COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.539  -2.138   0.029  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.605  -3.145  -0.146  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.272  -2.794  -0.295  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.110   0.278   0.227  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.469  -0.011   0.377  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.493  -1.062  -0.421  1.00  0.00           C  
HETATM    7  C   UNL     1       0.213   0.598  -0.430  1.00  0.00           C  
HETATM    8  C   UNL     1       0.600   1.771  -1.071  1.00  0.00           C  
HETATM    9  C   UNL     1       2.497   0.141   0.138  1.00  0.00           C  
HETATM   10  C   UNL     1       1.160  -0.214   0.176  1.00  0.00           C  
HETATM   11  C   UNL     1       6.861   1.172   0.090  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.645  -1.918  -0.577  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.915  -1.447  -0.263  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.115  -0.808   0.045  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.713   1.618   0.247  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.672   2.597   0.413  1.00  0.00           C  
HETATM   17  N   UNL     1      -7.945   2.282   0.551  1.00  0.00           N  
HETATM   18  C   UNL     1      -8.361   1.030   0.537  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.834  -0.507  -0.093  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.140   0.239  -0.392  1.00  0.00           N  
HETATM   21  O   UNL     1       3.629  -0.424   0.621  1.00  0.00           O  
HETATM   22  C   UNL     1       4.666   0.364   0.286  1.00  0.00           C  
HETATM   23  N   UNL     1       4.244   1.403  -0.387  1.00  0.00           N  
HETATM   24  C   UNL     1       2.890   1.320  -0.513  1.00  0.00           C  
HETATM   25  C   UNL     1       1.929   2.133  -1.115  1.00  0.00           C  
HETATM   26  N   UNL     1       5.982   0.113   0.607  1.00  0.00           N  
HETATM   27  C   UNL     1       6.404  -1.204   0.107  1.00  0.00           C  
HETATM   28  C   UNL     1       7.850  -1.467   0.536  1.00  0.00           C  
HETATM   29  O   UNL     1       8.685  -0.411   0.051  1.00  0.00           O  
HETATM   30  C   UNL     1       8.303   0.886   0.518  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.586  -2.379   0.147  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.909  -4.181  -0.167  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.519  -3.556  -0.433  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.816  -1.034   0.366  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.144   2.400  -1.537  1.00  0.00           H  
HETATM   36  H   UNL     1       0.854  -1.121   0.677  1.00  0.00           H  
HETATM   37  H   UNL     1       6.803   1.195  -0.998  1.00  0.00           H  
HETATM   38  H   UNL     1       6.546   2.135   0.491  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.673   1.883   0.136  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.375   3.635   0.431  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.413   0.816   0.653  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.823   0.926  -0.344  1.00  0.00           H  
HETATM   43  H   UNL     1       2.226   3.042  -1.617  1.00  0.00           H  
HETATM   44  H   UNL     1       5.756  -1.975   0.523  1.00  0.00           H  
HETATM   45  H   UNL     1       6.338  -1.219  -0.980  1.00  0.00           H  
HETATM   46  H   UNL     1       7.906  -1.505   1.624  1.00  0.00           H  
HETATM   47  H   UNL     1       8.186  -2.417   0.120  1.00  0.00           H  
HETATM   48  H   UNL     1       8.967   1.637   0.089  1.00  0.00           H  
HETATM   49  H   UNL     1       8.373   0.917   1.606  1.00  0.00           H  
CONECT    1   14   14    2   31                                       
CONECT    2    3    3    1   32                                       
CONECT    3   13    2    2   33                                       
CONECT    4    5   14   15   15                                       
CONECT    5   18   18    4   34                                       
CONECT    6   20   12   12   13                                       
CONECT    7    8    8   10   20                                       
CONECT    8   25    7    7   35                                       
CONECT    9   24   21   10   10                                       
CONECT   10    9    9    7   36                                       
CONECT   11   26   30   37   38                                       
CONECT   12    6    6                                                 
CONECT   13    6   19   19    3                                       
CONECT   14   19    4    1    1                                       
CONECT   15    4    4   16   39                                       
CONECT   16   17   17   15   40                                       
CONECT   17   18   16   16                                            
CONECT   18    5    5   17   41                                       
CONECT   19   13   13   14                                            
CONECT   20    7    6   42                                            
CONECT   21   22    9                                                 
CONECT   22   26   23   23   21                                       
CONECT   23   22   22   24                                            
CONECT   24   23   25   25    9                                       
CONECT   25   24   24    8   43                                       
CONECT   26   27   11   22                                            
CONECT   27   28   26   44   45                                       
CONECT   28   27   29   46   47                                       
CONECT   29   28   30                                                 
CONECT   30   29   11   48   49                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   25                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   30                                                      
CONECT   49   30                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
