COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.243  -1.028   0.121  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.535  -0.688  -0.050  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.739   0.781   0.215  1.00  0.00           C  
HETATM    4  C   UNL     1       5.727  -1.008  -0.029  1.00  0.00           C  
HETATM    5  C   UNL     1       4.405  -0.524  -0.467  1.00  0.00           C  
HETATM    6  C   UNL     1       4.309   0.444  -1.477  1.00  0.00           C  
HETATM    7  C   UNL     1       1.918   0.395  -1.296  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.617   2.899  -0.460  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.112   3.484   0.705  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.413   2.695   1.620  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.231   1.351   1.369  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.468   4.915   0.688  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.307   4.002  -1.223  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.436  -1.507   0.844  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.629  -2.281   1.609  1.00  0.00           C  
HETATM   16  C   UNL     1       0.780  -2.008   1.257  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.679  -1.932  -0.291  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.028  -2.506  -1.385  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.760  -2.933  -2.473  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.137  -2.794  -2.482  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.789  -2.225  -1.402  1.00  0.00           C  
HETATM   22  O   UNL     1       5.816  -1.939   0.941  1.00  0.00           O  
HETATM   23  O   UNL     1       6.736  -0.567  -0.542  1.00  0.00           O  
HETATM   24  O   UNL     1       1.743  -2.545   1.767  1.00  0.00           O  
HETATM   25  C   UNL     1      -2.901  -1.472   0.879  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.476  -1.063   1.870  1.00  0.00           O  
HETATM   27  C   UNL     1       2.005  -0.569  -0.297  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.068  -1.789  -0.310  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.430   1.558  -0.701  1.00  0.00           C  
HETATM   30  C   UNL     1       3.062   0.894  -1.885  1.00  0.00           C  
HETATM   31  N   UNL     1       0.839  -1.077   0.287  1.00  0.00           N  
HETATM   32  O   UNL     1      -1.046  -3.162   2.546  1.00  0.00           O  
HETATM   33  O   UNL     1      -1.178   5.713   1.558  1.00  0.00           O  
HETATM   34  O   UNL     1      -2.158   5.209  -0.426  1.00  0.00           O  
HETATM   35  O   UNL     1       5.433   0.940  -2.053  1.00  0.00           O  
HETATM   36  H   UNL     1       3.309  -1.777   0.896  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.742  -0.912  -1.097  1.00  0.00           H  
HETATM   38  H   UNL     1       0.950   0.749  -1.618  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.018   3.135   2.524  1.00  0.00           H  
HETATM   40  H   UNL     1       0.310   0.740   2.076  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.835   4.136  -2.196  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.364   3.765  -1.348  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.954  -2.615  -1.379  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.258  -3.377  -3.320  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.706  -3.130  -3.337  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.864  -2.119  -1.416  1.00  0.00           H  
HETATM   47  H   UNL     1       6.704  -2.225   1.195  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.578  -1.343   0.532  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.822   1.111  -1.602  1.00  0.00           H  
HETATM   50  H   UNL     1       2.986   1.640  -2.662  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.327  -3.628   2.995  1.00  0.00           H  
HETATM   52  H   UNL     1       5.790   1.722  -1.611  1.00  0.00           H  
CONECT    1    5    5   27   36                                       
CONECT    2   31    3   14   37                                       
CONECT    3   29   29    2   11                                       
CONECT    4   23   23    5   22                                       
CONECT    5    6    4    1    1                                       
CONECT    6   35   30   30    5                                       
CONECT    7   30   27   27   38                                       
CONECT    8   13   29    9    9                                       
CONECT    9    8    8   12   10                                       
CONECT   10    9   11   11   39                                       
CONECT   11    3   10   10   40                                       
CONECT   12   34    9   33   33                                       
CONECT   13   34    8   41   42                                       
CONECT   14    2   15   15   25                                       
CONECT   15   16   14   14   32                                       
CONECT   16   31   24   24   15                                       
CONECT   17   18   25   28   28                                       
CONECT   18   19   19   17   43                                       
CONECT   19   18   18   20   44                                       
CONECT   20   19   21   21   45                                       
CONECT   21   20   20   28   46                                       
CONECT   22    4   47                                                 
CONECT   23    4    4                                                 
CONECT   24   16   16                                                 
CONECT   25   14   17   26   26                                       
CONECT   26   25   25                                                 
CONECT   27    7    7    1   31                                       
CONECT   28   17   17   21   48                                       
CONECT   29    8    3    3   49                                       
CONECT   30    6    6    7   50                                       
CONECT   31   27   16    2                                            
CONECT   32   15   51                                                 
CONECT   33   12   12                                                 
CONECT   34   13   12                                                 
CONECT   35    6   52                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    7                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
CONECT   51   32                                                      
CONECT   52   35                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
