COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.983   0.946  -0.004  1.00  0.00           C  
HETATM    2  C   UNL     1       0.358   1.634  -0.005  1.00  0.00           C  
HETATM    3  O   UNL     1       0.419   2.846  -0.008  1.00  0.00           O  
HETATM    4  C   UNL     1       1.589   0.839  -0.004  1.00  0.00           C  
HETATM    5  N   UNL     1       1.649  -0.477  -0.007  1.00  0.00           N  
HETATM    6  C   UNL     1       2.924  -0.851  -0.006  1.00  0.00           C  
HETATM    7  C   UNL     1       3.693   0.293  -0.002  1.00  0.00           C  
HETATM    8  O   UNL     1       2.840   1.336  -0.006  1.00  0.00           O  
HETATM    9  C   UNL     1       5.169   0.362   0.002  1.00  0.00           C  
HETATM   10  N   UNL     1       5.878  -0.757   0.001  1.00  0.00           N  
HETATM   11  CA  UNL     1       7.204  -0.737   0.004  1.00  0.00           C  
HETATM   12  C   UNL     1       7.898   0.472   0.009  1.00  0.00           C  
HETATM   13  C   UNL     1       7.186   1.663   0.009  1.00  0.00           C  
HETATM   14  C   UNL     1       5.804   1.609   0.000  1.00  0.00           C  
HETATM   15  C   UNL     1       7.955  -2.013   0.003  1.00  0.00           C  
HETATM   16  OXT UNL     1       9.170  -2.003   0.006  1.00  0.00           O  
HETATM   17  O   UNL     1       7.292  -3.185  -0.001  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.095   1.997  -0.005  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.436   1.310  -0.003  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.047   0.988  -1.202  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.275   0.358  -1.206  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.899   0.047   0.000  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.279   0.373   1.205  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.049   0.998   1.197  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.220  -0.630   0.002  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.838  -0.962  -1.202  1.00  0.00           C  
HETATM   27  C   UNL     1      -9.066  -1.592  -1.194  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.683  -1.893   0.006  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.075  -1.566   1.204  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.844  -0.942   1.209  1.00  0.00           C  
HETATM   31  H   UNL     1      -1.072   0.322  -0.892  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.072   0.325   0.888  1.00  0.00           H  
HETATM   33  H   UNL     1       3.290  -1.867  -0.007  1.00  0.00           H  
HETATM   34  H   UNL     1       8.978   0.481   0.012  1.00  0.00           H  
HETATM   35  H   UNL     1       7.701   2.613   0.013  1.00  0.00           H  
HETATM   36  H   UNL     1       5.222   2.519  -0.004  1.00  0.00           H  
HETATM   37  H   UNL     1       7.826  -3.992  -0.001  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.006   2.622   0.883  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.006   2.619  -0.897  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.562   1.230  -2.136  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.752   0.108  -2.142  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.759   0.134   2.142  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.565   1.248   2.130  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.356  -0.726  -2.140  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.545  -1.849  -2.127  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.644  -2.386   0.007  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.562  -1.804   2.139  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.368  -0.691   2.145  1.00  0.00           H  
CONECT    1   18    2   31   32                                       
CONECT    2    1    4    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    2    8    5    5                                       
CONECT    5    4    4    6                                            
CONECT    6    5    7    7   33                                       
CONECT    7    6    6    9    8                                       
CONECT    8    4    7                                                 
CONECT    9    7   10   10   14                                       
CONECT   10    9    9   11                                            
CONECT   11   10   15   12   12                                       
CONECT   12   11   11   34   13                                       
CONECT   13   12   35   14   14                                       
CONECT   14    9   13   13   36                                       
CONECT   15   11   17   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   15   37                                                 
CONECT   18    1   19   38   39                                       
CONECT   19   18   24   20   20                                       
CONECT   20   19   19   21   40                                       
CONECT   21   20   22   22   41                                       
CONECT   22   21   21   23   25                                       
CONECT   23   22   42   24   24                                       
CONECT   24   19   23   23   43                                       
CONECT   25   22   30   26   26                                       
CONECT   26   25   25   27   44                                       
CONECT   27   26   28   28   45                                       
CONECT   28   27   27   29   46                                       
CONECT   29   28   47   30   30                                       
CONECT   30   25   29   29   48                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    6                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
