COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.800  -0.070   1.726  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.040  -0.056  -1.788  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.376  -0.061  -3.105  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.816   0.798  -4.116  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.190   0.789  -5.345  1.00  0.00           C  
HETATM    6  C   UNL     1       0.870  -0.068  -5.578  1.00  0.00           C  
HETATM    7  C   UNL     1       1.311  -0.922  -4.582  1.00  0.00           C  
HETATM    8  C   UNL     1       0.698  -0.920  -3.347  1.00  0.00           C  
HETATM    9  C   UNL     1       1.798   1.148  -0.710  1.00  0.00           C  
HETATM   10  C   UNL     1       3.160   1.181  -0.488  1.00  0.00           C  
HETATM   11  C   UNL     1       3.795   0.099   0.093  1.00  0.00           C  
HETATM   12  C   UNL     1       3.070  -1.021   0.457  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.808  -0.091   0.410  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.670  -0.074  -0.278  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.373  -0.087  -1.589  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.460  -0.025   0.433  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.331   0.032   2.575  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.498  -0.009   1.834  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.686  -0.029   2.433  1.00  0.00           N  
HETATM   20  C   UNL     1       1.708  -1.064   0.246  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.398  -0.020  -0.580  1.00  0.00           C  
HETATM   22  C   UNL     1       1.062   0.021  -0.345  1.00  0.00           C  
HETATM   23  C   UNL     1       1.005   0.100   4.599  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.392   0.055   4.038  1.00  0.00           C  
HETATM   25  O   UNL     1       1.955   0.112   3.853  1.00  0.00           O  
HETATM   26  O   UNL     1       1.194   0.127   5.928  1.00  0.00           O  
HETATM   27  H   UNL     1      -4.745  -0.086   2.250  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.644   1.467  -3.935  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.529   1.452  -6.127  1.00  0.00           H  
HETATM   30  H   UNL     1       1.356  -0.071  -6.543  1.00  0.00           H  
HETATM   31  H   UNL     1       2.139  -1.588  -4.772  1.00  0.00           H  
HETATM   32  H   UNL     1       1.043  -1.586  -2.570  1.00  0.00           H  
HETATM   33  H   UNL     1       1.304   1.994  -1.165  1.00  0.00           H  
HETATM   34  H   UNL     1       3.730   2.054  -0.770  1.00  0.00           H  
HETATM   35  H   UNL     1       4.861   0.129   0.264  1.00  0.00           H  
HETATM   36  H   UNL     1       3.572  -1.863   0.911  1.00  0.00           H  
HETATM   37  H   UNL     1       0.528   0.047   2.125  1.00  0.00           H  
HETATM   38  H   UNL     1       1.143  -1.940   0.530  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.898  -0.842   4.394  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.944   0.936   4.365  1.00  0.00           H  
HETATM   41  H   UNL     1       2.091   0.155   6.288  1.00  0.00           H  
CONECT    1   13   13   19   27                                       
CONECT    2    3   15   21   21                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5   28                                       
CONECT    5    4    6    6   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    6    8    8   31                                       
CONECT    8    3    7    7   32                                       
CONECT    9   10   10   22   33                                       
CONECT   10    9    9   11   34                                       
CONECT   11   10   12   12   35                                       
CONECT   12   11   11   20   36                                       
CONECT   13    1    1   14                                            
CONECT   14   13   15   16   16                                       
CONECT   15    2   14                                                 
CONECT   16   14   14   18   21                                       
CONECT   17   18   24   37                                            
CONECT   18   16   17   19   19                                       
CONECT   19    1   18   18                                            
CONECT   20   12   22   22   38                                       
CONECT   21    2    2   16   22                                       
CONECT   22    9   20   20   21                                       
CONECT   23   24   25   25   26                                       
CONECT   24   17   23   39   40                                       
CONECT   25   23   23                                                 
CONECT   26   23   41                                                 
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   17                                                      
CONECT   38   20                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
CONECT   41   26                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
