COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.625   0.419   0.595  1.00  0.00           N  
HETATM    2  C   UNL     1       3.812   1.262  -0.029  1.00  0.00           C  
HETATM    3  C   UNL     1       4.313   2.413  -0.634  1.00  0.00           C  
HETATM    4  C   UNL     1       5.675   2.666  -0.575  1.00  0.00           C  
HETATM    5  C   UNL     1       3.389   3.369  -1.343  1.00  0.00           C  
HETATM    6  C   UNL     1       6.800  -0.354   1.387  1.00  0.00           C  
HETATM    7  C   UNL     1       0.139  -1.824  -0.016  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.777   0.181   0.245  1.00  0.00           C  
HETATM    9  C   UNL     1       1.806  -5.173  -0.662  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.645   1.969   0.335  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.981   1.496   0.100  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.391  -0.281  -0.122  1.00  0.00           C  
HETATM   13  C   UNL     1       6.487   1.759   0.087  1.00  0.00           C  
HETATM   14  C   UNL     1       5.920   0.635   0.666  1.00  0.00           C  
HETATM   15  C   UNL     1       0.530  -0.500   0.255  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.213  -2.138  -0.156  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.420   0.493   0.384  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.167  -1.147  -0.021  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.549  -1.132  -0.103  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.949   0.158   0.108  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.902   0.921   0.312  1.00  0.00           N  
HETATM   22  N   UNL     1       1.883  -0.189   0.395  1.00  0.00           N  
HETATM   23  C   UNL     1       1.158  -2.878  -0.159  1.00  0.00           C  
HETATM   24  N   UNL     1       0.792  -4.124  -0.520  1.00  0.00           N  
HETATM   25  O   UNL     1       2.329  -2.624   0.049  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.353   0.623   0.108  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.957   2.396   0.333  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.698   0.161  -0.132  1.00  0.00           C  
HETATM   29  C   UNL     1       2.359   0.978  -0.083  1.00  0.00           C  
HETATM   30  O   UNL     1       1.597   1.796  -0.559  1.00  0.00           O  
HETATM   31  H   UNL     1       6.093   3.549  -1.034  1.00  0.00           H  
HETATM   32  H   UNL     1       2.930   4.038  -0.614  1.00  0.00           H  
HETATM   33  H   UNL     1       3.956   3.954  -2.067  1.00  0.00           H  
HETATM   34  H   UNL     1       2.611   2.806  -1.859  1.00  0.00           H  
HETATM   35  H   UNL     1       6.877  -0.074   2.437  1.00  0.00           H  
HETATM   36  H   UNL     1       6.366  -1.351   1.308  1.00  0.00           H  
HETATM   37  H   UNL     1       7.793  -0.353   0.936  1.00  0.00           H  
HETATM   38  H   UNL     1       1.325  -6.105  -0.957  1.00  0.00           H  
HETATM   39  H   UNL     1       2.528  -4.879  -1.424  1.00  0.00           H  
HETATM   40  H   UNL     1       2.319  -5.314   0.290  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.847   2.672   0.518  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.006   1.837   0.090  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.171  -1.324  -0.299  1.00  0.00           H  
HETATM   44  H   UNL     1       7.552   1.927   0.152  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.514  -3.153  -0.369  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.116   1.508   0.592  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.124  -1.893  -0.277  1.00  0.00           H  
HETATM   48  H   UNL     1       2.481  -0.812   0.836  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.142  -4.327  -0.685  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.185   3.436   0.513  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.501  -0.535  -0.321  1.00  0.00           H  
CONECT    1   14    2    2                                            
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4    5                                       
CONECT    4   13    3    3   31                                       
CONECT    5    3   32   33   34                                       
CONECT    6   14   35   36   37                                       
CONECT    7   15   15   16   23                                       
CONECT    8   17   17   18   21                                       
CONECT    9   24   38   39   40                                       
CONECT   10   26   26   27   41                                       
CONECT   11   27   27   28   42                                       
CONECT   12   26   28   28   43                                       
CONECT   13   14   14    4   44                                       
CONECT   14   13   13    1    6                                       
CONECT   15    7    7   17   22                                       
CONECT   16    7   18   18   45                                       
CONECT   17   15    8    8   46                                       
CONECT   18   16   16    8   19                                       
CONECT   19   18   20   47                                            
CONECT   20   19   21   21   26                                       
CONECT   21    8   20   20                                            
CONECT   22   15   29   48                                            
CONECT   23    7   24   25   25                                       
CONECT   24   23    9   49                                            
CONECT   25   23   23                                                 
CONECT   26   20   10   10   12                                       
CONECT   27   10   11   11   50                                       
CONECT   28   11   12   12   51                                       
CONECT   29    2   22   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
