COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.384  -1.716  -0.013  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.003  -1.531  -0.009  1.00  0.00           C  
HETATM    3  C   UNL     1       1.066  -0.469   0.000  1.00  0.00           C  
HETATM    4  C   UNL     1       3.356   0.160   0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       5.415  -3.599   0.669  1.00  0.00           C  
HETATM    6  C   UNL     1       6.604  -3.760  -0.019  1.00  0.00           C  
HETATM    7  C   UNL     1       7.164  -2.692  -0.697  1.00  0.00           C  
HETATM    8  C   UNL     1       6.535  -1.462  -0.691  1.00  0.00           C  
HETATM    9  C   UNL     1       4.652   3.614   0.050  1.00  0.00           C  
HETATM   10  C   UNL     1       4.364   4.161   1.450  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.745  -1.146  -0.016  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.858  -1.990  -0.030  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.195   0.769  -0.008  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.933   1.774  -0.014  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.230  -2.921  -0.022  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.311  -0.900  -0.006  1.00  0.00           O  
HETATM   17  O   UNL     1       0.756   0.703   0.008  1.00  0.00           O  
HETATM   18  N   UNL     1       2.367  -0.823  -0.001  1.00  0.00           N  
HETATM   19  C   UNL     1       3.155   1.506   0.023  1.00  0.00           C  
HETATM   20  C   UNL     1       4.407   2.127   0.032  1.00  0.00           C  
HETATM   21  N   UNL     1       5.330   1.200   0.023  1.00  0.00           N  
HETATM   22  N   UNL     1       4.701  -0.052   0.007  1.00  0.00           N  
HETATM   23  C   UNL     1       5.341  -1.298  -0.002  1.00  0.00           C  
HETATM   24  C   UNL     1       4.780  -2.373   0.675  1.00  0.00           C  
HETATM   25  C   UNL     1       3.730   4.295  -0.964  1.00  0.00           C  
HETATM   26  C   UNL     1       6.110   3.895  -0.317  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.127  -1.454  -0.032  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.300  -0.075  -0.021  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.923   0.240   0.000  1.00  0.00           C  
HETATM   30  N   UNL     1      -7.591   0.466  -0.023  1.00  0.00           N  
HETATM   31  N   UNL     1      -9.239   1.833  -0.015  1.00  0.00           N  
HETATM   32  N   UNL     1      -9.746   0.653  -0.024  1.00  0.00           N  
HETATM   33  N   UNL     1      -8.811  -0.234  -0.035  1.00  0.00           N  
HETATM   34  H   UNL     1       0.102  -2.145  -0.904  1.00  0.00           H  
HETATM   35  H   UNL     1       0.100  -2.158   0.876  1.00  0.00           H  
HETATM   36  H   UNL     1       4.981  -4.435   1.198  1.00  0.00           H  
HETATM   37  H   UNL     1       7.098  -4.720  -0.025  1.00  0.00           H  
HETATM   38  H   UNL     1       8.093  -2.821  -1.233  1.00  0.00           H  
HETATM   39  H   UNL     1       6.974  -0.628  -1.217  1.00  0.00           H  
HETATM   40  H   UNL     1       5.020   3.676   2.172  1.00  0.00           H  
HETATM   41  H   UNL     1       4.541   5.237   1.463  1.00  0.00           H  
HETATM   42  H   UNL     1       3.325   3.961   1.711  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.724  -3.062  -0.038  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.334   1.840   0.004  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.254   2.613  -0.004  1.00  0.00           H  
HETATM   46  H   UNL     1       2.614  -1.760  -0.008  1.00  0.00           H  
HETATM   47  H   UNL     1       2.197   2.005   0.027  1.00  0.00           H  
HETATM   48  H   UNL     1       3.851  -2.249   1.212  1.00  0.00           H  
HETATM   49  H   UNL     1       3.908   5.370  -0.951  1.00  0.00           H  
HETATM   50  H   UNL     1       3.936   3.905  -1.960  1.00  0.00           H  
HETATM   51  H   UNL     1       2.691   4.095  -0.702  1.00  0.00           H  
HETATM   52  H   UNL     1       6.767   3.409   0.405  1.00  0.00           H  
HETATM   53  H   UNL     1       6.316   3.504  -1.314  1.00  0.00           H  
HETATM   54  H   UNL     1       6.288   4.970  -0.304  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.988  -2.106  -0.043  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.065   0.896   0.010  1.00  0.00           H  
CONECT    1   11   15   15   16                                       
CONECT    2   16    3   34   35                                       
CONECT    3    2   17   17   18                                       
CONECT    4   18   19   19   22                                       
CONECT    5   24   24    6   36                                       
CONECT    6    7    7    5   37                                       
CONECT    7    8    6    6   38                                       
CONECT    8   23   23    7   39                                       
CONECT    9   26   25   20   10                                       
CONECT   10    9   40   41   42                                       
CONECT   11   12   12   29    1                                       
CONECT   12   27   11   11   43                                       
CONECT   13   28   29   29   44                                       
CONECT   14   31   31   30   45                                       
CONECT   15    1    1                                                 
CONECT   16    1    2                                                 
CONECT   17    3    3                                                 
CONECT   18    3    4   46                                            
CONECT   19    4    4   20   47                                       
CONECT   20   19    9   21   21                                       
CONECT   21   20   20   22                                            
CONECT   22    4   21   23                                            
CONECT   23   22    8    8   24                                       
CONECT   24   23    5    5   48                                       
CONECT   25    9   49   50   51                                       
CONECT   26    9   52   53   54                                       
CONECT   27   28   28   12   55                                       
CONECT   28   30   27   27   13                                       
CONECT   29   13   13   11   56                                       
CONECT   30   14   33   28                                            
CONECT   31   32   14   14                                            
CONECT   32   31   33   33                                            
CONECT   33   32   32   30                                            
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   29                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
