COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.338   5.852   0.227  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.231   5.920  -0.591  1.00  0.00           O  
HETATM    3  C   UNL     1      -0.041   7.030   1.118  1.00  0.00           C  
HETATM    4  N   UNL     1       0.384   4.720   0.342  1.00  0.00           N  
HETATM    5  C   UNL     1       0.091   3.572  -0.520  1.00  0.00           C  
HETATM    6  C   UNL     1       0.548   2.306   0.157  1.00  0.00           C  
HETATM    7  O   UNL     1       1.067   2.356   1.252  1.00  0.00           O  
HETATM    8  C   UNL     1       0.829   3.734  -1.851  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.266  -2.316  -0.464  1.00  0.00           C  
HETATM   10  CA  UNL     1      -5.891  -1.981  -0.164  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.455  -1.132   0.069  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.711  -2.152  -0.071  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.309  -1.918  -0.670  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.492  -1.881   1.118  1.00  0.00           C  
HETATM   15  C   UNL     1       2.286  -0.338  -0.083  1.00  0.00           C  
HETATM   16  O   UNL     1       2.897   0.453  -0.769  1.00  0.00           O  
HETATM   17  C   UNL     1       0.823  -0.115   0.203  1.00  0.00           C  
HETATM   18  C   UNL     1       0.012  -1.298  -0.330  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.763  -2.157  -0.918  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.155  -1.987   1.145  1.00  0.00           N  
HETATM   21  O   UNL     1      -8.200  -1.725   0.430  1.00  0.00           O  
HETATM   22  N   UNL     1       0.379   1.117  -0.455  1.00  0.00           N  
HETATM   23  N   UNL     1       2.914  -1.418   0.424  1.00  0.00           N  
HETATM   24  C   UNL     1       4.336  -1.635   0.146  1.00  0.00           C  
HETATM   25  C   UNL     1       4.487  -2.346  -1.174  1.00  0.00           C  
HETATM   26  O   UNL     1       3.566  -2.997  -1.621  1.00  0.00           O  
HETATM   27  C   UNL     1       4.948  -2.489   1.258  1.00  0.00           C  
HETATM   28  C   UNL     1       4.862  -1.734   2.586  1.00  0.00           C  
HETATM   29  C   UNL     1       4.181  -3.808   1.370  1.00  0.00           C  
HETATM   30  N   UNL     1       5.645  -2.259  -1.858  1.00  0.00           N  
HETATM   31  H   UNL     1      -0.634   6.955   2.030  1.00  0.00           H  
HETATM   32  H   UNL     1       1.019   7.033   1.374  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.292   7.953   0.596  1.00  0.00           H  
HETATM   34  H   UNL     1       1.099   4.665   0.996  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.982   3.520  -0.703  1.00  0.00           H  
HETATM   36  H   UNL     1       0.498   4.650  -2.341  1.00  0.00           H  
HETATM   37  H   UNL     1       1.902   3.786  -1.668  1.00  0.00           H  
HETATM   38  H   UNL     1       0.610   2.880  -2.493  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.186  -2.350  -1.550  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.877  -3.242  -0.041  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.844  -0.206  -0.354  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.535  -1.097   1.156  1.00  0.00           H  
HETATM   43  H1  UNL     1      -7.409  -1.088  -1.369  1.00  0.00           H  
HETATM   44  H2  UNL     1      -7.556  -2.851  -1.177  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.135  -1.740   1.974  1.00  0.00           H  
HETATM   46  H   UNL     1       0.672  -0.026   1.279  1.00  0.00           H  
HETATM   47  H   UNL     1       0.401  -2.225   0.093  1.00  0.00           H  
HETATM   48  H   UNL     1       0.092  -1.333  -1.416  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.725  -2.265  -1.881  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.132  -1.675   0.178  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.036   1.076  -1.331  1.00  0.00           H  
HETATM   52  H   UNL     1       2.425  -2.051   0.972  1.00  0.00           H  
HETATM   53  H   UNL     1       4.848  -0.674   0.101  1.00  0.00           H  
HETATM   54  H   UNL     1       5.993  -2.695   1.024  1.00  0.00           H  
HETATM   55  H   UNL     1       5.329  -0.755   2.479  1.00  0.00           H  
HETATM   56  H   UNL     1       3.815  -1.609   2.865  1.00  0.00           H  
HETATM   57  H   UNL     1       5.379  -2.301   3.360  1.00  0.00           H  
HETATM   58  H   UNL     1       4.617  -4.416   2.162  1.00  0.00           H  
HETATM   59  H   UNL     1       3.136  -3.602   1.603  1.00  0.00           H  
HETATM   60  H   UNL     1       4.242  -4.345   0.423  1.00  0.00           H  
HETATM   61  H   UNL     1       6.405  -1.799  -1.468  1.00  0.00           H  
HETATM   62  H   UNL     1       5.718  -2.656  -2.740  1.00  0.00           H  
CONECT    1    4    2    2    3                                       
CONECT    2    1    1                                                 
CONECT    3    1   31   32   33                                       
CONECT    4    5    1   34                                            
CONECT    5    6    8    4   35                                       
CONECT    6   22    7    7    5                                       
CONECT    7    6    6                                                 
CONECT    8    5   36   37   38                                       
CONECT    9   12   11   39   40                                       
CONECT   10   13   19   14   14                                       
CONECT   11    9   18   41   42                                       
CONECT   12    9   19   20   20                                       
CONECT   13   10   21   43   44                                       
CONECT   14   10   10   20   45                                       
CONECT   15   23   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   22   18   46                                       
CONECT   18   11   17   47   48                                       
CONECT   19   10   12   49                                            
CONECT   20   12   12   14                                            
CONECT   21   13   50                                                 
CONECT   22   17    6   51                                            
CONECT   23   24   15   52                                            
CONECT   24   27   25   23   53                                       
CONECT   25   24   30   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   28   24   29   54                                       
CONECT   28   27   56   57   55                                       
CONECT   29   27   58   59   60                                       
CONECT   30   25   61   62                                            
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
