COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.826   1.565  -0.338  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.641   5.121  -0.464  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.338  -2.316   1.346  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.751   3.644  -0.187  1.00  0.00           C  
HETATM    5  C   UNL     1       0.799   0.422  -0.260  1.00  0.00           C  
HETATM    6  C   UNL     1       1.677  -0.668  -0.075  1.00  0.00           C  
HETATM    7  C   UNL     1       1.236  -1.949  -0.349  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.076  -2.133  -0.805  1.00  0.00           C  
HETATM    9  C   UNL     1       4.117  -1.333   0.674  1.00  0.00           C  
HETATM   10  C   UNL     1       4.990  -0.097   0.419  1.00  0.00           C  
HETATM   11  C   UNL     1       5.444   0.042  -1.033  1.00  0.00           C  
HETATM   12  C   UNL     1       6.190   1.371  -1.196  1.00  0.00           C  
HETATM   13  C   UNL     1       7.328   1.431  -0.173  1.00  0.00           C  
HETATM   14  C   UNL     1       6.751   1.301   1.238  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.875   3.140   0.451  1.00  0.00           C  
HETATM   16  C   UNL     1       3.748   0.740   0.754  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.935   1.775   0.686  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.859   0.991   0.265  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.871  -0.476   0.491  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.507  -2.627   0.341  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.042  -4.006  -0.049  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.167  -1.462  -0.256  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.255  -1.255  -1.438  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.778   2.830  -0.552  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.531  -1.125   1.418  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.881  -1.065  -0.967  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.419   0.224  -0.680  1.00  0.00           N  
HETATM   28  N   UNL     1       2.968  -0.455   0.376  1.00  0.00           N  
HETATM   29  O   UNL     1      -0.488  -3.256  -1.053  1.00  0.00           O  
HETATM   30  O   UNL     1       6.053   0.058   1.354  1.00  0.00           O  
HETATM   31  H   UNL     1      -4.070   5.340  -1.441  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.181   5.675   0.303  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.591   5.415  -0.453  1.00  0.00           H  
HETATM   34  H   UNL     1       1.137   1.426  -0.048  1.00  0.00           H  
HETATM   35  H   UNL     1       1.893  -2.795  -0.213  1.00  0.00           H  
HETATM   36  H   UNL     1       4.261  -2.131  -0.055  1.00  0.00           H  
HETATM   37  H   UNL     1       4.147  -1.688   1.704  1.00  0.00           H  
HETATM   38  H   UNL     1       6.109  -0.784  -1.288  1.00  0.00           H  
HETATM   39  H   UNL     1       4.574   0.028  -1.690  1.00  0.00           H  
HETATM   40  H   UNL     1       6.602   1.437  -2.204  1.00  0.00           H  
HETATM   41  H   UNL     1       5.502   2.199  -1.028  1.00  0.00           H  
HETATM   42  H   UNL     1       8.026   0.615  -0.357  1.00  0.00           H  
HETATM   43  H   UNL     1       7.851   2.384  -0.266  1.00  0.00           H  
HETATM   44  H   UNL     1       7.561   1.333   1.967  1.00  0.00           H  
HETATM   45  H   UNL     1       6.061   2.124   1.426  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.680   3.793   0.756  1.00  0.00           H  
HETATM   47  H   UNL     1       3.667   1.003   1.809  1.00  0.00           H  
HETATM   48  H   UNL     1       3.599   1.592   0.091  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.788   1.331   1.180  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.488  -4.742   0.621  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.346  -4.216  -1.074  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.956  -4.058   0.026  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.299  -2.129  -2.088  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.575  -0.373  -1.993  1.00  0.00           H  
CONECT    1   18   18   24                                            
CONECT    2    4   31   32   33                                       
CONECT    3   25   20                                                 
CONECT    4   15    2   24   24                                       
CONECT    5   27   27    6   34                                       
CONECT    6    5    7    7   28                                       
CONECT    7    8    6    6   35                                       
CONECT    8   26   29   29    7                                       
CONECT    9   28   10   36   37                                       
CONECT   10   16    9   30   11                                       
CONECT   11   10   12   38   39                                       
CONECT   12   11   13   40   41                                       
CONECT   13   14   12   42   43                                       
CONECT   14   30   13   44   45                                       
CONECT   15   17   17    4   46                                       
CONECT   16   28   10   47   48                                       
CONECT   17   15   15   18   49                                       
CONECT   18   17   19    1    1                                       
CONECT   19   25   25   18   22                                       
CONECT   20    3   22   22   21                                       
CONECT   21   20   50   51   52                                       
CONECT   22   19   20   20   23                                       
CONECT   23   22   26   53   54                                       
CONECT   24    4    4    1                                            
CONECT   25    3   19   19                                            
CONECT   26   23   27    8                                            
CONECT   27   26    5    5                                            
CONECT   28    6   16    9                                            
CONECT   29    8    8                                                 
CONECT   30   10   14                                                 
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
