COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.148   0.573   1.641  1.00  0.00           C  
HETATM    2  C   UNL     1       6.209   1.538   1.955  1.00  0.00           C  
HETATM    3  C   UNL     1       4.931   1.459   1.433  1.00  0.00           C  
HETATM    4  N   UNL     1       0.624   1.207  -0.369  1.00  0.00           N  
HETATM    5  C   UNL     1       4.590   0.410   0.592  1.00  0.00           C  
HETATM    6  C   UNL     1       2.294   0.233   1.133  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.833   1.141  -2.210  1.00  0.00           N  
HETATM    8  C   UNL     1       0.905   0.065   0.513  1.00  0.00           C  
HETATM    9  C   UNL     1       1.626   1.303  -1.439  1.00  0.00           C  
HETATM   10  C   UNL     1       3.016   1.470  -0.819  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.651   1.127  -0.891  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.097   0.971  -1.906  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.053   1.064  -2.711  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.923   0.955  -0.587  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.880  -0.288   1.160  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.698   1.033  -0.079  1.00  0.00           N  
HETATM   17  N   UNL     1       3.297   0.328   0.062  1.00  0.00           N  
HETATM   18  C   UNL     1       5.676  -3.628  -1.763  1.00  0.00           C  
HETATM   19  O   UNL     1       5.208  -1.593  -0.547  1.00  0.00           O  
HETATM   20  C   UNL     1       6.230  -2.552  -0.827  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.030  -0.280   2.169  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.362  -0.353   1.418  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.456   0.825   0.444  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.264   0.785  -0.515  1.00  0.00           C  
HETATM   25  C   UNL     1       5.537  -0.562   0.276  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.437  -1.648   0.651  1.00  0.00           C  
HETATM   27  C   UNL     1       6.815  -0.476   0.803  1.00  0.00           C  
HETATM   28  N   UNL     1      -4.014   0.859   0.253  1.00  0.00           N  
HETATM   29  O   UNL     1      -7.523  -1.930  -0.086  1.00  0.00           O  
HETATM   30  O   UNL     1      -5.520  -2.433   0.699  1.00  0.00           O  
HETATM   31  H   UNL     1       8.147   0.641   2.048  1.00  0.00           H  
HETATM   32  H   UNL     1       6.475   2.355   2.609  1.00  0.00           H  
HETATM   33  H   UNL     1       4.200   2.214   1.680  1.00  0.00           H  
HETATM   34  H   UNL     1       2.317   1.142   1.734  1.00  0.00           H  
HETATM   35  H   UNL     1       2.517  -0.627   1.764  1.00  0.00           H  
HETATM   36  H   UNL     1       0.156   0.024   1.304  1.00  0.00           H  
HETATM   37  H   UNL     1       0.874  -0.857  -0.067  1.00  0.00           H  
HETATM   38  H   UNL     1       1.604   0.394  -2.040  1.00  0.00           H  
HETATM   39  H   UNL     1       1.404   2.163  -2.070  1.00  0.00           H  
HETATM   40  H   UNL     1       3.764   1.512  -1.610  1.00  0.00           H  
HETATM   41  H   UNL     1       3.046   2.393  -0.240  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.198   1.077  -3.781  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.930  -0.222   1.691  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.909  -1.213   0.584  1.00  0.00           H  
HETATM   45  H   UNL     1       5.347  -3.166  -2.694  1.00  0.00           H  
HETATM   46  H   UNL     1       6.456  -4.359  -1.977  1.00  0.00           H  
HETATM   47  H   UNL     1       4.832  -4.126  -1.286  1.00  0.00           H  
HETATM   48  H   UNL     1       6.559  -3.014   0.104  1.00  0.00           H  
HETATM   49  H   UNL     1       7.074  -2.054  -1.304  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.939  -1.140   2.833  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.993   0.638   2.756  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.186  -0.303   2.130  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.383   0.755  -0.124  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.442   1.761   1.003  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.287  -0.145  -1.083  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.320   1.631  -1.200  1.00  0.00           H  
HETATM   57  H   UNL     1       7.552  -1.225   0.557  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.525  -2.773  -0.561  1.00  0.00           H  
CONECT    1    2    2   27   31                                       
CONECT    2    3    1    1   32                                       
CONECT    3    5    5    2   33                                       
CONECT    4   11    9    8                                            
CONECT    5   17    3    3   25                                       
CONECT    6    8   17   34   35                                       
CONECT    7   13   13   11                                            
CONECT    8    4    6   36   37                                       
CONECT    9    4   10   38   39                                       
CONECT   10    9   17   40   41                                       
CONECT   11   16   16    7    4                                       
CONECT   12   14   14   13                                            
CONECT   13   12    7    7   42                                       
CONECT   14   28   12   12   16                                       
CONECT   15   21   28   43   44                                       
CONECT   16   14   11   11                                            
CONECT   17   10    6    5                                            
CONECT   18   20   45   46   47                                       
CONECT   19   25   20                                                 
CONECT   20   19   18   48   49                                       
CONECT   21   22   15   50   51                                       
CONECT   22   26   23   21   52                                       
CONECT   23   22   24   53   54                                       
CONECT   24   23   28   55   56                                       
CONECT   25    5   19   27   27                                       
CONECT   26   30   30   29   22                                       
CONECT   27   25   25    1   57                                       
CONECT   28   24   15   14                                            
CONECT   29   26   58                                                 
CONECT   30   26   26                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   27                                                      
CONECT   58   29                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
