    8  C   UNL     1       5.417  -0.369  -0.298  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.754   0.401   0.082  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.258   0.756  -1.342  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.745   0.346  -1.295  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.044  -1.231   0.159  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.330  -0.890  -0.550  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.604  -1.593  -0.079  1.00  0.00           C  
HETATM   15  C   UNL     1       1.846   2.004   0.344  1.00  0.00           C  
HETATM   16  N   UNL     1       3.118   1.488   0.308  1.00  0.00           N  
HETATM   17  N   UNL     1       5.000  -2.988   0.207  1.00  0.00           N  
HETATM   18  C   UNL     1       7.344  -3.489  -0.223  1.00  0.00           C  
HETATM   19  N   UNL     1       1.737  -0.201   0.084  1.00  0.00           N  
HETATM   20  C   UNL     1       0.975   0.909   0.205  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.410   1.159   0.209  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.316   0.122   0.076  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.891  -0.641  -0.215  1.00  0.00           N  
HETATM   24  O   UNL     1      -6.048  -2.035   1.067  1.00  0.00           O  
HETATM   25  C   UNL     1      -8.386  -0.112   0.236  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.569  -0.881   0.389  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.826   2.413   0.343  1.00  0.00           N  
HETATM   28  C   UNL     1       0.031   3.409   0.470  1.00  0.00           C  
HETATM   29  N   UNL     1       1.335   3.224   0.472  1.00  0.00           N  
HETATM   30  H   UNL     1       3.979   3.428  -1.339  1.00  0.00           H  
HETATM   31  H   UNL     1       5.695   3.342  -0.873  1.00  0.00           H  
HETATM   32  H   UNL     1       4.910   1.941  -1.640  1.00  0.00           H  
HETATM   33  H   UNL     1       5.153   1.597   0.803  1.00  0.00           H  
HETATM   34  H   UNL     1       4.222   3.084   1.105  1.00  0.00           H  
HETATM   35  H   UNL     1       2.989  -2.563   0.583  1.00  0.00           H  
HETATM   36  H   UNL     1       5.597   0.675  -0.507  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.993   1.195   0.790  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.158   1.825  -1.531  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.720   0.181  -2.095  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.364   1.218  -1.086  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.038  -0.097  -2.247  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.237  -0.678  -1.615  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.350  -1.842  -0.833  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.513  -2.302   0.744  1.00  0.00           H  
HETATM   45  H   UNL     1       7.833  -3.567   0.748  1.00  0.00           H  
HETATM   46  H   UNL     1       6.976  -4.470  -0.524  1.00  0.00           H  
HETATM   47  H   UNL     1       8.059  -3.127  -0.962  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.000  -0.790  -0.021  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.151   0.154   1.267  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.988   0.613  -0.311  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.094  -1.750  -0.067  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.663  -1.021   1.466  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.351   4.414   0.577  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2   16    1   33   34                                       
CONECT    3    4   16   19   19                                       
CONECT    4    5    5    8    3                                       
CONECT    5   17    4    4   35                                       
CONECT    6   18   17   17    7                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    4   36                                       
CONECT    9   26   22   10   37                                       
CONECT   10   11    9   38   39                                       
CONECT   11   23   10   40   41                                       
CONECT   12   13   24   24   23                                       
CONECT   13   25   14   12   42                                       
CONECT   14   25   13   43   44                                       
CONECT   15   16   29   29   20                                       
CONECT   16    2    3   15                                            
CONECT   17    6    6    5                                            
CONECT   18    6   45   46   47                                       
CONECT   19    3    3   20                                            
CONECT   20   15   19   21   21                                       
CONECT   21   20   20   27   22                                       
CONECT   22   21    9   48                                            
CONECT   23   12   26   11                                            
CONECT   24   12   12                                                 
CONECT   25   13   14   49   50                                       
CONECT   26   23    9   51   52                                       
CONECT   27   28   28   21                                            
CONECT   28   29   27   27   53                                       
CONECT   29   15   15   28                                            
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
