COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   VAL A   1      -1.823  -1.096  -0.371  1.00  0.00           N  
ATOM      2  CB  VAL A   1      -3.709  -2.421  -1.189  1.00  0.00           C  
ATOM      3  CG1 VAL A   1      -5.219  -2.396  -1.432  1.00  0.00           C  
ATOM      4  C   VAL A   1      -3.906  -1.059   0.874  1.00  0.00           C  
HETATM    5  C   UNK A   0      -1.269   2.420  -0.183  1.00  0.00           C  
HETATM    6  C   UNK A   0       0.143   2.463  -0.071  1.00  0.00           C  
HETATM    7  C   UNK A   0       4.170  -0.154  -0.385  1.00  0.00           C  
ATOM      8  OXT VAL A   1      -5.241  -1.073   1.005  1.00  0.00           O  
ATOM      9  O   VAL A   1      -3.203  -0.995   1.855  1.00  0.00           O  
ATOM     10  CA  VAL A   1      -3.282  -1.125  -0.496  1.00  0.00           C  
ATOM     11  CG2 VAL A   1      -3.355  -3.615  -0.300  1.00  0.00           C  
HETATM   12  C   UNK A   0      -1.161   0.115  -0.273  1.00  0.00           C  
HETATM   13  N   UNK A   0       0.164   0.109  -0.161  1.00  0.00           N  
HETATM   14  C   UNK A   0       0.854   1.237  -0.063  1.00  0.00           C  
HETATM   15  C   UNK A   0       0.792   3.697   0.026  1.00  0.00           C  
HETATM   16  C   UNK A   0       0.057   4.847   0.013  1.00  0.00           C  
HETATM   17  C   UNK A   0      -1.330   4.807  -0.096  1.00  0.00           C  
HETATM   18  C   UNK A   0      -1.993   3.619  -0.193  1.00  0.00           C  
HETATM   19  N   UNK A   0      -1.873   1.226  -0.281  1.00  0.00           N  
HETATM   20  N   UNK A   0       2.229   1.217   0.042  1.00  0.00           N  
HETATM   21  C   UNK A   0       2.903  -0.001   0.165  1.00  0.00           C  
HETATM   22  C   UNK A   0       2.309  -1.061   0.837  1.00  0.00           C  
HETATM   23  C   UNK A   0       2.978  -2.263   0.957  1.00  0.00           C  
HETATM   24  C   UNK A   0       4.239  -2.412   0.408  1.00  0.00           C  
HETATM   25  C   UNK A   0       4.831  -1.360  -0.266  1.00  0.00           C  
HETATM   26  C   UNK A   0       6.205  -1.527  -0.863  1.00  0.00           C  
HETATM   27  N   UNK A   0       7.220  -1.153   0.132  1.00  0.00           N  
ATOM     28  H   VAL A   1      -1.321  -1.926  -0.352  1.00  0.00           H  
ATOM     29  HB  VAL A   1      -3.189  -2.511  -2.143  1.00  0.00           H  
ATOM     30 HG11 VAL A   1      -5.471  -1.546  -2.066  1.00  0.00           H  
ATOM     31 HG12 VAL A   1      -5.523  -3.319  -1.926  1.00  0.00           H  
ATOM     32 HG13 VAL A   1      -5.739  -2.306  -0.479  1.00  0.00           H  
HETATM   33  H   UNK A   0       4.635   0.668  -0.909  1.00  0.00           H  
ATOM     34  HXT VAL A   1      -5.595  -1.029   1.904  1.00  0.00           H  
ATOM     35  HA  VAL A   1      -3.613  -0.271  -1.087  1.00  0.00           H  
ATOM     36 HG21 VAL A   1      -3.875  -3.524   0.654  1.00  0.00           H  
ATOM     37 HG22 VAL A   1      -3.659  -4.538  -0.794  1.00  0.00           H  
ATOM     38 HG23 VAL A   1      -2.279  -3.632  -0.127  1.00  0.00           H  
HETATM   39  H   UNK A   0       1.868   3.741   0.112  1.00  0.00           H  
HETATM   40  H   UNK A   0       0.558   5.800   0.089  1.00  0.00           H  
HETATM   41  H   UNK A   0      -1.889   5.731  -0.104  1.00  0.00           H  
HETATM   42  H   UNK A   0      -3.069   3.604  -0.277  1.00  0.00           H  
HETATM   43  H   UNK A   0       2.728   2.049   0.031  1.00  0.00           H  
HETATM   44  H   UNK A   0       1.325  -0.945   1.267  1.00  0.00           H  
HETATM   45  H   UNK A   0       2.516  -3.088   1.479  1.00  0.00           H  
HETATM   46  H   UNK A   0       4.760  -3.353   0.504  1.00  0.00           H  
HETATM   47  H   UNK A   0       6.350  -2.567  -1.156  1.00  0.00           H  
HETATM   48  H   UNK A   0       6.301  -0.886  -1.739  1.00  0.00           H  
HETATM   49  H   UNK A   0       7.110  -1.690   0.979  1.00  0.00           H  
HETATM   50  H   UNK A   0       8.150  -1.257  -0.245  1.00  0.00           H  
CONECT    1   10   12   28                                            
CONECT    2    3   10   11   29                                       
CONECT    3    2   30   31   32                                       
CONECT    4   10    9    9    8                                       
CONECT    5   19   19    6   18                                       
CONECT    6   14   14    5   15                                       
CONECT    7   25   25   21   33                                       
CONECT    8    4   34                                                 
CONECT    9    4    4                                                 
CONECT   10    2    1    4   35                                       
CONECT   11    2   36   37   38                                       
CONECT   12    1   13   13   19                                       
CONECT   13   12   12   14                                            
CONECT   14   13   20    6    6                                       
CONECT   15    6   16   16   39                                       
CONECT   16   15   15   17   40                                       
CONECT   17   18   18   16   41                                       
CONECT   18    5   17   17   42                                       
CONECT   19   12    5    5                                            
CONECT   20   21   14   43                                            
CONECT   21    7   20   22   22                                       
CONECT   22   21   21   23   44                                       
CONECT   23   24   24   22   45                                       
CONECT   24   25   23   23   46                                       
CONECT   25   26    7    7   24                                       
CONECT   26   27   25   47   48                                       
CONECT   27   26   49   50                                            
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
