COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -5.675   2.623  -0.893  1.00  0.00           C  
HETATM    2  C   UNK A   0      -5.070   3.309  -2.119  1.00  0.00           C  
HETATM    3  C   UNK A   0      -5.010   1.007   0.782  1.00  0.00           C  
HETATM    4  O   UNK A   0      -6.105   1.114   1.281  1.00  0.00           O  
HETATM    5  O   UNK A   0      -4.697   1.722  -0.310  1.00  0.00           O  
HETATM    6  C   UNK A   0      -3.574  -1.150   0.569  1.00  0.00           C  
HETATM    7  C   UNK A   0      -3.994   0.072   1.387  1.00  0.00           C  
HETATM    8  O   UNK A   0      -4.421  -1.251   1.717  1.00  0.00           O  
HETATM    9  C   UNK A   0      -2.151  -1.630   0.701  1.00  0.00           C  
HETATM   10  O   UNK A   0      -1.918  -2.698   1.226  1.00  0.00           O  
ATOM     11  N   ILE A   1      -1.138  -0.872   0.236  1.00  0.00           N  
ATOM     12  CA  ILE A   1       0.244  -1.338   0.365  1.00  0.00           C  
ATOM     13  C   ILE A   1       1.176  -0.154   0.365  1.00  0.00           C  
ATOM     14  O   ILE A   1       0.729   0.969   0.267  1.00  0.00           O  
ATOM     15  CB  ILE A   1       0.585  -2.255  -0.812  1.00  0.00           C  
ATOM     16  CG1 ILE A   1       0.427  -1.482  -2.123  1.00  0.00           C  
ATOM     17  CG2 ILE A   1      -0.361  -3.457  -0.812  1.00  0.00           C  
ATOM     18  CD1 ILE A   1       0.887  -2.358  -3.290  1.00  0.00           C  
ATOM     19  N   ILE A   2       2.506  -0.343   0.474  1.00  0.00           N  
ATOM     20  CA  ILE A   2       3.412   0.809   0.474  1.00  0.00           C  
ATOM     21  C   ILE A   2       3.729   1.198  -0.947  1.00  0.00           C  
ATOM     22  O   ILE A   2       4.546   2.235  -1.192  1.00  0.00           O  
ATOM     23  CB  ILE A   2       4.706   0.440   1.203  1.00  0.00           C  
ATOM     24  CG1 ILE A   2       5.600   1.676   1.312  1.00  0.00           C  
ATOM     25  CG2 ILE A   2       5.438  -0.652   0.420  1.00  0.00           C  
ATOM     26  CD1 ILE A   2       6.836   1.339   2.148  1.00  0.00           C  
ATOM     27  OXT ILE A   2       3.248   0.578  -1.865  1.00  0.00           O  
HETATM   28  H   UNK A   0      -5.959   3.376  -0.158  1.00  0.00           H  
HETATM   29  H   UNK A   0      -6.557   2.057  -1.192  1.00  0.00           H  
HETATM   30  H   UNK A   0      -4.187   3.875  -1.820  1.00  0.00           H  
HETATM   31  H   UNK A   0      -4.786   2.556  -2.854  1.00  0.00           H  
HETATM   32  H   UNK A   0      -5.804   3.985  -2.557  1.00  0.00           H  
HETATM   33  H   UNK A   0      -4.029  -1.286  -0.412  1.00  0.00           H  
HETATM   34  H   UNK A   0      -3.244   0.538   2.026  1.00  0.00           H  
ATOM     35  H   ILE A   1      -1.325  -0.017  -0.183  1.00  0.00           H  
ATOM     36  HA  ILE A   1       0.357  -1.889   1.299  1.00  0.00           H  
ATOM     37  HB  ILE A   1       1.614  -2.602  -0.716  1.00  0.00           H  
ATOM     38 HG11 ILE A   1      -0.620  -1.211  -2.261  1.00  0.00           H  
ATOM     39 HG12 ILE A   1       1.034  -0.577  -2.086  1.00  0.00           H  
ATOM     40 HG21 ILE A   1      -0.119  -4.110  -1.650  1.00  0.00           H  
ATOM     41 HG22 ILE A   1      -0.249  -4.008   0.122  1.00  0.00           H  
ATOM     42 HG23 ILE A   1      -1.390  -3.110  -0.908  1.00  0.00           H  
ATOM     43 HD11 ILE A   1       1.933  -2.628  -3.151  1.00  0.00           H  
ATOM     44 HD12 ILE A   1       0.279  -3.262  -3.326  1.00  0.00           H  
ATOM     45 HD13 ILE A   1       0.774  -1.807  -4.224  1.00  0.00           H  
ATOM     46  H   ILE A   2       2.864  -1.241   0.552  1.00  0.00           H  
ATOM     47  HA  ILE A   2       2.935   1.646   0.982  1.00  0.00           H  
ATOM     48  H   ILE A   2       4.750   2.485  -2.104  1.00  0.00           H  
ATOM     49  HB  ILE A   2       4.468   0.073   2.201  1.00  0.00           H  
ATOM     50 HG11 ILE A   2       5.910   1.990   0.315  1.00  0.00           H  
ATOM     51 HG12 ILE A   2       5.046   2.484   1.791  1.00  0.00           H  
ATOM     52 HG21 ILE A   2       4.802  -1.533   0.342  1.00  0.00           H  
ATOM     53 HG22 ILE A   2       5.676  -0.285  -0.579  1.00  0.00           H  
ATOM     54 HG23 ILE A   2       6.360  -0.915   0.939  1.00  0.00           H  
ATOM     55 HD11 ILE A   2       7.473   2.221   2.226  1.00  0.00           H  
ATOM     56 HD12 ILE A   2       6.526   1.026   3.145  1.00  0.00           H  
ATOM     57 HD13 ILE A   2       7.390   0.532   1.669  1.00  0.00           H  
CONECT    1    2    5   28   29                                       
CONECT    2    1   30   31   32                                       
CONECT    3    4    4    5    7                                       
CONECT    4    3    3                                                 
CONECT    5    1    3                                                 
CONECT    6    7    8    9   33                                       
CONECT    7    3    6    8   34                                       
CONECT    8    6    7                                                 
CONECT    9    6   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   35                                            
CONECT   12   11   13   15   36                                       
CONECT   13   12   14   14   19                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   17   37                                       
CONECT   16   15   18   38   39                                       
CONECT   17   15   40   41   42                                       
CONECT   18   16   43   44   45                                       
CONECT   19   13   20   46                                            
CONECT   20   19   21   23   47                                       
CONECT   21   20   22   27   27                                       
CONECT   22   21   48                                                 
CONECT   23   20   24   25   49                                       
CONECT   24   23   26   50   51                                       
CONECT   25   23   52   53   54                                       
CONECT   26   24   55   56   57                                       
CONECT   27   21   21                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
