COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.878   3.939  -0.065  1.00  0.00           C  
HETATM    2  C   UNL     1       3.913   0.352  -0.031  1.00  0.00           C  
HETATM    3  C   UNL     1       2.807   1.389  -0.064  1.00  0.00           C  
HETATM    4  C   UNL     1       2.912   2.326   1.141  1.00  0.00           C  
HETATM    5  C   UNL     1       2.853   2.183  -1.370  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.919   0.188   0.091  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.213   0.674   0.094  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.955  -1.569   0.372  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.151  -2.286   1.022  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.593  -3.387   0.036  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.328  -3.669  -0.812  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.442   2.046   0.015  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.713  -2.258  -0.987  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.374   2.927  -0.065  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.080   2.450  -0.068  1.00  0.00           C  
HETATM   16  C   UNL     1       0.157   1.076   0.016  1.00  0.00           C  
HETATM   17  C   UNL     1       1.540   0.563   0.013  1.00  0.00           C  
HETATM   18  C   UNL     1       3.967  -2.133   0.110  1.00  0.00           C  
HETATM   19  C   UNL     1       3.595  -2.848   1.411  1.00  0.00           C  
HETATM   20  C   UNL     1       3.538  -2.990  -1.083  1.00  0.00           C  
HETATM   21  N   UNL     1       1.901  -0.678   0.075  1.00  0.00           N  
HETATM   22  N   UNL     1       3.283  -0.838   0.052  1.00  0.00           N  
HETATM   23  O   UNL     1      -3.715   2.522   0.017  1.00  0.00           O  
HETATM   24  O   UNL     1       5.109   0.550  -0.074  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.262  -0.188   0.172  1.00  0.00           O  
HETATM   26  H   UNL     1      -4.940   4.184  -0.054  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.388   4.411   0.786  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.431   4.303  -0.990  1.00  0.00           H  
HETATM   29  H   UNL     1       3.865   2.855   1.108  1.00  0.00           H  
HETATM   30  H   UNL     1       2.095   3.046   1.113  1.00  0.00           H  
HETATM   31  H   UNL     1       2.852   1.743   2.061  1.00  0.00           H  
HETATM   32  H   UNL     1       2.752   1.501  -2.214  1.00  0.00           H  
HETATM   33  H   UNL     1       2.036   2.905  -1.386  1.00  0.00           H  
HETATM   34  H   UNL     1       3.805   2.710  -1.442  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.740  -0.876   0.152  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.072  -1.667   1.004  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.848  -2.733   1.969  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.965  -1.581   1.186  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.898  -4.283   0.576  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.406  -3.029  -0.596  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.643  -4.326  -0.276  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.598  -4.095  -1.778  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.220  -1.717  -1.785  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.645  -2.331  -1.193  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.556   3.990  -0.125  1.00  0.00           H  
HETATM   46  H   UNL     1       0.749   3.139  -0.132  1.00  0.00           H  
HETATM   47  H   UNL     1       5.045  -1.976   0.076  1.00  0.00           H  
HETATM   48  H   UNL     1       4.104  -3.811   1.454  1.00  0.00           H  
HETATM   49  H   UNL     1       3.901  -2.237   2.260  1.00  0.00           H  
HETATM   50  H   UNL     1       2.517  -3.004   1.444  1.00  0.00           H  
HETATM   51  H   UNL     1       2.460  -3.146  -1.050  1.00  0.00           H  
HETATM   52  H   UNL     1       3.803  -2.480  -2.010  1.00  0.00           H  
HETATM   53  H   UNL     1       4.047  -3.953  -1.040  1.00  0.00           H  
CONECT    1   23   26   27   28                                       
CONECT    2   24   24   22    3                                       
CONECT    3    5    2   17    4                                       
CONECT    4    3   29   30   31                                       
CONECT    5    3   32   33   34                                       
CONECT    6   16   16    7   35                                       
CONECT    7    6   25   12   12                                       
CONECT    8   13    9   25   36                                       
CONECT    9   10    8   37   38                                       
CONECT   10   11    9   39   40                                       
CONECT   11   10   13   41   42                                       
CONECT   12    7    7   14   23                                       
CONECT   13   11    8   43   44                                       
CONECT   14   15   15   12   45                                       
CONECT   15   16   14   14   46                                       
CONECT   16   17    6    6   15                                       
CONECT   17    3   21   21   16                                       
CONECT   18   19   22   20   47                                       
CONECT   19   18   48   49   50                                       
CONECT   20   18   51   52   53                                       
CONECT   21   22   17   17                                            
CONECT   22    2   18   21                                            
CONECT   23   12    1                                                 
CONECT   24    2    2                                                 
CONECT   25    8    7                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
