COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  C   VAL A   1      -4.671   1.173   0.843  1.00  0.00           C  
HETATM    2  C   UNK A   0       5.536   0.552  -0.231  1.00  0.00           C  
HETATM    3  C   UNK A   0       5.619  -0.729   0.285  1.00  0.00           C  
HETATM    4  C   UNK A   0       4.467  -1.444   0.550  1.00  0.00           C  
HETATM    5  C   UNK A   0       3.225  -0.876   0.297  1.00  0.00           C  
HETATM    6  C   UNK A   0       0.441  -0.633   0.145  1.00  0.00           C  
HETATM    7  C   UNK A   0       4.299   1.120  -0.484  1.00  0.00           C  
HETATM    8  C   UNK A   0      -2.014  -0.327  -0.027  1.00  0.00           C  
ATOM      9  N   VAL A   1      -3.307  -0.688   0.093  1.00  0.00           N  
ATOM     10  CG1 VAL A   1      -6.734   0.427  -1.081  1.00  0.00           C  
HETATM   11  O   UNK A   0      -1.728   0.768  -0.461  1.00  0.00           O  
HETATM   12 CL   UNK A   0       6.985   1.450  -0.557  1.00  0.00          Cl  
ATOM     13  CB  VAL A   1      -5.627  -0.545  -0.668  1.00  0.00           C  
ATOM     14  OXT VAL A   1      -5.616   2.117   0.709  1.00  0.00           O  
ATOM     15  CG2 VAL A   1      -5.318  -1.490  -1.831  1.00  0.00           C  
ATOM     16  O   VAL A   1      -4.068   1.066   1.885  1.00  0.00           O  
ATOM     17  CA  VAL A   1      -4.367   0.242  -0.303  1.00  0.00           C  
HETATM   18  C   UNK A   0      -0.924  -1.285   0.379  1.00  0.00           C  
HETATM   19  C   UNK A   0       3.145   0.410  -0.222  1.00  0.00           C  
HETATM   20  S   UNK A   0       1.753  -1.785   0.634  1.00  0.00           S  
HETATM   21  H   UNK A   0       6.585  -1.170   0.481  1.00  0.00           H  
HETATM   22  H   UNK A   0       4.533  -2.444   0.953  1.00  0.00           H  
HETATM   23  H   UNK A   0       0.549  -0.386  -0.912  1.00  0.00           H  
HETATM   24  H   UNK A   0       0.516   0.277   0.740  1.00  0.00           H  
HETATM   25  H   UNK A   0       4.238   2.121  -0.887  1.00  0.00           H  
ATOM     26  H   VAL A   1      -3.536  -1.565   0.440  1.00  0.00           H  
ATOM     27 HG11 VAL A   1      -6.405   1.007  -1.943  1.00  0.00           H  
ATOM     28 HG12 VAL A   1      -7.632  -0.134  -1.341  1.00  0.00           H  
ATOM     29 HG13 VAL A   1      -6.954   1.100  -0.252  1.00  0.00           H  
ATOM     30  HB  VAL A   1      -5.956  -1.125   0.194  1.00  0.00           H  
ATOM     31  HXT VAL A   1      -5.779   2.687   1.472  1.00  0.00           H  
ATOM     32 HG21 VAL A   1      -4.530  -2.182  -1.538  1.00  0.00           H  
ATOM     33 HG22 VAL A   1      -6.216  -2.051  -2.092  1.00  0.00           H  
ATOM     34 HG23 VAL A   1      -4.990  -0.909  -2.694  1.00  0.00           H  
ATOM     35  HA  VAL A   1      -4.038   0.823  -1.164  1.00  0.00           H  
HETATM   36  H   UNK A   0      -0.999  -2.195  -0.216  1.00  0.00           H  
HETATM   37  H   UNK A   0      -1.031  -1.531   1.436  1.00  0.00           H  
HETATM   38  H   UNK A   0       2.180   0.855  -0.419  1.00  0.00           H  
CONECT    1   17   16   16   14                                       
CONECT    2   12    3    3    7                                       
CONECT    3    2    2    4   21                                       
CONECT    4    3    5    5   22                                       
CONECT    5    4    4   19   20                                       
CONECT    6   20   18   23   24                                       
CONECT    7    2   19   19   25                                       
CONECT    8   11   11   18    9                                       
CONECT    9    8   17   26                                            
CONECT   10   13   27   28   29                                       
CONECT   11    8    8                                                 
CONECT   12    2                                                      
CONECT   13   10   17   15   30                                       
CONECT   14    1   31                                                 
CONECT   15   13   32   33   34                                       
CONECT   16    1    1                                                 
CONECT   17   13    9    1   35                                       
CONECT   18    8    6   36   37                                       
CONECT   19    7    7    5   38                                       
CONECT   20    5    6                                                 
CONECT   21    3                                                      
CONECT   22    4                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
