COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.590  -3.301   0.083  1.00  0.00           C  
HETATM    2  C   UNL     1       6.607   2.072  -0.342  1.00  0.00           C  
HETATM    3  C   UNL     1       5.695   2.386   0.649  1.00  0.00           C  
HETATM    4  C   UNL     1       6.408   0.965  -1.147  1.00  0.00           C  
HETATM    5  C   UNL     1       4.583   1.592   0.843  1.00  0.00           C  
HETATM    6  C   UNL     1       5.299   0.164  -0.962  1.00  0.00           C  
HETATM    7  C   UNL     1       2.981  -1.502  -0.564  1.00  0.00           C  
HETATM    8  C   UNL     1       2.267  -0.076   1.244  1.00  0.00           C  
HETATM    9  C   UNL     1       1.872  -2.299  -0.366  1.00  0.00           C  
HETATM   10  C   UNL     1       1.158  -0.877   1.430  1.00  0.00           C  
HETATM   11  C   UNL     1       4.380   0.473   0.039  1.00  0.00           C  
HETATM   12  C   UNL     1       3.186  -0.385   0.243  1.00  0.00           C  
HETATM   13  C   UNL     1       0.963  -1.988   0.629  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.400  -0.160  -0.430  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.137   1.126   0.816  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.173   2.980  -0.742  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.810   1.212   0.038  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.119   2.033   0.039  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.250  -2.859   0.837  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.401  -2.346  -0.032  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.735  -2.749  -0.653  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.046   2.092  -1.126  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.799  -1.012   0.424  1.00  0.00           N  
HETATM   24  O   UNL     1      -2.611  -0.498  -1.576  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.944   2.773   0.940  1.00  0.00           O  
HETATM   26  H   UNL     1      -2.321  -4.270  -0.337  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.859  -3.423   1.133  1.00  0.00           H  
HETATM   28  H   UNL     1       7.476   2.696  -0.491  1.00  0.00           H  
HETATM   29  H   UNL     1       5.853   3.254   1.272  1.00  0.00           H  
HETATM   30  H   UNL     1       7.121   0.727  -1.922  1.00  0.00           H  
HETATM   31  H   UNL     1       3.871   1.838   1.618  1.00  0.00           H  
HETATM   32  H   UNL     1       5.145  -0.700  -1.591  1.00  0.00           H  
HETATM   33  H   UNL     1       3.691  -1.745  -1.341  1.00  0.00           H  
HETATM   34  H   UNL     1       2.421   0.788   1.873  1.00  0.00           H  
HETATM   35  H   UNL     1       1.715  -3.168  -0.988  1.00  0.00           H  
HETATM   36  H   UNL     1       0.445  -0.639   2.205  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.501   0.099   0.830  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.003   1.495   1.833  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.670   3.376  -1.627  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.824   3.791  -0.103  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.033   1.634   0.675  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.729   1.446  -0.647  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.012  -3.885   0.556  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.544  -2.828   1.886  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.076  -2.294  -1.071  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.491  -2.566  -1.615  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.534  -3.361  -0.592  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.274   1.553  -1.947  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.631  -0.742   1.340  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.525   3.413   0.507  1.00  0.00           H  
CONECT    1   21   20   26   27                                       
CONECT    2    4    4    3   28                                       
CONECT    3    5    5    2   29                                       
CONECT    4    6    2    2   30                                       
CONECT    5   11    3    3   31                                       
CONECT    6   11   11    4   32                                       
CONECT    7    9    9   12   33                                       
CONECT    8   10   12   12   34                                       
CONECT    9   13    7    7   35                                       
CONECT   10   13   13    8   36                                       
CONECT   11   12    6    6    5                                       
CONECT   12    8    8    7   11                                       
CONECT   13   19   10   10    9                                       
CONECT   14   17   24   24   23                                       
CONECT   15   18   17   37   38                                       
CONECT   16   18   22   39   40                                       
CONECT   17   15   22   14   41                                       
CONECT   18   25   16   15   42                                       
CONECT   19   20   13   43   44                                       
CONECT   20   23    1   19   45                                       
CONECT   21    1   46   47                                            
CONECT   22   16   17   48                                            
CONECT   23   14   20   49                                            
CONECT   24   14   14                                                 
CONECT   25   18   50                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
