COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.229  -0.284  -0.013  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.164  -0.231  -1.388  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.952  -0.014  -2.027  1.00  0.00           C  
HETATM    4  C   UNL     1       0.205   0.152  -1.283  1.00  0.00           C  
HETATM    5  C   UNL     1       0.153   0.100   0.094  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.064  -0.117   0.743  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.630   0.083  -3.503  1.00  0.00           C  
HETATM    8  C   UNL     1       0.756   0.758  -3.570  1.00  0.00           C  
HETATM    9  C   UNL     1       1.379   0.371  -2.213  1.00  0.00           C  
HETATM   10  C   UNL     1       2.195  -0.915  -2.351  1.00  0.00           C  
HETATM   11  C   UNL     1       3.415  -0.654  -3.237  1.00  0.00           C  
HETATM   12  C   UNL     1       2.659  -1.376  -0.967  1.00  0.00           C  
HETATM   13  C   UNL     1       0.620   2.277  -3.693  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.674   0.942  -4.219  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.571  -1.311  -4.129  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.549  -0.521   0.673  1.00  0.00           C  
HETATM   17  C   UNL     1       0.108   0.135   3.026  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.220   0.008   4.515  1.00  0.00           C  
HETATM   19  C   UNL     1       1.010   0.316   5.329  1.00  0.00           C  
HETATM   20  O   UNL     1       2.044   0.606   4.775  1.00  0.00           O  
HETATM   21  O   UNL     1       0.957   0.266   6.670  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.122  -0.171   2.212  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.159  -0.463   2.768  1.00  0.00           O  
HETATM   24  H   UNL     1      -3.063  -0.360  -1.972  1.00  0.00           H  
HETATM   25  H   UNL     1       1.056   0.230   0.672  1.00  0.00           H  
HETATM   26  H   UNL     1       1.343   0.355  -4.395  1.00  0.00           H  
HETATM   27  H   UNL     1       2.010   1.179  -1.842  1.00  0.00           H  
HETATM   28  H   UNL     1       1.576  -1.690  -2.803  1.00  0.00           H  
HETATM   29  H   UNL     1       3.995  -1.571  -3.335  1.00  0.00           H  
HETATM   30  H   UNL     1       3.084  -0.326  -4.222  1.00  0.00           H  
HETATM   31  H   UNL     1       4.033   0.120  -2.784  1.00  0.00           H  
HETATM   32  H   UNL     1       3.277  -0.601  -0.515  1.00  0.00           H  
HETATM   33  H   UNL     1       1.790  -1.562  -0.336  1.00  0.00           H  
HETATM   34  H   UNL     1       3.240  -2.293  -1.066  1.00  0.00           H  
HETATM   35  H   UNL     1       1.607   2.735  -3.641  1.00  0.00           H  
HETATM   36  H   UNL     1       0.154   2.524  -4.647  1.00  0.00           H  
HETATM   37  H   UNL     1       0.001   2.653  -2.879  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.646   0.453  -4.163  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.730   1.919  -3.740  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.388   1.065  -5.264  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.579  -1.721  -4.198  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.137  -1.244  -5.126  1.00  0.00           H  
HETATM   43  H   UNL     1       0.042  -1.963  -3.508  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.648  -1.579   0.915  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.593   0.066   1.589  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.362  -0.223   0.010  1.00  0.00           H  
HETATM   47  H   UNL     1       0.900  -0.567   2.768  1.00  0.00           H  
HETATM   48  H   UNL     1       0.440   1.151   2.813  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.011   0.711   4.774  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.552  -1.007   4.729  1.00  0.00           H  
HETATM   51  H   UNL     1       1.747   0.464   7.192  1.00  0.00           H  
CONECT    1    2    2    6   16                                       
CONECT    2    1    1    3   24                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   25                                       
CONECT    6    1    5    5   22                                       
CONECT    7    3    8   14   15                                       
CONECT    8    7    9   13   26                                       
CONECT    9    4    8   10   27                                       
CONECT   10    9   11   12   28                                       
CONECT   11   10   29   30   31                                       
CONECT   12   10   32   33   34                                       
CONECT   13    8   35   36   37                                       
CONECT   14    7   38   39   40                                       
CONECT   15    7   41   42   43                                       
CONECT   16    1   44   45   46                                       
CONECT   17   18   22   47   48                                       
CONECT   18   17   19   49   50                                       
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   51                                                 
CONECT   22    6   17   23   23                                       
CONECT   23   22   22                                                 
CONECT   24    2                                                      
CONECT   25    5                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   21                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
