COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.344   2.096  -0.191  1.00  0.00           N  
HETATM    2  N   UNL     1      -0.581   0.873  -0.376  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.397  -0.155  -0.023  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.533  -1.239   0.060  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.260  -0.301   0.164  1.00  0.00           C  
HETATM    6  C   UNL     1       0.269   1.879  -0.361  1.00  0.00           C  
HETATM    7  C   UNL     1       1.860   0.633   0.744  1.00  0.00           C  
HETATM    8  C   UNL     1       4.321   1.562  -0.484  1.00  0.00           C  
HETATM    9  C   UNL     1       5.575  -1.294  -1.752  1.00  0.00           C  
HETATM   10  C   UNL     1       5.452   1.368   1.192  1.00  0.00           C  
HETATM   11  C   UNL     1       0.991  -0.456   0.749  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.440  -2.748  -0.004  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.280  -1.678  -0.074  1.00  0.00           C  
HETATM   14  O   UNL     1       7.056  -1.068   0.144  1.00  0.00           O  
HETATM   15  C   UNL     1       6.199  -0.336  -0.735  1.00  0.00           C  
HETATM   16  C   UNL     1       7.013   0.730  -1.470  1.00  0.00           C  
HETATM   17  C   UNL     1       5.091   0.338   0.077  1.00  0.00           C  
HETATM   18  C   UNL     1       3.950   1.744   1.009  1.00  0.00           C  
HETATM   19  C   UNL     1       3.925  -0.541   0.647  1.00  0.00           C  
HETATM   20  N   UNL     1       3.120   0.530   1.314  1.00  0.00           N  
HETATM   21  N   UNL     1       1.464   1.773   0.183  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.166  -1.359   0.143  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.832  -2.716   0.204  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.910  -3.446   0.164  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.056  -2.547   0.070  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.769  -0.373  -0.090  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.694   0.779  -0.167  1.00  0.00           C  
HETATM   28  N   UNL     1      -6.523   2.849  -0.261  1.00  0.00           N  
HETATM   29  C   UNL     1      -7.541   2.026  -0.280  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.058   0.719  -0.228  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.441   2.448  -0.159  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.007   0.852  -0.031  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.022   2.818  -0.808  1.00  0.00           H  
HETATM   34  H   UNL     1       4.957   2.348  -0.889  1.00  0.00           H  
HETATM   35  H   UNL     1       3.480   1.309  -1.129  1.00  0.00           H  
HETATM   36  H   UNL     1       4.995  -2.053  -1.228  1.00  0.00           H  
HETATM   37  H   UNL     1       4.921  -0.736  -2.423  1.00  0.00           H  
HETATM   38  H   UNL     1       6.364  -1.774  -2.331  1.00  0.00           H  
HETATM   39  H   UNL     1       5.693   0.924   2.157  1.00  0.00           H  
HETATM   40  H   UNL     1       6.153   2.142   0.882  1.00  0.00           H  
HETATM   41  H   UNL     1       1.281  -1.395   1.196  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.842  -3.750   0.004  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.347  -1.836  -0.131  1.00  0.00           H  
HETATM   44  H   UNL     1       6.606  -1.763   0.645  1.00  0.00           H  
HETATM   45  H   UNL     1       6.359   1.288  -2.141  1.00  0.00           H  
HETATM   46  H   UNL     1       7.457   1.412  -0.745  1.00  0.00           H  
HETATM   47  H   UNL     1       7.802   0.250  -2.049  1.00  0.00           H  
HETATM   48  H   UNL     1       3.597   2.710   1.369  1.00  0.00           H  
HETATM   49  H   UNL     1       3.361  -1.023  -0.153  1.00  0.00           H  
HETATM   50  H   UNL     1       4.292  -1.273   1.367  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.948  -4.525   0.196  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.581   2.312  -0.331  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.656  -0.180  -0.229  1.00  0.00           H  
CONECT    1   28   27   31                                            
CONECT    2    6    6    5                                            
CONECT    3   26    4    4   32                                       
CONECT    4    3    3   25   22                                       
CONECT    5    2   22   11   11                                       
CONECT    6    2    2   21   33                                       
CONECT    7   21   21   11   20                                       
CONECT    8   18   17   34   35                                       
CONECT    9   15   36   37   38                                       
CONECT   10   18   17   39   40                                       
CONECT   11    5    5    7   41                                       
CONECT   12   13   25   25   42                                       
CONECT   13   26   26   12   43                                       
CONECT   14   15   44                                                 
CONECT   15   17   16    9   14                                       
CONECT   16   15   45   46   47                                       
CONECT   17   19   10    8   15                                       
CONECT   18   20   10    8   48                                       
CONECT   19   20   17   49   50                                       
CONECT   20    7   19   18                                            
CONECT   21    6    7    7                                            
CONECT   22    4    5   23                                            
CONECT   23   22   24   24                                            
CONECT   24   25   23   23   51                                       
CONECT   25   12   12    4   24                                       
CONECT   26   27   13   13    3                                       
CONECT   27   30   30    1   26                                       
CONECT   28   29   29    1                                            
CONECT   29   28   28   30   52                                       
CONECT   30   29   27   27   53                                       
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   24                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
