COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.072  -2.222   0.147  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.240  -1.341   0.372  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.882  -0.224  -0.411  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.105   0.654  -0.173  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.316   1.483  -0.250  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.256   0.835   0.449  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.461  -0.461   0.614  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.524  -1.449   0.877  1.00  0.00           C  
HETATM    9  O   UNL     1       4.351  -0.821  -1.706  1.00  0.00           O  
HETATM   10  C   UNL     1       4.094  -0.415  -0.593  1.00  0.00           C  
HETATM   11  N   UNL     1       5.074   0.085   0.185  1.00  0.00           N  
HETATM   12  C   UNL     1       6.459   0.145  -0.301  1.00  0.00           C  
HETATM   13  C   UNL     1       6.972   1.581  -0.153  1.00  0.00           C  
HETATM   14  C   UNL     1       6.795   2.034   1.298  1.00  0.00           C  
HETATM   15  C   UNL     1       5.309   2.012   1.664  1.00  0.00           C  
HETATM   16  C   UNL     1       4.776   0.587   1.534  1.00  0.00           C  
HETATM   17  C   UNL     1       2.678  -0.469  -0.080  1.00  0.00           C  
HETATM   18  C   UNL     1       1.770  -1.075  -1.152  1.00  0.00           C  
HETATM   19  C   UNL     1       0.354  -1.130  -0.639  1.00  0.00           C  
HETATM   20  O   UNL     1       0.718  -3.112   0.401  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.324  -2.302   0.624  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.515  -0.129  -0.931  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.087   1.046  -1.773  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.819   0.775  -0.680  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.469   2.798  -0.970  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.670   1.318   0.644  1.00  0.00           C  
HETATM   27  O   UNL     1      -5.758  -0.309   0.952  1.00  0.00           O  
HETATM   28  H   UNL     1      -3.798  -2.305   1.476  1.00  0.00           H  
HETATM   29  H   UNL     1       7.082  -0.529   0.288  1.00  0.00           H  
HETATM   30  H   UNL     1       6.491  -0.151  -1.349  1.00  0.00           H  
HETATM   31  H   UNL     1       8.028   1.619  -0.420  1.00  0.00           H  
HETATM   32  H   UNL     1       6.406   2.239  -0.812  1.00  0.00           H  
HETATM   33  H   UNL     1       7.342   1.361   1.958  1.00  0.00           H  
HETATM   34  H   UNL     1       7.182   3.047   1.412  1.00  0.00           H  
HETATM   35  H   UNL     1       5.182   2.358   2.690  1.00  0.00           H  
HETATM   36  H   UNL     1       4.759   2.667   0.988  1.00  0.00           H  
HETATM   37  H   UNL     1       3.698   0.585   1.695  1.00  0.00           H  
HETATM   38  H   UNL     1       5.260  -0.050   2.275  1.00  0.00           H  
HETATM   39  H   UNL     1       2.640  -1.085   0.819  1.00  0.00           H  
HETATM   40  H   UNL     1       2.338   0.539   0.156  1.00  0.00           H  
HETATM   41  H   UNL     1       1.807  -0.460  -2.050  1.00  0.00           H  
HETATM   42  H   UNL     1       2.110  -2.084  -1.388  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.926   1.731  -1.895  1.00  0.00           H  
HETATM   44  H   UNL     1       0.737   1.564  -1.282  1.00  0.00           H  
HETATM   45  H   UNL     1       0.238   0.692  -2.751  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.548   1.629  -1.282  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.218   3.614  -0.292  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.799   2.821  -1.830  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.499   2.909  -1.308  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.299   0.934  -0.160  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.047   0.960   1.602  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.687   2.407   0.630  1.00  0.00           H  
CONECT    1   19   21   20   20                                       
CONECT    2    3    3    8   21                                       
CONECT    3   24   22    2    2                                       
CONECT    4    5   24   24    7                                       
CONECT    5   25    6    6    4                                       
CONECT    6   26    5    5   27                                       
CONECT    7    4   27    8    8                                       
CONECT    8    7    7    2   28                                       
CONECT    9   10   10                                                 
CONECT   10    9    9   17   11                                       
CONECT   11   10   12   16                                            
CONECT   12   11   13   29   30                                       
CONECT   13   12   14   31   32                                       
CONECT   14   13   15   33   34                                       
CONECT   15   14   16   35   36                                       
CONECT   16   11   15   37   38                                       
CONECT   17   10   18   39   40                                       
CONECT   18   17   19   41   42                                       
CONECT   19   22   22   18    1                                       
CONECT   20    1    1                                                 
CONECT   21    2    1                                                 
CONECT   22   23    3   19   19                                       
CONECT   23   22   43   44   45                                       
CONECT   24    4    4    3   46                                       
CONECT   25    5   47   48   49                                       
CONECT   26    6   50   51   52                                       
CONECT   27    6    7                                                 
CONECT   28    8                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
