COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.804  -3.931   1.048  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.250  -3.273  -0.175  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.089  -2.643  -0.967  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.778  -1.364  -0.376  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.672  -1.418   0.605  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.739  -2.643   1.534  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.134  -2.935   2.020  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.516  -0.355  -1.411  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.439   1.009  -0.775  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.221   1.495  -0.321  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.172   2.770   0.269  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.332   3.533   0.396  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.524   3.040  -0.057  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.582   1.781  -0.647  1.00  0.00           C  
HETATM   15  O   UNL     1       0.023   0.970  -0.323  1.00  0.00           O  
HETATM   16  C   UNL     1       0.920   1.817   0.235  1.00  0.00           C  
HETATM   17  C   UNL     1       0.236   2.994   0.640  1.00  0.00           C  
HETATM   18  C   UNL     1       2.253   1.581   0.382  1.00  0.00           C  
HETATM   19  C   UNL     1       2.828   0.320  -0.083  1.00  0.00           C  
HETATM   20  C   UNL     1       4.243  -0.092  -0.001  1.00  0.00           C  
HETATM   21  C   UNL     1       4.306  -1.372  -0.572  1.00  0.00           C  
HETATM   22  N   UNL     1       3.032  -1.717  -0.973  1.00  0.00           N  
HETATM   23  C   UNL     1       2.156  -0.724  -0.681  1.00  0.00           C  
HETATM   24  C   UNL     1       5.396   0.510   0.495  1.00  0.00           C  
HETATM   25  C   UNL     1       6.599  -0.157   0.422  1.00  0.00           C  
HETATM   26  C   UNL     1       6.665  -1.422  -0.143  1.00  0.00           C  
HETATM   27  C   UNL     1       5.531  -2.030  -0.637  1.00  0.00           C  
HETATM   28  O   UNL     1       0.712   3.979   1.180  1.00  0.00           O  
HETATM   29  O   UNL     1      -4.770   1.303  -1.099  1.00  0.00           O  
HETATM   30  H   UNL     1      -4.663  -4.386   1.541  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.089  -4.713   0.790  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.750  -4.007  -0.808  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.963  -2.491   0.086  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.216  -3.293  -0.918  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.387  -2.505  -2.007  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.726  -1.440   0.064  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.701  -0.515   1.214  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.366  -3.513   0.994  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.097  -2.466   2.396  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.711  -2.010   2.050  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.089  -3.372   3.017  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.571  -0.580  -1.906  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.323  -0.369  -2.144  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.289   4.512   0.850  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.423   3.631   0.041  1.00  0.00           H  
HETATM   46  H   UNL     1       2.886   2.325   0.842  1.00  0.00           H  
HETATM   47  H   UNL     1       2.794  -2.555  -1.401  1.00  0.00           H  
HETATM   48  H   UNL     1       1.096  -0.747  -0.888  1.00  0.00           H  
HETATM   49  H   UNL     1       5.347   1.495   0.935  1.00  0.00           H  
HETATM   50  H   UNL     1       7.496   0.308   0.805  1.00  0.00           H  
HETATM   51  H   UNL     1       7.613  -1.936  -0.196  1.00  0.00           H  
HETATM   52  H   UNL     1       5.593  -3.015  -1.074  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.270   0.804  -0.438  1.00  0.00           H  
CONECT    1    2    7   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    2    4   34   35                                       
CONECT    4    3    5    8                                            
CONECT    5    4    6   36   37                                       
CONECT    6    5    7   38   39                                       
CONECT    7    1    6   40   41                                       
CONECT    8    4    9   42   43                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   15                                       
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   13   44                                       
CONECT   13   12   14   14   45                                       
CONECT   14    9   13   13   29                                       
CONECT   15   10   16                                                 
CONECT   16   15   17   18   18                                       
CONECT   17   11   16   28   28                                       
CONECT   18   16   16   19   46                                       
CONECT   19   18   20   23   23                                       
CONECT   20   19   21   21   24                                       
CONECT   21   20   20   22   27                                       
CONECT   22   21   23   47                                            
CONECT   23   19   19   22   48                                       
CONECT   24   20   25   25   49                                       
CONECT   25   24   24   26   50                                       
CONECT   26   25   27   27   51                                       
CONECT   27   21   26   26   52                                       
CONECT   28   17   17                                                 
CONECT   29   14   53                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   18                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
