COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.342  -0.188  -0.523  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.663   1.095  -0.463  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.924   1.500  -0.526  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.911   0.621  -0.653  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.606  -0.740  -0.751  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.274  -1.120  -0.665  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.517  -2.671  -0.742  1.00  0.00           O  
HETATM    8  C   UNL     1      -4.798  -1.742  -0.428  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.342  -0.762   0.520  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.077   0.604   0.368  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.230   1.051  -0.641  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.724   1.963  -1.676  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.440   1.080   2.284  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.681  -0.273   2.456  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.141  -1.193   1.584  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.643   1.520   1.246  1.00  0.00           C  
HETATM   17  N   UNL     1       0.344   2.039  -0.330  1.00  0.00           N  
HETATM   18  C   UNL     1       1.670   1.626  -0.145  1.00  0.00           C  
HETATM   19  C   UNL     1       2.711   2.376  -0.677  1.00  0.00           C  
HETATM   20  C   UNL     1       4.018   1.969  -0.495  1.00  0.00           C  
HETATM   21  C   UNL     1       4.291   0.810   0.221  1.00  0.00           C  
HETATM   22  N   UNL     1       5.616   0.398   0.405  1.00  0.00           N  
HETATM   23  C   UNL     1       6.306   0.251  -0.882  1.00  0.00           C  
HETATM   24  C   UNL     1       7.785  -0.058  -0.638  1.00  0.00           C  
HETATM   25  C   UNL     1       7.904  -1.348   0.177  1.00  0.00           C  
HETATM   26  O   UNL     1       9.281  -1.611   0.457  1.00  0.00           O  
HETATM   27  C   UNL     1       7.137  -1.185   1.492  1.00  0.00           C  
HETATM   28  C   UNL     1       5.677  -0.844   1.186  1.00  0.00           C  
HETATM   29  C   UNL     1       3.250   0.061   0.753  1.00  0.00           C  
HETATM   30  C   UNL     1       1.944   0.471   0.575  1.00  0.00           C  
HETATM   31  N   UNL     1      -3.589  -1.702  -0.970  1.00  0.00           N  
HETATM   32  C   UNL     1      -3.251  -2.785  -1.898  1.00  0.00           C  
HETATM   33  H   UNL     1      -1.000  -2.163  -0.714  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.579   2.994  -1.352  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.175   1.793  -2.602  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.786   1.781  -1.844  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.879   1.795   2.965  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.295  -0.609   3.279  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.335  -2.246   1.721  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.460   2.576   1.117  1.00  0.00           H  
HETATM   41  H   UNL     1       0.131   2.984  -0.365  1.00  0.00           H  
HETATM   42  H   UNL     1       2.498   3.277  -1.233  1.00  0.00           H  
HETATM   43  H   UNL     1       4.827   2.552  -0.909  1.00  0.00           H  
HETATM   44  H   UNL     1       5.853  -0.565  -1.446  1.00  0.00           H  
HETATM   45  H   UNL     1       6.217   1.177  -1.450  1.00  0.00           H  
HETATM   46  H   UNL     1       8.293  -0.183  -1.594  1.00  0.00           H  
HETATM   47  H   UNL     1       8.242   0.764  -0.087  1.00  0.00           H  
HETATM   48  H   UNL     1       7.482  -2.178  -0.390  1.00  0.00           H  
HETATM   49  H   UNL     1       9.431  -2.416   0.971  1.00  0.00           H  
HETATM   50  H   UNL     1       7.182  -2.116   2.058  1.00  0.00           H  
HETATM   51  H   UNL     1       7.583  -0.381   2.077  1.00  0.00           H  
HETATM   52  H   UNL     1       5.131  -0.713   2.120  1.00  0.00           H  
HETATM   53  H   UNL     1       5.227  -1.655   0.613  1.00  0.00           H  
HETATM   54  H   UNL     1       3.463  -0.840   1.309  1.00  0.00           H  
HETATM   55  H   UNL     1       1.134  -0.112   0.989  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.798  -3.608  -1.345  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.156  -3.135  -2.393  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.547  -2.417  -2.644  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2    1    1   17    3                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3   11    5                                       
CONECT    5    4    6    6   31                                       
CONECT    6    1    5    5   33                                       
CONECT    7    8    8                                                 
CONECT    8    7    7    9   31                                       
CONECT    9    8   10   10   15                                       
CONECT   10    9    9   16   11                                       
CONECT   11    4   10   12                                            
CONECT   12   11   34   35   36                                       
CONECT   13   16   16   14   37                                       
CONECT   14   13   15   15   38                                       
CONECT   15    9   14   14   39                                       
CONECT   16   10   13   13   40                                       
CONECT   17    2   18   41                                            
CONECT   18   17   19   19   30                                       
CONECT   19   18   18   20   42                                       
CONECT   20   19   21   21   43                                       
CONECT   21   20   20   22   29                                       
CONECT   22   21   23   28                                            
CONECT   23   22   24   44   45                                       
CONECT   24   23   25   46   47                                       
CONECT   25   24   26   27   48                                       
CONECT   26   25   49                                                 
CONECT   27   25   28   50   51                                       
CONECT   28   22   27   52   53                                       
CONECT   29   21   30   30   54                                       
CONECT   30   18   29   29   55                                       
CONECT   31    5    8   32                                            
CONECT   32   31   56   57   58                                       
CONECT   33    6                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
