COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.253   0.165  -0.771  1.00  0.00           C  
HETATM    2  N   UNL     1       4.755  -1.047  -0.605  1.00  0.00           N  
HETATM    3  C   UNL     1       3.524  -1.225  -0.141  1.00  0.00           C  
HETATM    4  N   UNL     1       2.738  -0.207   0.177  1.00  0.00           N  
HETATM    5  C   UNL     1       3.160   1.045   0.040  1.00  0.00           C  
HETATM    6  C   UNL     1       4.464   1.274  -0.451  1.00  0.00           C  
HETATM    7  C   UNL     1       3.014  -2.606   0.027  1.00  0.00           C  
HETATM    8  C   UNL     1       3.820  -3.696  -0.300  1.00  0.00           C  
HETATM    9  C   UNL     1       3.339  -4.979  -0.141  1.00  0.00           C  
HETATM   10  C   UNL     1       2.060  -5.187   0.342  1.00  0.00           C  
HETATM   11  C   UNL     1       1.255  -4.110   0.669  1.00  0.00           C  
HETATM   12  C   UNL     1       1.727  -2.822   0.519  1.00  0.00           C  
HETATM   13  N   UNL     1       2.338   2.103   0.372  1.00  0.00           N  
HETATM   14  C   UNL     1       0.983   1.880   0.637  1.00  0.00           C  
HETATM   15  C   UNL     1       0.057   2.893   0.426  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.280   2.669   0.688  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.698   1.438   1.159  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.778   0.427   1.370  1.00  0.00           C  
HETATM   19  C   UNL     1       0.560   0.643   1.105  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.158   1.197   1.444  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.831   0.669   0.204  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.148   0.380   0.223  1.00  0.00           N  
HETATM   23  O   UNL     1      -3.189   0.505  -0.811  1.00  0.00           O  
HETATM   24  C   UNL     1       4.981   2.644  -0.615  1.00  0.00           C  
HETATM   25  O   UNL     1       4.335   3.590  -0.207  1.00  0.00           O  
HETATM   26  N   UNL     1       6.169   2.848  -1.216  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.802  -0.133  -0.982  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.285  -0.377  -0.693  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.422  -1.400   0.437  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.946   0.938  -0.274  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.969  -0.913  -1.952  1.00  0.00           C  
HETATM   32  H   UNL     1       6.257   0.298  -1.146  1.00  0.00           H  
HETATM   33  H   UNL     1       4.819  -3.535  -0.677  1.00  0.00           H  
HETATM   34  H   UNL     1       3.963  -5.824  -0.394  1.00  0.00           H  
HETATM   35  H   UNL     1       1.686  -6.193   0.461  1.00  0.00           H  
HETATM   36  H   UNL     1       0.257  -4.278   1.045  1.00  0.00           H  
HETATM   37  H   UNL     1       1.097  -1.982   0.774  1.00  0.00           H  
HETATM   38  H   UNL     1       2.700   3.001   0.422  1.00  0.00           H  
HETATM   39  H   UNL     1       0.382   3.855   0.058  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.001   3.457   0.525  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.107  -0.533   1.738  1.00  0.00           H  
HETATM   42  H   UNL     1       1.278  -0.147   1.270  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.256   0.469   2.249  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.629   2.134   1.743  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.661   0.512   1.036  1.00  0.00           H  
HETATM   46  H   UNL     1       6.684   2.093  -1.541  1.00  0.00           H  
HETATM   47  H   UNL     1       6.509   3.750  -1.324  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.705   0.596  -1.787  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.332  -1.069  -1.281  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.478  -1.574   0.643  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.951  -2.336   0.138  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.935  -1.018   1.334  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.848   1.666  -1.079  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.002   0.764  -0.068  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.459   1.319   0.623  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.871  -0.185  -2.757  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.498  -1.850  -2.251  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.025  -1.087  -1.746  1.00  0.00           H  
CONECT    1    2    6    6   32                                       
CONECT    2    3    3    1                                            
CONECT    3    7    2    2    4                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4   13    6                                       
CONECT    6    1    1    5   24                                       
CONECT    7   12   12    8    3                                       
CONECT    8    9    9    7   33                                       
CONECT    9   10    8    8   34                                       
CONECT   10   11   11    9   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12   11    7    7   37                                       
CONECT   13   14    5   38                                            
CONECT   14   19   19   15   13                                       
CONECT   15   16   16   14   39                                       
CONECT   16   17   15   15   40                                       
CONECT   17   20   18   18   16                                       
CONECT   18   17   17   19   41                                       
CONECT   19   18   14   14   42                                       
CONECT   20   21   17   43   44                                       
CONECT   21   22   23   23   20                                       
CONECT   22   27   21   45                                            
CONECT   23   21   21                                                 
CONECT   24    6   26   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   24   46   47                                            
CONECT   27   28   22   48   49                                       
CONECT   28   31   29   30   27                                       
CONECT   29   28   50   51   52                                       
CONECT   30   28   53   54   55                                       
CONECT   31   28   56   57   58                                       
CONECT   32    1                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
