COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.137  -0.766   0.437  1.00  0.00           N  
HETATM    2  N   UNL     1       5.137  -0.304  -0.236  1.00  0.00           N  
HETATM    3  C   UNL     1       1.908  -1.838   0.569  1.00  0.00           C  
HETATM    4  C   UNL     1       5.948  -1.142   0.652  1.00  0.00           C  
HETATM    5  C   UNL     1       5.456  -2.566   0.618  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.571   1.332   0.083  1.00  0.00           C  
HETATM    7  C   UNL     1       5.530   1.108  -0.131  1.00  0.00           C  
HETATM    8  C   UNL     1       7.491  -1.464  -1.286  1.00  0.00           C  
HETATM    9  C   UNL     1       6.743   2.893  -1.227  1.00  0.00           C  
HETATM   10  C   UNL     1       4.474   2.013  -0.799  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.722   2.181   0.742  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.163   0.151  -0.351  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.775   0.809   0.424  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.795  -0.520   0.120  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.995  -0.154  -1.003  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.637  -2.201   0.245  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.462   1.691   0.900  1.00  0.00           O  
HETATM   18  N   UNL     1      -5.346  -0.337   0.003  1.00  0.00           N  
HETATM   19  C   UNL     1      -7.119  -2.015   0.184  1.00  0.00           C  
HETATM   20  N   UNL     1      -9.253  -1.599  -0.945  1.00  0.00           N  
HETATM   21  C   UNL     1     -10.694  -1.879  -0.990  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.488   0.093  -1.100  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.316   0.992   0.306  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.357   2.349   0.630  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.776   3.503   1.054  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.640   4.500   1.604  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.525  -0.021  -0.241  1.00  0.00           C  
HETATM   28  N   UNL     1       0.808   1.500  -0.025  1.00  0.00           N  
HETATM   29  C   UNL     1       1.652   0.407   0.101  1.00  0.00           C  
HETATM   30  N   UNL     1       2.949   0.567  -0.119  1.00  0.00           N  
HETATM   31  C   UNL     1       3.783  -0.460  -0.006  1.00  0.00           C  
HETATM   32  C   UNL     1       5.246   3.148  -1.496  1.00  0.00           C  
HETATM   33  C   UNL     1       6.824   1.373  -0.940  1.00  0.00           C  
HETATM   34  C   UNL     1       7.408  -1.099   0.197  1.00  0.00           C  
HETATM   35  O   UNL     1       6.240  -3.487   0.711  1.00  0.00           O  
HETATM   36  N   UNL     1       4.132  -2.808   0.482  1.00  0.00           N  
HETATM   37  C   UNL     1       3.615  -4.178   0.474  1.00  0.00           C  
HETATM   38  C   UNL     1       3.267  -1.712   0.350  1.00  0.00           C  
HETATM   39  H   UNL     1       1.482  -2.792   0.844  1.00  0.00           H  
HETATM   40  H   UNL     1       5.878  -0.761   1.671  1.00  0.00           H  
HETATM   41  H   UNL     1       5.666   1.388   0.913  1.00  0.00           H  
HETATM   42  H   UNL     1       7.245  -2.518  -1.415  1.00  0.00           H  
HETATM   43  H   UNL     1       6.785  -0.855  -1.850  1.00  0.00           H  
HETATM   44  H   UNL     1       8.502  -1.280  -1.650  1.00  0.00           H  
HETATM   45  H   UNL     1       7.337   3.148  -2.104  1.00  0.00           H  
HETATM   46  H   UNL     1       7.077   3.463  -0.359  1.00  0.00           H  
HETATM   47  H   UNL     1       3.905   1.443  -1.534  1.00  0.00           H  
HETATM   48  H   UNL     1       3.804   2.425  -0.045  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.331   2.966   1.165  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.552  -0.633  -0.774  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.152  -0.030   1.026  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.490   0.268  -1.877  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.383   0.320  -0.102  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.871  -3.265   0.276  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.026  -1.717   1.140  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.798  -1.041  -0.377  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.727  -2.511  -0.703  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.663  -2.448   1.075  1.00  0.00           H  
HETATM   59  H   UNL     1     -11.111  -1.486  -1.917  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.857  -2.956  -0.945  1.00  0.00           H  
HETATM   61  H   UNL     1     -11.183  -1.402  -0.140  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.296   1.165  -1.128  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.101  -0.370  -2.009  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.374   4.799   0.855  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.155   4.095   2.475  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.051   5.368   1.901  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.982  -0.939  -0.579  1.00  0.00           H  
HETATM   68  H   UNL     1       1.179   2.382  -0.187  1.00  0.00           H  
HETATM   69  H   UNL     1       4.950   4.111  -1.079  1.00  0.00           H  
HETATM   70  H   UNL     1       5.051   3.128  -2.568  1.00  0.00           H  
HETATM   71  H   UNL     1       7.706   1.138  -0.345  1.00  0.00           H  
HETATM   72  H   UNL     1       6.822   0.804  -1.870  1.00  0.00           H  
HETATM   73  H   UNL     1       7.806  -0.095   0.347  1.00  0.00           H  
HETATM   74  H   UNL     1       7.991  -1.812   0.780  1.00  0.00           H  
HETATM   75  H   UNL     1       4.443  -4.879   0.589  1.00  0.00           H  
HETATM   76  H   UNL     1       2.914  -4.307   1.298  1.00  0.00           H  
HETATM   77  H   UNL     1       3.106  -4.369  -0.471  1.00  0.00           H  
CONECT    1    3    3   29                                            
CONECT    2    4    7   31                                            
CONECT    3    1    1   38   39                                       
CONECT    4    2    5   34   40                                       
CONECT    5    4   35   35   36                                       
CONECT    6   12   12   24   28                                       
CONECT    7    2   10   33   41                                       
CONECT    8   34   42   43   44                                       
CONECT    9   32   33   45   46                                       
CONECT   10    7   32   47   48                                       
CONECT   11   23   24   24   49                                       
CONECT   12    6    6   27   50                                       
CONECT   13   17   17   18   23                                       
CONECT   14   18   19   22   51                                       
CONECT   15   20   22   52   53                                       
CONECT   16   19   20   54   55                                       
CONECT   17   13   13                                                 
CONECT   18   13   14   56                                            
CONECT   19   14   16   57   58                                       
CONECT   20   15   16   21                                            
CONECT   21   20   59   60   61                                       
CONECT   22   14   15   62   63                                       
CONECT   23   11   13   27   27                                       
CONECT   24    6   11   11   25                                       
CONECT   25   24   26                                                 
CONECT   26   25   64   65   66                                       
CONECT   27   12   23   23   67                                       
CONECT   28    6   29   68                                            
CONECT   29    1   28   30   30                                       
CONECT   30   29   29   31                                            
CONECT   31    2   30   38   38                                       
CONECT   32    9   10   69   70                                       
CONECT   33    7    9   71   72                                       
CONECT   34    4    8   73   74                                       
CONECT   35    5    5                                                 
CONECT   36    5   37   38                                            
CONECT   37   36   75   76   77                                       
CONECT   38    3   31   31   36                                       
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   26                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   33                                                      
CONECT   73   34                                                      
CONECT   74   34                                                      
CONECT   75   37                                                      
CONECT   76   37                                                      
CONECT   77   37                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
