COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.768   1.196   2.380  1.00  0.00           C  
HETATM    2  C   UNL     1       3.645   1.995   0.067  1.00  0.00           C  
HETATM    3  C   UNL     1       5.793   1.719  -0.957  1.00  0.00           C  
HETATM    4  C   UNL     1       4.518  -0.538  -0.894  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.097   1.583  -1.300  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.512   2.138  -0.948  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.218   0.465  -1.133  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.840  -1.262  -1.338  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.798  -2.914   0.105  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.056  -1.779   0.802  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.010  -0.922   1.201  1.00  0.00           C  
HETATM   12  C   UNL     1       1.370  -1.276   0.817  1.00  0.00           C  
HETATM   13  O   UNL     1       1.614  -2.283  -0.025  1.00  0.00           O  
HETATM   14  C   UNL     1       2.861  -2.431  -0.730  1.00  0.00           C  
HETATM   15  C   UNL     1       3.970  -2.891   0.208  1.00  0.00           C  
HETATM   16  O   UNL     1       2.299  -0.658   1.299  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.314   0.235   1.923  1.00  0.00           C  
HETATM   18  C   UNL     1       1.511   1.678   1.171  1.00  0.00           C  
HETATM   19  C   UNL     1       2.915   2.056   1.184  1.00  0.00           C  
HETATM   20  C   UNL     1       5.057   2.359  -0.032  1.00  0.00           C  
HETATM   21  C   UNL     1       5.165   0.585  -1.730  1.00  0.00           C  
HETATM   22  O   UNL     1       5.738  -0.715  -1.616  1.00  0.00           O  
HETATM   23  C   UNL     1       3.228  -1.135  -1.444  1.00  0.00           C  
HETATM   24  N   UNL     1       0.861   1.775   0.050  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.511   1.429  -0.006  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.551   1.189  -1.243  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.844   1.778  -0.890  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.528   0.108  -1.077  1.00  0.00           O  
HETATM   29  C   UNL     1      -4.252  -0.484  -1.434  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.921  -0.121  -1.486  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.620   0.536   2.238  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.645  -0.303   1.838  1.00  0.00           C  
HETATM   33  O   UNL     1      -3.930   0.006   2.150  1.00  0.00           O  
HETATM   34  C   UNL     1      -2.370  -1.455   1.124  1.00  0.00           C  
HETATM   35  H   UNL     1       0.313   2.043   2.895  1.00  0.00           H  
HETATM   36  H   UNL     1       1.453   0.684   3.057  1.00  0.00           H  
HETATM   37  H   UNL     1       3.171   1.657  -0.862  1.00  0.00           H  
HETATM   38  H   UNL     1       6.824   1.966  -1.126  1.00  0.00           H  
HETATM   39  H   UNL     1       4.568  -0.382   0.190  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.015   2.624  -1.614  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.576   0.946  -2.013  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.221   3.161  -0.759  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.332  -1.895  -0.610  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.917  -1.411  -1.261  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.508  -1.525  -2.342  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.645  -3.691   0.661  1.00  0.00           H  
HETATM   47  H   UNL     1       2.723  -3.212  -1.498  1.00  0.00           H  
HETATM   48  H   UNL     1       3.700  -3.853   0.645  1.00  0.00           H  
HETATM   49  H   UNL     1       4.900  -2.994  -0.351  1.00  0.00           H  
HETATM   50  H   UNL     1       4.103  -2.156   1.002  1.00  0.00           H  
HETATM   51  H   UNL     1       3.354   2.386   2.122  1.00  0.00           H  
HETATM   52  H   UNL     1       5.493   3.103   0.603  1.00  0.00           H  
HETATM   53  H   UNL     1       4.697   0.848  -2.671  1.00  0.00           H  
HETATM   54  H   UNL     1       2.416  -0.411  -1.326  1.00  0.00           H  
HETATM   55  H   UNL     1       3.352  -1.336  -2.513  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.595   2.519  -0.654  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.541  -1.508  -1.625  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.168  -0.859  -1.721  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.842   1.433   2.799  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.377   0.546   1.484  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.176  -2.104   0.813  1.00  0.00           H  
CONECT    1   17   18   35   36                                       
CONECT    2   20   19   19   37                                       
CONECT    3   20   20   38   21                                       
CONECT    4   23   22   21   39                                       
CONECT    5   25   26   40   41                                       
CONECT    6   26   26   27   42                                       
CONECT    7   29   28   27   27                                       
CONECT    8   28   43   44   45                                       
CONECT    9   10   46                                                 
CONECT   10    9   34   34   11                                       
CONECT   11   10   12   17   17                                       
CONECT   12   16   16   11   13                                       
CONECT   13   12   14                                                 
CONECT   14   23   13   15   47                                       
CONECT   15   14   48   49   50                                       
CONECT   16   12   12                                                 
CONECT   17   11   11   31    1                                       
CONECT   18    1   19   24   24                                       
CONECT   19    2    2   18   51                                       
CONECT   20    2    3    3   52                                       
CONECT   21   22    4   53    3                                       
CONECT   22    4   21                                                 
CONECT   23   14    4   54   55                                       
CONECT   24   18   18   25                                            
CONECT   25   24    5                                                 
CONECT   26   30    5    6    6                                       
CONECT   27    7    7    6   56                                       
CONECT   28    8    7                                                 
CONECT   29   30   30    7   57                                       
CONECT   30   29   29   26   58                                       
CONECT   31   32   32   17   59                                       
CONECT   32   34   33   31   31                                       
CONECT   33   32   60                                                 
CONECT   34   10   10   32   61                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
