COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   VAL A   1      -1.885   0.487  -0.201  1.00  0.00           N  
ATOM      2  CA  VAL A   1      -3.113   0.001   0.433  1.00  0.00           C  
ATOM      3  CB  VAL A   1      -3.508  -1.343  -0.183  1.00  0.00           C  
ATOM      4  CG2 VAL A   1      -3.624  -1.193  -1.701  1.00  0.00           C  
ATOM      5  CG1 VAL A   1      -2.440  -2.388   0.147  1.00  0.00           C  
ATOM      6  C   VAL A   1      -4.220   0.999   0.215  1.00  0.00           C  
ATOM      7  O   VAL A   1      -4.006   2.012  -0.407  1.00  0.00           O  
HETATM    8  C   UNK A   0      -0.684   0.073   0.250  1.00  0.00           C  
HETATM    9  O   UNK A   0      -0.620  -0.701   1.181  1.00  0.00           O  
HETATM   10  C   UNK A   0       0.579   0.573  -0.403  1.00  0.00           C  
HETATM   11  C   UNK A   0       1.793  -0.045   0.294  1.00  0.00           C  
HETATM   12  C   UNK A   0       3.075   0.463  -0.368  1.00  0.00           C  
HETATM   13  C   UNK A   0       4.288  -0.155   0.329  1.00  0.00           C  
HETATM   14  C   UNK A   0       5.571   0.353  -0.334  1.00  0.00           C  
HETATM   15  C   UNK A   0       6.784  -0.265   0.363  1.00  0.00           C  
HETATM   16  C   UNK A   0       8.066   0.242  -0.299  1.00  0.00           C  
ATOM     17  H   VAL A   1      -1.936   1.103  -0.948  1.00  0.00           H  
ATOM     18  HA  VAL A   1      -2.943  -0.126   1.503  1.00  0.00           H  
ATOM     19  HB  VAL A   1      -4.467  -1.662   0.225  1.00  0.00           H  
ATOM     20 HG21 VAL A   1      -2.664  -0.874  -2.109  1.00  0.00           H  
ATOM     21 HG22 VAL A   1      -3.905  -2.150  -2.140  1.00  0.00           H  
ATOM     22 HG23 VAL A   1      -4.384  -0.448  -1.936  1.00  0.00           H  
ATOM     23 HG11 VAL A   1      -2.358  -2.495   1.228  1.00  0.00           H  
ATOM     24 HG12 VAL A   1      -2.722  -3.346  -0.292  1.00  0.00           H  
ATOM     25 HG13 VAL A   1      -1.481  -2.070  -0.261  1.00  0.00           H  
ATOM     26  OXT VAL A   1      -5.445   0.762   0.711  1.00  0.00           O  
HETATM   27  H   UNK A   0       0.581   0.290  -1.455  1.00  0.00           H  
HETATM   28  H   UNK A   0       0.626   1.659  -0.319  1.00  0.00           H  
HETATM   29  H   UNK A   0       1.791   0.239   1.347  1.00  0.00           H  
HETATM   30  H   UNK A   0       1.746  -1.130   0.211  1.00  0.00           H  
HETATM   31  H   UNK A   0       3.077   0.179  -1.421  1.00  0.00           H  
HETATM   32  H   UNK A   0       3.122   1.549  -0.285  1.00  0.00           H  
HETATM   33  H   UNK A   0       4.286   0.129   1.381  1.00  0.00           H  
HETATM   34  H   UNK A   0       4.241  -1.241   0.245  1.00  0.00           H  
HETATM   35  H   UNK A   0       5.573   0.069  -1.386  1.00  0.00           H  
HETATM   36  H   UNK A   0       5.617   1.439  -0.250  1.00  0.00           H  
HETATM   37  H   UNK A   0       6.782   0.019   1.416  1.00  0.00           H  
HETATM   38  H   UNK A   0       6.737  -1.351   0.280  1.00  0.00           H  
HETATM   39  H   UNK A   0       8.068  -0.041  -1.352  1.00  0.00           H  
HETATM   40  H   UNK A   0       8.113   1.328  -0.216  1.00  0.00           H  
HETATM   41  H   UNK A   0       8.931  -0.198   0.197  1.00  0.00           H  
ATOM     42  HXT VAL A   1      -6.123   1.431   0.545  1.00  0.00           H  
CONECT    1    2    8   17                                            
CONECT    2    6    1    3   18                                       
CONECT    3    2    5    4   19                                       
CONECT    4    3   20   21   22                                       
CONECT    5    3   23   24   25                                       
CONECT    6    7    7    2   26                                       
CONECT    7    6    6                                                 
CONECT    8    1   10    9    9                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   27   28                                       
CONECT   11   10   12   29   30                                       
CONECT   12   11   13   31   32                                       
CONECT   13   12   14   33   34                                       
CONECT   14   13   15   35   36                                       
CONECT   15   14   16   37   38                                       
CONECT   16   15   39   40   41                                       
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6   42                                                 
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
