COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.321   1.264  -0.179  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.944   1.111  -0.337  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.102   0.799  -0.666  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.333  -1.586  -0.381  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.125   0.147   0.043  1.00  0.00           C  
HETATM    6  C   UNL     1       1.260   0.646  -0.817  1.00  0.00           C  
HETATM    7  C   UNL     1       1.030  -1.733  -0.539  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.174  -1.272  -0.053  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.907  -0.318  -0.444  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.372  -0.156  -0.274  1.00  0.00           C  
HETATM   11  C   UNL     1       1.652  -3.104  -0.471  1.00  0.00           C  
HETATM   12  C   UNL     1       1.829  -0.619  -0.754  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.403  -2.307   0.342  1.00  0.00           C  
HETATM   14  C   UNL     1       6.019  -0.723  -0.374  1.00  0.00           C  
HETATM   15  C   UNL     1       5.975   0.140   0.891  1.00  0.00           C  
HETATM   16  C   UNL     1       5.363   0.045  -1.525  1.00  0.00           C  
HETATM   17  C   UNL     1       4.522   0.513   1.195  1.00  0.00           C  
HETATM   18  C   UNL     1       3.934   0.422  -1.128  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.578  -3.336   0.728  1.00  0.00           C  
HETATM   20  C   UNL     1       4.475   1.425   2.423  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.903  -3.413   0.397  1.00  0.00           O  
HETATM   22  O   UNL     1       3.963   1.197   0.072  1.00  0.00           O  
HETATM   23  O   UNL     1       7.377  -1.017  -0.707  1.00  0.00           O  
HETATM   24  O   UNL     1       6.519  -0.595   1.990  1.00  0.00           O  
HETATM   25  O   UNL     1       6.112   1.232  -1.796  1.00  0.00           O  
HETATM   26  O   UNL     1       3.114   1.678   2.776  1.00  0.00           O  
HETATM   27  O   UNL     1       3.171  -0.767  -0.910  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.227   3.585  -0.434  1.00  0.00           O  
HETATM   29  C   UNL     1      -4.928   2.612  -0.241  1.00  0.00           C  
HETATM   30  N   UNL     1      -6.258   2.760  -0.082  1.00  0.00           N  
HETATM   31  C   UNL     1      -6.859   4.094  -0.143  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.552  -1.121   0.106  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.734  -2.161   0.495  1.00  0.00           N  
HETATM   34  H   UNL     1      -2.321   1.977  -0.509  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.545   1.783  -0.715  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.954  -2.453  -0.209  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.192   0.265   0.166  1.00  0.00           H  
HETATM   38  H   UNL     1       1.884   1.511  -0.985  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.730  -2.255  -0.004  1.00  0.00           H  
HETATM   40  H   UNL     1       1.927  -3.328   0.559  1.00  0.00           H  
HETATM   41  H   UNL     1       0.936  -3.845  -0.826  1.00  0.00           H  
HETATM   42  H   UNL     1       2.542  -3.130  -1.099  1.00  0.00           H  
HETATM   43  H   UNL     1       5.477  -1.653  -0.200  1.00  0.00           H  
HETATM   44  H   UNL     1       6.559   1.047   0.734  1.00  0.00           H  
HETATM   45  H   UNL     1       5.340  -0.583  -2.416  1.00  0.00           H  
HETATM   46  H   UNL     1       3.948  -0.392   1.392  1.00  0.00           H  
HETATM   47  H   UNL     1       3.476   1.005  -1.927  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.484  -4.024  -0.112  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.261  -3.835   1.644  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.617  -3.023   0.826  1.00  0.00           H  
HETATM   51  H   UNL     1       4.982   0.938   3.256  1.00  0.00           H  
HETATM   52  H   UNL     1       4.973   2.367   2.195  1.00  0.00           H  
HETATM   53  H   UNL     1       7.479  -1.556  -1.503  1.00  0.00           H  
HETATM   54  H   UNL     1       7.440  -0.864   1.865  1.00  0.00           H  
HETATM   55  H   UNL     1       5.753   1.768  -2.516  1.00  0.00           H  
HETATM   56  H   UNL     1       3.008   2.251   3.548  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.818   1.982   0.072  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.659   4.539  -1.118  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.936   4.015   0.006  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.429   4.722   0.638  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.134  -1.278   0.451  1.00  0.00           H  
CONECT    1    2   29    5    5                                       
CONECT    2   10   10    1   34                                       
CONECT    3    6    6    9   35                                       
CONECT    4    7    9    9   36                                       
CONECT    5    1    1   32   37                                       
CONECT    6   12    3    3   38                                       
CONECT    7   11   12   12    4                                       
CONECT    8   10   32   32   39                                       
CONECT    9    4    4    3   10                                       
CONECT   10    9    2    2    8                                       
CONECT   11    7   40   41   42                                       
CONECT   12   27    7    7    6                                       
CONECT   13   32   33   21   21                                       
CONECT   14   15   23   16   43                                       
CONECT   15   24   17   14   44                                       
CONECT   16   14   25   18   45                                       
CONECT   17   20   15   22   46                                       
CONECT   18   22   16   27   47                                       
CONECT   19   33   48   49   50                                       
CONECT   20   26   17   51   52                                       
CONECT   21   13   13                                                 
CONECT   22   17   18                                                 
CONECT   23   14   53                                                 
CONECT   24   15   54                                                 
CONECT   25   16   55                                                 
CONECT   26   20   56                                                 
CONECT   27   18   12                                                 
CONECT   28   29   29                                                 
CONECT   29   30   28   28    1                                       
CONECT   30   31   29   57                                            
CONECT   31   30   58   59   60                                       
CONECT   32    8    8    5   13                                       
CONECT   33   13   19   61                                            
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   30                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
