COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.046   0.215   0.496  1.00  0.00           C  
HETATM    2  C   UNL     1       0.227  -0.232  -0.118  1.00  0.00           C  
HETATM    3  N   UNL     1      -3.213   0.815   0.927  1.00  0.00           N  
HETATM    4  C   UNL     1      -8.764   0.102  -0.401  1.00  0.00           C  
HETATM    5  N   UNL     1       1.552   0.195  -0.257  1.00  0.00           N  
HETATM    6  C   UNL     1       2.565  -0.661  -0.020  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.541  -0.653  -0.915  1.00  0.00           C  
HETATM    8  N   UNL     1       8.535  -0.322   0.163  1.00  0.00           N  
HETATM    9  N   UNL     1      -3.724  -1.236   0.385  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.203  -0.115   0.839  1.00  0.00           C  
HETATM   11  O   UNL     1       2.329  -1.827   0.233  1.00  0.00           O  
HETATM   12  C   UNL     1       3.962  -0.184  -0.068  1.00  0.00           C  
HETATM   13  C   UNL     1       4.232   1.161  -0.361  1.00  0.00           C  
HETATM   14  C   UNL     1       5.514   1.618  -0.409  1.00  0.00           C  
HETATM   15  C   UNL     1       6.578   0.748  -0.166  1.00  0.00           C  
HETATM   16  N   UNL     1       7.937   0.905  -0.141  1.00  0.00           N  
HETATM   17  C   UNL     1       8.652   2.158  -0.394  1.00  0.00           C  
HETATM   18  C   UNL     1       7.624  -1.236   0.330  1.00  0.00           C  
HETATM   19  C   UNL     1       6.321  -0.606   0.130  1.00  0.00           C  
HETATM   20  C   UNL     1       5.005  -1.069   0.177  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.734   0.644   0.359  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.120  -1.538  -0.459  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.406  -1.974  -0.320  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.391  -1.105   0.157  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.645   0.122   1.206  1.00  0.00           C  
HETATM   26  N   UNL     1      -6.401   0.497   0.004  1.00  0.00           N  
HETATM   27  C   UNL     1      -7.748   0.982   0.356  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.904   2.443  -0.071  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.927  -0.463  -1.579  1.00  0.00           C  
HETATM   30  H   UNL     1      -3.308   1.730   1.237  1.00  0.00           H  
HETATM   31  H   UNL     1      -9.126  -0.705   0.236  1.00  0.00           H  
HETATM   32  H   UNL     1      -9.596   0.703  -0.769  1.00  0.00           H  
HETATM   33  H   UNL     1       1.741   1.108  -0.525  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.753  -0.635  -1.668  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.510  -1.589  -0.358  1.00  0.00           H  
HETATM   36  H   UNL     1       3.415   1.842  -0.551  1.00  0.00           H  
HETATM   37  H   UNL     1       5.708   2.656  -0.635  1.00  0.00           H  
HETATM   38  H   UNL     1       8.873   2.243  -1.458  1.00  0.00           H  
HETATM   39  H   UNL     1       8.031   2.999  -0.084  1.00  0.00           H  
HETATM   40  H   UNL     1       9.583   2.166   0.173  1.00  0.00           H  
HETATM   41  H   UNL     1       7.799  -2.274   0.572  1.00  0.00           H  
HETATM   42  H   UNL     1       4.799  -2.105   0.403  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.463   1.656   0.622  1.00  0.00           H  
HETATM   44  H   UNL     1       0.637  -2.213  -0.830  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.666  -2.987  -0.590  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.066  -0.789   1.631  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.706   0.927   1.939  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.906   0.890   1.431  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.906   2.790   0.180  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.166   3.055   0.448  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.750   2.525  -1.147  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.330  -1.416  -1.922  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.872   0.254  -2.398  1.00  0.00           H  
CONECT    1   24    3   21   21                                       
CONECT    2   22   22   21    5                                       
CONECT    3   10    1   30                                            
CONECT    4   29   27   31   32                                       
CONECT    5    2    6   33                                            
CONECT    6    5   11   11   12                                       
CONECT    7   29   26   34   35                                       
CONECT    8   18   18   16                                            
CONECT    9   24   10   10                                            
CONECT   10    9    9   25    3                                       
CONECT   11    6    6                                                 
CONECT   12    6   20   20   13                                       
CONECT   13   12   14   14   36                                       
CONECT   14   13   13   15   37                                       
CONECT   15   19   19   14   16                                       
CONECT   16    8   15   17                                            
CONECT   17   16   38   39   40                                       
CONECT   18   19    8    8   41                                       
CONECT   19   20   18   15   15                                       
CONECT   20   12   12   19   42                                       
CONECT   21    1    1    2   43                                       
CONECT   22   23    2    2   44                                       
CONECT   23   24   24   22   45                                       
CONECT   24    9   23   23    1                                       
CONECT   25   26   10   46   47                                       
CONECT   26    7   27   25                                            
CONECT   27    4   26   28   48                                       
CONECT   28   27   49   50   51                                       
CONECT   29    7    4   52   53                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
