COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.287  -1.806  -0.601  1.00  0.00           C  
HETATM    2  C   UNL     1       1.067  -1.806  -0.217  1.00  0.00           C  
HETATM    3  C   UNL     1       1.793  -3.004  -0.316  1.00  0.00           C  
HETATM    4  N   UNL     1       1.166  -4.086  -0.769  1.00  0.00           N  
HETATM    5  N   UNL     1      -0.826  -2.942  -1.043  1.00  0.00           N  
HETATM    6  C   UNL     1      -7.568   0.739   1.316  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.499   1.064   0.593  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.169   0.574   0.985  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.057  -0.206   1.912  1.00  0.00           O  
HETATM   10  N   UNL     1      -4.074   0.989   0.319  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.752   0.427   0.626  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.181   2.009  -0.734  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.534   1.467  -2.013  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.100   1.027  -1.707  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.124  -0.094  -0.670  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.754  -0.540  -0.405  1.00  0.00           N  
HETATM   17  N   UNL     1       0.277   0.266   0.089  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.107  -4.041  -1.118  1.00  0.00           C  
HETATM   19  N   UNL     1       3.125  -3.057   0.047  1.00  0.00           N  
HETATM   20  C   UNL     1       1.375  -0.443   0.217  1.00  0.00           C  
HETATM   21  C   UNL     1       2.682   0.047   0.708  1.00  0.00           C  
HETATM   22  C   UNL     1       3.296   1.171   0.107  1.00  0.00           C  
HETATM   23  C   UNL     1       2.690   1.848  -0.961  1.00  0.00           C  
HETATM   24  C   UNL     1       3.310   2.927  -1.516  1.00  0.00           C  
HETATM   25  C   UNL     1       4.540   3.370  -1.037  1.00  0.00           C  
HETATM   26  C   UNL     1       5.158   2.738  -0.002  1.00  0.00           C  
HETATM   27  C   UNL     1       4.548   1.621   0.595  1.00  0.00           C  
HETATM   28  C   UNL     1       5.157   0.944   1.666  1.00  0.00           C  
HETATM   29  C   UNL     1       4.545  -0.136   2.227  1.00  0.00           C  
HETATM   30  C   UNL     1       3.315  -0.587   1.764  1.00  0.00           C  
HETATM   31  H   UNL     1      -8.544   1.099   1.028  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.458   0.116   2.191  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.609   1.688  -0.282  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.116   1.202   1.055  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.860  -0.394   1.335  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.231   2.231  -0.922  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.664   2.915  -0.419  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.107   0.614  -2.377  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.521   2.248  -2.773  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.630   0.663  -2.621  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.535   1.874  -1.319  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.713  -0.929  -1.050  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.577  -4.943  -1.481  1.00  0.00           H  
HETATM   44  H   UNL     1       3.599  -2.242   0.270  1.00  0.00           H  
HETATM   45  H   UNL     1       3.585  -3.911   0.079  1.00  0.00           H  
HETATM   46  H   UNL     1       1.736   1.514  -1.343  1.00  0.00           H  
HETATM   47  H   UNL     1       2.840   3.445  -2.339  1.00  0.00           H  
HETATM   48  H   UNL     1       5.011   4.228  -1.493  1.00  0.00           H  
HETATM   49  H   UNL     1       6.113   3.092   0.359  1.00  0.00           H  
HETATM   50  H   UNL     1       6.111   1.281   2.043  1.00  0.00           H  
HETATM   51  H   UNL     1       5.023  -0.648   3.049  1.00  0.00           H  
HETATM   52  H   UNL     1       2.851  -1.446   2.227  1.00  0.00           H  
CONECT    1    2   16    5    5                                       
CONECT    2   20    3    3    1                                       
CONECT    3   19    2    2    4                                       
CONECT    4    3   18   18                                            
CONECT    5    1    1   18                                            
CONECT    6    7    7   31   32                                       
CONECT    7    8    6    6   33                                       
CONECT    8   10    7    9    9                                       
CONECT    9    8    8                                                 
CONECT   10   11   12    8                                            
CONECT   11   15   10   34   35                                       
CONECT   12   10   13   36   37                                       
CONECT   13   14   12   38   39                                       
CONECT   14   15   13   40   41                                       
CONECT   15   16   11   14   42                                       
CONECT   16   17    1   15                                            
CONECT   17   20   20   16                                            
CONECT   18    4    4    5   43                                       
CONECT   19    3   44   45                                            
CONECT   20   21   17   17    2                                       
CONECT   21   22   22   30   20                                       
CONECT   22   27   23   21   21                                       
CONECT   23   24   24   22   46                                       
CONECT   24   25   23   23   47                                       
CONECT   25   26   26   24   48                                       
CONECT   26   25   25   27   49                                       
CONECT   27   26   28   28   22                                       
CONECT   28   27   27   29   50                                       
CONECT   29   28   30   30   51                                       
CONECT   30   29   29   21   52                                       
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
