COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.501   1.549  -1.760  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.813   1.424  -0.170  1.00  0.00           C  
HETATM    3  C   UNL     1       0.643   1.671   0.224  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.527   0.684   0.205  1.00  0.00           C  
HETATM    5  C   UNL     1       1.935   0.912   0.540  1.00  0.00           C  
HETATM    6  C   UNL     1       2.129  -0.199  -0.496  1.00  0.00           C  
HETATM    7  C   UNL     1       0.901  -1.114  -0.487  1.00  0.00           C  
HETATM    8  C   UNL     1       2.945  -0.281  -2.790  1.00  0.00           C  
HETATM    9  C   UNL     1       3.109   0.329  -4.158  1.00  0.00           C  
HETATM   10  C   UNL     1       3.390   2.453   1.630  1.00  0.00           C  
HETATM   11  C   UNL     1       4.547   3.418   1.654  1.00  0.00           C  
HETATM   12  N   UNL     1       2.288   0.394  -1.826  1.00  0.00           N  
HETATM   13  O   UNL     1      -5.401  -0.315  -0.316  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.923   0.529  -0.075  1.00  0.00           O  
HETATM   15  O   UNL     1      -4.915   2.072   0.674  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.269  -0.341  -0.758  1.00  0.00           O  
HETATM   17  O   UNL     1       0.414   2.663   1.226  1.00  0.00           O  
HETATM   18  O   UNL     1       3.061   1.828   0.489  1.00  0.00           O  
HETATM   19  O   UNL     1       3.405  -1.379  -2.557  1.00  0.00           O  
HETATM   20  O   UNL     1       2.758   2.242   2.639  1.00  0.00           O  
HETATM   21  P   UNL     1      -4.437   0.971  -0.399  1.00  0.00           P  
HETATM   22  P   UNL     1       0.125  -3.190   1.006  1.00  0.00           P  
HETATM   23  O   UNL     1      -1.232  -3.213   0.415  1.00  0.00           O  
HETATM   24  O   UNL     1       1.043  -4.299   0.285  1.00  0.00           O  
HETATM   25  O   UNL     1       0.777  -1.733   0.795  1.00  0.00           O  
HETATM   26  O   UNL     1       0.030  -3.513   2.580  1.00  0.00           O  
HETATM   27  H   UNL     1      -1.962   2.261   0.511  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.733   1.796  -1.192  1.00  0.00           H  
HETATM   29  H   UNL     1       0.731   2.150  -0.751  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.641   0.235   1.191  1.00  0.00           H  
HETATM   31  H   UNL     1       1.866   0.474   1.536  1.00  0.00           H  
HETATM   32  H   UNL     1       3.017  -0.780  -0.246  1.00  0.00           H  
HETATM   33  H   UNL     1       1.015  -1.882  -1.252  1.00  0.00           H  
HETATM   34  H   UNL     1       2.635   1.310  -4.178  1.00  0.00           H  
HETATM   35  H   UNL     1       4.170   0.434  -4.385  1.00  0.00           H  
HETATM   36  H   UNL     1       2.641  -0.316  -4.902  1.00  0.00           H  
HETATM   37  H   UNL     1       4.357   4.231   0.954  1.00  0.00           H  
HETATM   38  H   UNL     1       4.661   3.824   2.659  1.00  0.00           H  
HETATM   39  H   UNL     1       5.460   2.897   1.367  1.00  0.00           H  
HETATM   40  H   UNL     1       1.921   1.272  -2.013  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.331  -0.122  -0.500  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.899   1.762   1.589  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.392   3.180   1.091  1.00  0.00           H  
HETATM   44  H   UNL     1       1.948  -4.340   0.623  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.355  -4.377   2.782  1.00  0.00           H  
CONECT    1   21   21                                                 
CONECT    2    4   14   27   28                                       
CONECT    3    5    4   17   29                                       
CONECT    4   16    3    2   30                                       
CONECT    5    6   18    3   31                                       
CONECT    6   12    7    5   32                                       
CONECT    7    6   25   16   33                                       
CONECT    8   19   19    9   12                                       
CONECT    9    8   34   35   36                                       
CONECT   10   20   20   11   18                                       
CONECT   11   10   37   38   39                                       
CONECT   12    8    6   40                                            
CONECT   13   21   41                                                 
CONECT   14    2   21                                                 
CONECT   15   21   42                                                 
CONECT   16    7    4                                                 
CONECT   17    3   43                                                 
CONECT   18   10    5                                                 
CONECT   19    8    8                                                 
CONECT   20   10   10                                                 
CONECT   21   14    1    1   15                                       
CONECT   21   13                                                      
CONECT   22   23   23   24   26                                       
CONECT   22   25                                                      
CONECT   23   22   22                                                 
CONECT   24   22   44                                                 
CONECT   25   22    7                                                 
CONECT   26   22   45                                                 
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
