COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  OXT UNL     1      -2.866  -3.117  -0.030  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.914  -2.170  -0.137  1.00  0.00           C  
HETATM    3  O   UNL     1      -0.750  -2.491  -0.262  1.00  0.00           O  
HETATM    4  CA  UNL     1      -2.288  -0.736  -0.103  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.586  -0.362   0.171  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.945   0.932   0.206  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.101   1.219   0.452  1.00  0.00           O  
HETATM    8  N   UNL     1      -3.060   1.918  -0.022  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.771   1.629  -0.297  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.968   2.519  -0.504  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.354   0.222  -0.336  1.00  0.00           C  
HETATM   12  C   UNL     1       0.076  -0.151  -0.633  1.00  0.00           C  
HETATM   13  C   UNL     1       0.862  -0.244   0.676  1.00  0.00           C  
HETATM   14  C   UNL     1       2.314  -0.510   0.373  1.00  0.00           C  
HETATM   15  C   UNL     1       2.774  -1.810   0.280  1.00  0.00           C  
HETATM   16  C   UNL     1       4.106  -2.054   0.003  1.00  0.00           C  
HETATM   17  C   UNL     1       4.978  -0.998  -0.183  1.00  0.00           C  
HETATM   18  C   UNL     1       4.518   0.303  -0.091  1.00  0.00           C  
HETATM   19  C   UNL     1       3.184   0.546   0.182  1.00  0.00           C  
HETATM   20  C   UNL     1       2.682   1.964   0.277  1.00  0.00           C  
HETATM   21  O   UNL     1       3.750   2.868  -0.011  1.00  0.00           O  
HETATM   22  HXT UNL     1      -2.574  -4.038  -0.058  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.253  -1.046   0.342  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.350   2.843   0.010  1.00  0.00           H  
HETATM   25  H   UNL     1       0.102  -1.115  -1.142  1.00  0.00           H  
HETATM   26  H   UNL     1       0.525   0.609  -1.273  1.00  0.00           H  
HETATM   27  H   UNL     1       0.770   0.695   1.222  1.00  0.00           H  
HETATM   28  H   UNL     1       0.462  -1.057   1.282  1.00  0.00           H  
HETATM   29  H   UNL     1       2.092  -2.636   0.426  1.00  0.00           H  
HETATM   30  H   UNL     1       4.465  -3.070  -0.069  1.00  0.00           H  
HETATM   31  H   UNL     1       6.018  -1.188  -0.400  1.00  0.00           H  
HETATM   32  H   UNL     1       5.199   1.128  -0.236  1.00  0.00           H  
HETATM   33  H   UNL     1       1.876   2.112  -0.441  1.00  0.00           H  
HETATM   34  H   UNL     1       2.310   2.151   1.285  1.00  0.00           H  
HETATM   35  H   UNL     1       3.498   3.801   0.031  1.00  0.00           H  
CONECT    1    2   22                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    5    2   11   11                                       
CONECT    5    6    4   23                                            
CONECT    6    7    7    5    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   24                                            
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    4    4    9   12                                       
CONECT   12   11   13   25   26                                       
CONECT   13   12   14   27   28                                       
CONECT   14   13   19   19   15                                       
CONECT   15   14   16   16   29                                       
CONECT   16   15   15   17   30                                       
CONECT   17   18   18   16   31                                       
CONECT   18   19   17   17   32                                       
CONECT   19   20   14   14   18                                       
CONECT   20   21   19   33   34                                       
CONECT   21   20   35                                                 
CONECT   22    1                                                      
CONECT   23    5                                                      
CONECT   24    8                                                      
CONECT   25   12                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   13                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   20                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
