COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.343   1.303  -1.304  1.00  0.00           O  
HETATM    2  O   UNL     1       2.116  -0.728  -1.472  1.00  0.00           O  
HETATM    3  O   UNL     1       2.727  -2.886   0.003  1.00  0.00           O  
HETATM    4  O   UNL     1      -1.664  -1.895   0.587  1.00  0.00           O  
HETATM    5  N   UNL     1      -2.373   0.819   0.259  1.00  0.00           N1+
HETATM    6  C   UNL     1       1.758   2.531   1.018  1.00  0.00           C  
HETATM    7  C   UNL     1       2.924   2.425   0.277  1.00  0.00           C  
HETATM    8  C   UNL     1       3.178   1.378  -0.607  1.00  0.00           C  
HETATM    9  C   UNL     1       2.179   0.408  -0.745  1.00  0.00           C  
HETATM   10  C   UNL     1       1.048  -1.569  -0.938  1.00  0.00           C  
HETATM   11  C   UNL     1       1.639  -2.390   0.171  1.00  0.00           C  
HETATM   12  C   UNL     1       0.940  -2.623   1.476  1.00  0.00           C  
HETATM   13  C   UNL     1       0.256  -1.337   1.944  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.430   0.404   1.304  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.509   1.556   1.671  1.00  0.00           C  
HETATM   16  C   UNL     1       0.758   1.585   0.880  1.00  0.00           C  
HETATM   17  C   UNL     1       1.001   0.587  -0.035  1.00  0.00           C  
HETATM   18  C   UNL     1       0.063  -0.533  -0.413  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.706  -0.868   0.854  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.898  -0.057  -1.500  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.659   1.166  -0.975  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.306  -0.282  -0.016  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.387   0.196  -0.951  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.613  -0.443  -2.072  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.130   1.988   0.725  1.00  0.00           C  
HETATM   26  H   UNL     1       5.043   0.814  -0.848  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.200  -2.142   1.353  1.00  0.00           H  
HETATM   28  H   UNL     1       1.630   3.354   1.705  1.00  0.00           H  
HETATM   29  H   UNL     1       3.675   3.194   0.390  1.00  0.00           H  
HETATM   30  H   UNL     1       0.610  -2.201  -1.711  1.00  0.00           H  
HETATM   31  H   UNL     1       0.191  -3.405   1.351  1.00  0.00           H  
HETATM   32  H   UNL     1       1.667  -2.938   2.224  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.298  -1.531   2.863  1.00  0.00           H  
HETATM   34  H   UNL     1       1.008  -0.568   2.124  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.010   0.146   2.190  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.042   2.493   1.510  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.258   1.478   2.729  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.335   0.218  -2.392  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.604  -0.853  -1.739  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.376   1.497  -1.727  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.954   1.971  -0.770  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.766  -1.110  -0.477  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.757  -0.618   0.918  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.975   1.065  -0.697  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.024  -1.313  -2.326  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.387  -0.101  -2.743  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.458   2.840   0.823  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.914   2.224   0.006  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.580   1.767   1.694  1.00  0.00           H  
CONECT    1    8   26                                                 
CONECT    2    9   10                                                 
CONECT    3   11   11                                                 
CONECT    4   19   27                                                 
CONECT    5   14   21   22   25                                       
CONECT    6    7    7   16   28                                       
CONECT    7    6    6    8   29                                       
CONECT    8    1    7    9    9                                       
CONECT    9    2    8    8   17                                       
CONECT   10    2   11   18   30                                       
CONECT   11    3    3   10   12                                       
CONECT   12   11   13   31   32                                       
CONECT   13   12   19   33   34                                       
CONECT   14    5   15   19   35                                       
CONECT   15   14   16   36   37                                       
CONECT   16    6   15   17   17                                       
CONECT   17    9   16   16   18                                       
CONECT   18   10   17   19   20                                       
CONECT   19    4   13   14   18                                       
CONECT   20   18   21   38   39                                       
CONECT   21    5   20   40   41                                       
CONECT   22    5   23   42   43                                       
CONECT   23   22   24   24   44                                       
CONECT   24   23   23   45   46                                       
CONECT   25    5   47   48   49                                       
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30   10                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
