COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.325  -0.069  -0.007  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.571   1.809  -0.063  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.254   1.330  -0.048  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.410  -1.048  -0.033  1.00  0.00           N  
HETATM    5  C   UNL     1       0.484  -2.991  -0.597  1.00  0.00           C  
HETATM    6  C   UNL     1       1.511  -2.648   0.468  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.655  -0.396   0.057  1.00  0.00           N  
HETATM    8  C   UNL     1       3.750  -1.884   0.783  1.00  0.00           C  
HETATM    9  C   UNL     1       3.953  -0.445   0.342  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.027   2.158  -0.048  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.099   3.551  -0.103  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.393   0.792  -0.015  1.00  0.00           N  
HETATM   13  C   UNL     1       0.055   4.312  -0.098  1.00  0.00           C  
HETATM   14  C   UNL     1       1.293   3.704  -0.033  1.00  0.00           C  
HETATM   15  C   UNL     1       1.380   2.315   0.030  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.811  -3.346   0.033  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.107  -2.668   0.242  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.045  -1.699   0.188  1.00  0.00           C  
HETATM   19  C   UNL     1       0.222   1.542   0.015  1.00  0.00           C  
HETATM   20  C   UNL     1       2.697   1.635   0.108  1.00  0.00           C  
HETATM   21  O   UNL     1       3.740   2.236  -0.037  1.00  0.00           O  
HETATM   22  N   UNL     1       2.662   0.283   0.357  1.00  0.00           N  
HETATM   23  N   UNL     1       2.892  -2.702  -0.127  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.747  -2.306   0.088  1.00  0.00           C  
HETATM   25  C   UNL     1       2.811  -1.966  -1.430  1.00  0.00           C  
HETATM   26  H   UNL     1      -3.860   2.848  -0.112  1.00  0.00           H  
HETATM   27  H   UNL     1       0.302  -2.135  -1.252  1.00  0.00           H  
HETATM   28  H   UNL     1       0.825  -3.842  -1.190  1.00  0.00           H  
HETATM   29  H   UNL     1       1.337  -1.672   0.887  1.00  0.00           H  
HETATM   30  H   UNL     1       1.483  -3.397   1.266  1.00  0.00           H  
HETATM   31  H   UNL     1       4.719  -2.392   0.848  1.00  0.00           H  
HETATM   32  H   UNL     1       3.284  -1.909   1.773  1.00  0.00           H  
HETATM   33  H   UNL     1       4.618   0.049   1.084  1.00  0.00           H  
HETATM   34  H   UNL     1       4.464  -0.350  -0.609  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.062   4.039  -0.148  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.012   5.388  -0.140  1.00  0.00           H  
HETATM   37  H   UNL     1       2.190   4.306  -0.029  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.991  -4.233   0.383  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.387  -3.700   0.382  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.095  -1.951   0.247  1.00  0.00           H  
HETATM   41  H   UNL     1       0.283   0.465   0.042  1.00  0.00           H  
HETATM   42  H   UNL     1       1.822  -0.154   0.551  1.00  0.00           H  
HETATM   43  H   UNL     1       3.816  -1.788  -1.810  1.00  0.00           H  
HETATM   44  H   UNL     1       2.250  -2.562  -2.149  1.00  0.00           H  
HETATM   45  H   UNL     1       2.306  -1.012  -1.277  1.00  0.00           H  
CONECT    1    3    3    4    7                                       
CONECT    2    3   12   12   26                                       
CONECT    3   10    1    1    2                                       
CONECT    4    1   24   24                                            
CONECT    5    6   16   27   28                                       
CONECT    6   23    5   29   30                                       
CONECT    7    1   12   18                                            
CONECT    8    9   23   31   32                                       
CONECT    9   22    8   33   34                                       
CONECT   10   19   19   11    3                                       
CONECT   11   13   13   10   35                                       
CONECT   12    2    2    7                                            
CONECT   13   14   11   11   36                                       
CONECT   14   15   15   13   37                                       
CONECT   15   20   14   14   19                                       
CONECT   16    5   24   38                                            
CONECT   17   24   18   18   39                                       
CONECT   18    7   17   17   40                                       
CONECT   19   15   10   10   41                                       
CONECT   20   21   21   22   15                                       
CONECT   21   20   20                                                 
CONECT   22   20    9   42                                            
CONECT   23   25    8    6                                            
CONECT   24    4    4   16   17                                       
CONECT   25   23   43   44   45                                       
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
