COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.347   0.927  -0.682  1.00  0.00           C  
HETATM    2  C   UNL     1       2.146   0.045  -0.459  1.00  0.00           C  
HETATM    3  C   UNL     1       1.294  -2.087  -0.217  1.00  0.00           C  
HETATM    4  C   UNL     1       1.540  -3.573  -0.169  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.134  -2.517   0.158  1.00  0.00           C  
HETATM    6  C   UNL     1       0.900   0.620  -0.318  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.566   0.374   0.045  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.883   1.120   1.180  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.148   1.653   1.320  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.481   2.034   0.497  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.529   0.176  -0.944  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.450  -2.838   1.286  1.00  0.00           O  
HETATM   13  O   UNL     1      -1.817  -3.003  -0.897  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.002  -1.596  -0.058  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.210  -0.201  -0.112  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.101   1.449   0.338  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.791   0.715  -0.793  1.00  0.00           C  
HETATM   18  C   UNL     1       0.739   2.117  -0.384  1.00  0.00           C  
HETATM   19  N   UNL     1       0.592   2.532  -1.785  1.00  0.00           N  
HETATM   20  C   UNL     1       3.955   1.311   0.668  1.00  0.00           C  
HETATM   21  C   UNL     1       4.496   0.058   1.359  1.00  0.00           C  
HETATM   22  C   UNL     1       5.097   2.306   0.449  1.00  0.00           C  
HETATM   23  N   UNL     1       2.305  -1.265  -0.408  1.00  0.00           N  
HETATM   24  H   UNL     1       4.088   0.389  -1.275  1.00  0.00           H  
HETATM   25  H   UNL     1       3.042   1.829  -1.213  1.00  0.00           H  
HETATM   26  H   UNL     1       1.745  -3.874   0.859  1.00  0.00           H  
HETATM   27  H   UNL     1       0.657  -4.100  -0.532  1.00  0.00           H  
HETATM   28  H   UNL     1       2.395  -3.821  -0.798  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.141   1.280   1.947  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.395   2.231   2.198  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.505   3.032   0.059  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.206   1.397  -0.008  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.728   2.097   1.557  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.288  -0.397  -1.827  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.551  -3.604  -0.706  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.539   0.559  -1.556  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.147   2.413   0.178  1.00  0.00           H  
HETATM   38  H   UNL     1       1.618   2.597   0.046  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.238   2.132  -2.196  1.00  0.00           H  
HETATM   40  H   UNL     1       0.585   3.538  -1.866  1.00  0.00           H  
HETATM   41  H   UNL     1       3.190   1.769   1.294  1.00  0.00           H  
HETATM   42  H   UNL     1       5.262  -0.400   0.733  1.00  0.00           H  
HETATM   43  H   UNL     1       4.930   0.332   2.321  1.00  0.00           H  
HETATM   44  H   UNL     1       3.683  -0.651   1.515  1.00  0.00           H  
HETATM   45  H   UNL     1       4.712   3.198  -0.044  1.00  0.00           H  
HETATM   46  H   UNL     1       5.530   2.579   1.411  1.00  0.00           H  
HETATM   47  H   UNL     1       5.863   1.847  -0.177  1.00  0.00           H  
CONECT    1   20    2   24   25                                       
CONECT    2    1    6    6   23                                       
CONECT    3   14    4   23   23                                       
CONECT    4    3   26   27   28                                       
CONECT    5   12   12   14   13                                       
CONECT    6    2    2   15   18                                       
CONECT    7    8    8   15   11                                       
CONECT    8    7    7    9   29                                       
CONECT    9    8   16   16   30                                       
CONECT   10   16   31   32   33                                       
CONECT   11    7   17   17   34                                       
CONECT   12    5    5                                                 
CONECT   13    5   35                                                 
CONECT   14    3    5   15   15                                       
CONECT   15    6    7   14   14                                       
CONECT   16    9    9   10   17                                       
CONECT   17   11   11   16   36                                       
CONECT   18    6   19   37   38                                       
CONECT   19   18   39   40                                            
CONECT   20    1   22   21   41                                       
CONECT   21   20   42   43   44                                       
CONECT   22   20   45   46   47                                       
CONECT   23    2    3    3                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
