COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.176   1.792  -1.216  1.00  0.00           C  
HETATM    2  C   UNL     1       6.077   2.024  -0.411  1.00  0.00           C  
HETATM    3  C   UNL     1       1.217  -0.660   1.337  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.030   1.430   0.125  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.078   0.589  -0.040  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.295   1.320   0.489  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.525   3.724   0.996  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.633   1.114  -0.261  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.043  -0.757  -0.616  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.524  -2.766  -1.357  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.812  -2.669  -0.519  1.00  0.00           C  
HETATM   12  N   UNL     1       3.459  -1.741   1.729  1.00  0.00           N  
HETATM   13  C   UNL     1       4.708  -1.993   0.990  1.00  0.00           C  
HETATM   14  C   UNL     1       4.426  -1.371  -0.393  1.00  0.00           C  
HETATM   15  N   UNL     1       3.059  -0.845  -0.269  1.00  0.00           N  
HETATM   16  C   UNL     1       2.599  -1.080   0.905  1.00  0.00           C  
HETATM   17  C   UNL     1       3.187  -2.137   3.113  1.00  0.00           C  
HETATM   18  C   UNL     1       5.398  -0.257  -0.680  1.00  0.00           C  
HETATM   19  C   UNL     1       6.491  -0.486  -1.494  1.00  0.00           C  
HETATM   20  C   UNL     1       7.384   0.537  -1.758  1.00  0.00           C  
HETATM   21  C   UNL     1       5.188   1.000  -0.143  1.00  0.00           C  
HETATM   22  C   UNL     1       0.516   0.055   0.180  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.826   0.463   0.600  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.428   2.612   0.691  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.768   2.621   0.943  1.00  0.00           N  
HETATM   26  O   UNL     1      -1.217   1.442  -1.354  1.00  0.00           O  
HETATM   27  N   UNL     1      -5.191  -1.435  -0.816  1.00  0.00           N  
HETATM   28  O   UNL     1      -2.977  -1.264  -0.913  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.618  -1.143  -0.582  1.00  0.00           C  
HETATM   30  H   UNL     1       7.871   2.592  -1.426  1.00  0.00           H  
HETATM   31  H   UNL     1       5.912   3.005   0.009  1.00  0.00           H  
HETATM   32  H   UNL     1       0.642  -1.541   1.621  1.00  0.00           H  
HETATM   33  H   UNL     1       1.293   0.015   2.189  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.029   1.461  -0.305  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.735   0.774   1.323  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.532   4.435   0.170  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.857   4.223   1.907  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.514   3.343   1.139  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.847  -3.556  -1.032  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.700  -2.774  -2.433  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.702  -3.020  -1.041  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.715  -3.083   0.484  1.00  0.00           H  
HETATM   43  H   UNL     1       5.549  -1.495   1.472  1.00  0.00           H  
HETATM   44  H   UNL     1       4.893  -3.064   0.900  1.00  0.00           H  
HETATM   45  H   UNL     1       4.473  -2.132  -1.172  1.00  0.00           H  
HETATM   46  H   UNL     1       3.497  -1.339   3.787  1.00  0.00           H  
HETATM   47  H   UNL     1       2.120  -2.322   3.235  1.00  0.00           H  
HETATM   48  H   UNL     1       3.742  -3.046   3.346  1.00  0.00           H  
HETATM   49  H   UNL     1       6.649  -1.464  -1.924  1.00  0.00           H  
HETATM   50  H   UNL     1       8.242   0.356  -2.387  1.00  0.00           H  
HETATM   51  H   UNL     1       4.329   1.181   0.487  1.00  0.00           H  
HETATM   52  H   UNL     1       1.091   0.936  -0.105  1.00  0.00           H  
HETATM   53  H   UNL     1       0.441  -0.621  -0.672  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.135   0.264   1.498  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.954   2.763   1.925  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.115  -0.672  -1.431  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.814  -0.636   0.362  1.00  0.00           H  
CONECT    1   20   20    2   30                                       
CONECT    2    1   21   21   31                                       
CONECT    3   16   22   32   33                                       
CONECT    4   24    5    5    8                                       
CONECT    5    4    4    6    9                                       
CONECT    6    5   25   34   35                                       
CONECT    7   24   36   37   38                                       
CONECT    8   23    4   26   26                                       
CONECT    9    5   27   28   28                                       
CONECT   10   27   11   39   40                                       
CONECT   11   10   29   41   42                                       
CONECT   12   13   16   17                                            
CONECT   13   12   14   43   44                                       
CONECT   14   13   15   18   45                                       
CONECT   15   14   16   16                                            
CONECT   16   12   15   15    3                                       
CONECT   17   12   46   47   48                                       
CONECT   18   14   19   19   21                                       
CONECT   19   18   18   20   49                                       
CONECT   20   19    1    1   50                                       
CONECT   21   18    2    2   51                                       
CONECT   22    3   23   52   53                                       
CONECT   23   22    8   54                                            
CONECT   24    4   25    7                                            
CONECT   25   24    6   55                                            
CONECT   26    8    8                                                 
CONECT   27    9   10   29                                            
CONECT   28    9    9                                                 
CONECT   29   27   11   56   57                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   25                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
