COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.213  -0.654  -0.056  1.00  0.00           N  
HETATM    2  C   UNL     1      -7.032   0.252   3.182  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.635   1.165  -0.361  1.00  0.00           C  
HETATM    4  N   UNL     1       2.733   1.420  -0.182  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.677  -0.023  -0.251  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.729  -0.088   1.982  1.00  0.00           O  
HETATM    7  C   UNL     1      -7.669  -0.254  -0.396  1.00  0.00           C  
HETATM    8  O   UNL     1       8.700  -1.079   0.172  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.745   0.517   0.819  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.051   0.058   0.812  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.057   0.665  -0.371  1.00  0.00           C  
HETATM   12  O   UNL     1       7.924   1.553  -0.034  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.670   0.355  -1.570  1.00  0.00           C  
HETATM   14  O   UNL     1       1.521   1.361  -0.215  1.00  0.00           O  
HETATM   15  C   UNL     1      -6.975  -0.104  -1.585  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.499  -1.602  -0.076  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.274  -0.411  -0.150  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.296   0.464  -0.241  1.00  0.00           N  
HETATM   19  O   UNL     1      -8.950  -0.711  -0.408  1.00  0.00           O  
HETATM   20  C   UNL     1      -9.518  -1.016  -1.684  1.00  0.00           C  
HETATM   21  C   UNL     1       1.125   0.081  -0.140  1.00  0.00           C  
HETATM   22  C   UNL     1       3.242   0.218  -0.084  1.00  0.00           C  
HETATM   23  C   UNL     1       4.685  -0.122  -0.017  1.00  0.00           C  
HETATM   24  C   UNL     1       5.643   0.889  -0.057  1.00  0.00           C  
HETATM   25  C   UNL     1       6.987   0.568   0.006  1.00  0.00           C  
HETATM   26  C   UNL     1       7.449   2.896  -0.141  1.00  0.00           C  
HETATM   27  C   UNL     1       7.379  -0.764   0.110  1.00  0.00           C  
HETATM   28  C   UNL     1       9.032  -2.465   0.278  1.00  0.00           C  
HETATM   29  C   UNL     1       6.425  -1.770   0.150  1.00  0.00           C  
HETATM   30  C   UNL     1       5.083  -1.453   0.093  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.146  -0.375   3.277  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.734   1.299   3.145  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.686   0.090   4.039  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.490   1.829   0.491  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.435   1.709  -1.284  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.878  -0.567   0.672  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.823  -0.687  -1.103  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.263   0.760   1.755  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.130   0.472  -2.498  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.452  -0.345  -2.523  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.116   1.415  -0.300  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.926  -1.793  -2.168  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.541  -1.369  -1.551  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.521  -0.120  -2.304  1.00  0.00           H  
HETATM   45  H   UNL     1       5.337   1.921  -0.138  1.00  0.00           H  
HETATM   46  H   UNL     1       8.297   3.580  -0.163  1.00  0.00           H  
HETATM   47  H   UNL     1       6.871   3.005  -1.059  1.00  0.00           H  
HETATM   48  H   UNL     1       6.817   3.128   0.716  1.00  0.00           H  
HETATM   49  H   UNL     1      10.116  -2.577   0.319  1.00  0.00           H  
HETATM   50  H   UNL     1       8.590  -2.876   1.186  1.00  0.00           H  
HETATM   51  H   UNL     1       8.644  -2.999  -0.589  1.00  0.00           H  
HETATM   52  H   UNL     1       6.732  -2.802   0.231  1.00  0.00           H  
HETATM   53  H   UNL     1       4.342  -2.238   0.124  1.00  0.00           H  
CONECT    1   21   21   22                                            
CONECT    2    6   31   32   33                                       
CONECT    3   11    5   34   35                                       
CONECT    4   14   22   22                                            
CONECT    5    3   18   36   37                                       
CONECT    6    2   10                                                 
CONECT    7   10   19   15   15                                       
CONECT    8   28   27                                                 
CONECT    9   10   10   11   38                                       
CONECT   10    6    9    9    7                                       
CONECT   11    9    3   13   13                                       
CONECT   12   25   26                                                 
CONECT   13   11   11   15   39                                       
CONECT   14    4   21                                                 
CONECT   15    7    7   13   40                                       
CONECT   16   17   17                                                 
CONECT   17   16   16   21   18                                       
CONECT   18   17    5   41                                            
CONECT   19    7   20                                                 
CONECT   20   19   42   43   44                                       
CONECT   21   14   17    1    1                                       
CONECT   22    4    4   23    1                                       
CONECT   23   30   22   24   24                                       
CONECT   24   23   23   25   45                                       
CONECT   25   27   27   24   12                                       
CONECT   26   12   46   47   48                                       
CONECT   27   29    8   25   25                                       
CONECT   28    8   49   50   51                                       
CONECT   29   30   30   27   52                                       
CONECT   30   29   29   23   53                                       
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   24                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
