COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.005   1.917  -0.467  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.336   1.181  -0.206  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.939  -0.208   0.243  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.672  -1.183   0.901  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.091  -2.396   1.214  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.775  -2.640   0.870  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.043  -1.670   0.214  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.623  -0.453  -0.101  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.045   0.756  -0.805  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.701   1.045  -0.299  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.631   0.427  -0.839  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.782  -0.368  -1.745  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.270   0.719  -0.327  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.050   0.157  -0.785  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.953   1.552   0.634  1.00  0.00           N  
HETATM   16  O   UNL     1       0.239   1.579   0.830  1.00  0.00           O  
HETATM   17  C   UNL     1       0.898   0.748   0.002  1.00  0.00           C  
HETATM   18  C   UNL     1       2.358   0.521  -0.046  1.00  0.00           C  
HETATM   19  C   UNL     1       3.199   1.207   0.831  1.00  0.00           C  
HETATM   20  C   UNL     1       4.565   0.991   0.783  1.00  0.00           C  
HETATM   21  O   UNL     1       5.389   1.654   1.632  1.00  0.00           O  
HETATM   22  C   UNL     1       2.893  -0.387  -0.965  1.00  0.00           C  
HETATM   23  C   UNL     1       4.240  -0.607  -1.011  1.00  0.00           C  
HETATM   24  C   UNL     1       5.094   0.083  -0.147  1.00  0.00           C  
HETATM   25  C   UNL     1       6.548  -0.157  -0.199  1.00  0.00           C  
HETATM   26  O   UNL     1       7.313   0.774  -0.366  1.00  0.00           O  
HETATM   27  N   UNL     1       7.030  -1.408  -0.062  1.00  0.00           N  
HETATM   28  C   UNL     1       8.477  -1.636  -0.024  1.00  0.00           C  
HETATM   29  C   UNL     1       6.107  -2.540   0.050  1.00  0.00           C  
HETATM   30  H   UNL     1      -6.099   2.600  -1.311  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.675   2.449   0.425  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.900   1.686   0.578  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.926   1.130  -1.122  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.700  -0.992   1.170  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.666  -3.153   1.727  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.320  -3.589   1.114  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.014  -1.862  -0.054  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.018   0.589  -1.882  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.580   1.680   0.424  1.00  0.00           H  
HETATM   40  H   UNL     1       0.096  -0.569  -1.572  1.00  0.00           H  
HETATM   41  H   UNL     1       2.785   1.904   1.544  1.00  0.00           H  
HETATM   42  H   UNL     1       5.546   1.194   2.468  1.00  0.00           H  
HETATM   43  H   UNL     1       2.238  -0.915  -1.642  1.00  0.00           H  
HETATM   44  H   UNL     1       4.647  -1.305  -1.727  1.00  0.00           H  
HETATM   45  H   UNL     1       8.826  -1.584   1.007  1.00  0.00           H  
HETATM   46  H   UNL     1       8.700  -2.621  -0.434  1.00  0.00           H  
HETATM   47  H   UNL     1       8.980  -0.873  -0.617  1.00  0.00           H  
HETATM   48  H   UNL     1       5.083  -2.170   0.103  1.00  0.00           H  
HETATM   49  H   UNL     1       6.216  -3.185  -0.822  1.00  0.00           H  
HETATM   50  H   UNL     1       6.336  -3.107   0.952  1.00  0.00           H  
CONECT    1    9    2   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    8    8    4    2                                       
CONECT    4    5    5    3   34                                       
CONECT    5    6    4    4   35                                       
CONECT    6    7    7    5   36                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7    9    3    3                                       
CONECT    9   10    8    1   38                                       
CONECT   10   11    9   39                                            
CONECT   11   13   10   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   15   15   14   11                                       
CONECT   14   17   17   13   40                                       
CONECT   15   16   13   13                                            
CONECT   16   17   15                                                 
CONECT   17   18   16   14   14                                       
CONECT   18   22   22   19   17                                       
CONECT   19   20   20   18   41                                       
CONECT   20   24   21   19   19                                       
CONECT   21   20   42                                                 
CONECT   22   23   18   18   43                                       
CONECT   23   24   24   22   44                                       
CONECT   24   25   23   23   20                                       
CONECT   25   26   26   27   24                                       
CONECT   26   25   25                                                 
CONECT   27   29   25   28                                            
CONECT   28   27   45   46   47                                       
CONECT   29   27   48   49   50                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   14                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   28                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
