COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.826   2.248  -4.576  1.00  0.00           O  
HETATM    2  C   UNL     1       2.787   0.852  -4.271  1.00  0.00           C  
HETATM    3  C   UNL     1       2.046   0.680  -2.940  1.00  0.00           C  
HETATM    4  N   UNL     1       2.734   1.341  -1.840  1.00  0.00           N  
HETATM    5  C   UNL     1       2.029   1.126  -0.578  1.00  0.00           C  
HETATM    6  C   UNL     1       2.802   1.786   0.570  1.00  0.00           C  
HETATM    7  C   UNL     1       2.055   1.648   1.895  1.00  0.00           C  
HETATM    8  C   UNL     1       0.631   2.189   1.799  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.140   1.543   0.651  1.00  0.00           C  
HETATM   10  C   UNL     1       0.604   1.681  -0.676  1.00  0.00           C  
HETATM   11  C   UNL     1       2.090   0.127  -5.429  1.00  0.00           C  
HETATM   12  N   UNL     1       1.983  -1.299  -5.200  1.00  0.00           N  
HETATM   13  C   UNL     1       0.925  -1.921  -4.571  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.245  -1.377  -4.029  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.157  -2.257  -3.441  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.907  -3.627  -3.396  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.902  -4.540  -2.759  1.00  0.00           C  
HETATM   18  C   UNL     1       0.266  -4.159  -3.942  1.00  0.00           C  
HETATM   19  C   UNL     1       1.202  -3.292  -4.542  1.00  0.00           C  
HETATM   20  C   UNL     1       2.463  -3.474  -5.178  1.00  0.00           C  
HETATM   21  C   UNL     1       2.913  -2.229  -5.563  1.00  0.00           C  
HETATM   22  C   UNL     1       3.254  -4.716  -5.413  1.00  0.00           C  
HETATM   23  C   UNL     1       4.367  -4.478  -6.452  1.00  0.00           C  
HETATM   24  C   UNL     1       5.116  -3.154  -6.209  1.00  0.00           C  
HETATM   25  C   UNL     1       4.180  -1.934  -6.283  1.00  0.00           C  
HETATM   26  H   UNL     1      -1.409  -5.187  -2.024  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.693  -3.974  -2.251  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.394  -5.174  -3.508  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.076  -1.868  -3.010  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.441  -0.310  -4.062  1.00  0.00           H  
HETATM   31  H   UNL     1       0.444  -5.229  -3.898  1.00  0.00           H  
HETATM   32  H   UNL     1       3.705  -5.030  -4.465  1.00  0.00           H  
HETATM   33  H   UNL     1       2.603  -5.529  -5.754  1.00  0.00           H  
HETATM   34  H   UNL     1       5.072  -5.316  -6.428  1.00  0.00           H  
HETATM   35  H   UNL     1       3.928  -4.457  -7.459  1.00  0.00           H  
HETATM   36  H   UNL     1       5.923  -3.040  -6.942  1.00  0.00           H  
HETATM   37  H   UNL     1       5.587  -3.192  -5.218  1.00  0.00           H  
HETATM   38  H   UNL     1       3.951  -1.713  -7.333  1.00  0.00           H  
HETATM   39  H   UNL     1       4.678  -1.056  -5.859  1.00  0.00           H  
HETATM   40  H   UNL     1       2.639   0.266  -6.368  1.00  0.00           H  
HETATM   41  H   UNL     1       1.069   0.493  -5.585  1.00  0.00           H  
HETATM   42  H   UNL     1       3.825   0.510  -4.171  1.00  0.00           H  
HETATM   43  H   UNL     1       2.996   2.313  -5.528  1.00  0.00           H  
HETATM   44  H   UNL     1       1.031   1.086  -3.028  1.00  0.00           H  
HETATM   45  H   UNL     1       1.928  -0.386  -2.713  1.00  0.00           H  
HETATM   46  H   UNL     1       3.680   0.968  -1.763  1.00  0.00           H  
HETATM   47  H   UNL     1       1.979   0.045  -0.398  1.00  0.00           H  
HETATM   48  H   UNL     1       0.046   1.154  -1.460  1.00  0.00           H  
HETATM   49  H   UNL     1       0.630   2.741  -0.962  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.299   0.480   0.871  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.131   2.003   0.568  1.00  0.00           H  
HETATM   52  H   UNL     1       0.663   3.275   1.649  1.00  0.00           H  
HETATM   53  H   UNL     1       0.104   2.011   2.743  1.00  0.00           H  
HETATM   54  H   UNL     1       2.599   2.183   2.682  1.00  0.00           H  
HETATM   55  H   UNL     1       2.025   0.592   2.188  1.00  0.00           H  
HETATM   56  H   UNL     1       2.958   2.852   0.357  1.00  0.00           H  
HETATM   57  H   UNL     1       3.796   1.333   0.666  1.00  0.00           H  
CONECT    1    2   43                                                 
CONECT    2    1   11    3   42                                       
CONECT    3    2    4   44   45                                       
CONECT    4    3    5   46                                            
CONECT    5    4   10    6   47                                       
CONECT    6    5    7   56   57                                       
CONECT    7    6    8   54   55                                       
CONECT    8    7    9   52   53                                       
CONECT    9    8   10   50   51                                       
CONECT   10    5    9   48   49                                       
CONECT   11    2   12   40   41                                       
CONECT   12   11   21   13                                            
CONECT   13   12   14   19   19                                       
CONECT   14   13   15   15   30                                       
CONECT   15   14   14   16   29                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16   26   27   28                                       
CONECT   18   16   16   19   31                                       
CONECT   19   13   13   18   20                                       
CONECT   20   19   22   21   21                                       
CONECT   21   12   20   20   25                                       
CONECT   22   20   23   32   33                                       
CONECT   23   22   24   34   35                                       
CONECT   24   23   25   36   37                                       
CONECT   25   21   24   38   39                                       
CONECT   26   17                                                      
CONECT   27   17                                                      
CONECT   28   17                                                      
CONECT   29   15                                                      
CONECT   30   14                                                      
CONECT   31   18                                                      
CONECT   32   22                                                      
CONECT   33   22                                                      
CONECT   34   23                                                      
CONECT   35   23                                                      
CONECT   36   24                                                      
CONECT   37   24                                                      
CONECT   38   25                                                      
CONECT   39   25                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42    2                                                      
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52    8                                                      
CONECT   53    8                                                      
CONECT   54    7                                                      
CONECT   55    7                                                      
CONECT   56    6                                                      
CONECT   57    6                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
