COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.321   1.594  -0.459  1.00  0.00           C  
HETATM    2  C   UNL     1       9.006   2.236  -0.012  1.00  0.00           C  
HETATM    3  C   UNL     1       7.837   1.337  -0.419  1.00  0.00           C  
HETATM    4  C   UNL     1       6.522   1.979   0.029  1.00  0.00           C  
HETATM    5  C   UNL     1       5.352   1.080  -0.378  1.00  0.00           C  
HETATM    6  C   UNL     1       4.056   1.712   0.063  1.00  0.00           C  
HETATM    7  O   UNL     1       4.068   2.773   0.642  1.00  0.00           O  
HETATM    8  O   UNL     1       2.890   1.097  -0.189  1.00  0.00           O  
HETATM    9  C   UNL     1       1.682   1.764   0.264  1.00  0.00           C  
HETATM   10  C   UNL     1       0.463   0.919  -0.109  1.00  0.00           C  
HETATM   11  O   UNL     1       0.503  -0.337   0.618  1.00  0.00           O  
HETATM   12  C   UNL     1       1.139  -1.362   0.028  1.00  0.00           C  
HETATM   13  O   UNL     1       1.645  -1.214  -1.059  1.00  0.00           O  
HETATM   14  C   UNL     1       1.222  -2.697   0.723  1.00  0.00           C  
HETATM   15  C   UNL     1       1.993  -3.682  -0.158  1.00  0.00           C  
HETATM   16  C   UNL     1       2.077  -5.038   0.547  1.00  0.00           C  
HETATM   17  C   UNL     1       2.848  -6.023  -0.333  1.00  0.00           C  
HETATM   18  C   UNL     1       2.932  -7.379   0.372  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.815   1.678   0.256  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.033   0.890  -0.230  1.00  0.00           C  
HETATM   21  P   UNL     1      -3.555   1.794   0.205  1.00  0.00           P  
HETATM   22  O   UNL     1      -3.695   1.858   1.742  1.00  0.00           O1-
HETATM   23  O   UNL     1      -3.482   3.229  -0.365  1.00  0.00           O  
HETATM   24  O   UNL     1      -4.828   1.033  -0.420  1.00  0.00           O  
HETATM   25  C   UNL     1      -6.159   1.549  -0.343  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.122   0.582  -1.033  1.00  0.00           C  
HETATM   27  N   UNL     1      -7.182  -0.674  -0.273  1.00  0.00           N1+
HETATM   28  C   UNL     1      -7.527  -0.385   1.125  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.205  -1.552  -0.858  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.875  -1.342  -0.327  1.00  0.00           C  
HETATM   31  H   UNL     1      10.430   0.619   0.016  1.00  0.00           H  
HETATM   32  H   UNL     1      10.316   1.471  -1.542  1.00  0.00           H  
HETATM   33  H   UNL     1      11.155   2.234  -0.170  1.00  0.00           H  
HETATM   34  H   UNL     1       9.012   2.358   1.071  1.00  0.00           H  
HETATM   35  H   UNL     1       8.898   3.210  -0.488  1.00  0.00           H  
HETATM   36  H   UNL     1       7.831   1.215  -1.502  1.00  0.00           H  
HETATM   37  H   UNL     1       7.945   0.362   0.057  1.00  0.00           H  
HETATM   38  H   UNL     1       6.527   2.101   1.112  1.00  0.00           H  
HETATM   39  H   UNL     1       6.413   2.954  -0.447  1.00  0.00           H  
HETATM   40  H   UNL     1       5.346   0.958  -1.461  1.00  0.00           H  
HETATM   41  H   UNL     1       5.460   0.105   0.098  1.00  0.00           H  
HETATM   42  H   UNL     1       1.720   1.889   1.346  1.00  0.00           H  
HETATM   43  H   UNL     1       1.607   2.742  -0.212  1.00  0.00           H  
HETATM   44  H   UNL     1       0.473   0.720  -1.181  1.00  0.00           H  
HETATM   45  H   UNL     1       1.739  -2.579   1.675  1.00  0.00           H  
HETATM   46  H   UNL     1       0.216  -3.077   0.900  1.00  0.00           H  
HETATM   47  H   UNL     1       1.476  -3.800  -1.110  1.00  0.00           H  
HETATM   48  H   UNL     1       2.999  -3.302  -0.335  1.00  0.00           H  
HETATM   49  H   UNL     1       2.594  -4.920   1.500  1.00  0.00           H  
HETATM   50  H   UNL     1       1.071  -5.418   0.724  1.00  0.00           H  
HETATM   51  H   UNL     1       2.331  -6.141  -1.286  1.00  0.00           H  
HETATM   52  H   UNL     1       3.854  -5.643  -0.510  1.00  0.00           H  
HETATM   53  H   UNL     1       3.449  -7.261   1.325  1.00  0.00           H  
HETATM   54  H   UNL     1       1.926  -7.759   0.549  1.00  0.00           H  
HETATM   55  H   UNL     1       3.482  -8.081  -0.255  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.869   1.800   1.337  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.803   2.659  -0.220  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.979   0.768  -1.312  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.044  -0.090   0.246  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.445   1.663   0.703  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.201   2.519  -0.839  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.116   1.028  -1.077  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.770   0.378  -2.044  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.497   0.111   1.165  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.571  -1.316   1.689  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.768   0.267   1.559  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.949  -1.767  -1.896  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.249  -2.484  -0.294  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.175  -1.056  -0.818  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.157  -0.785   0.276  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.968  -2.355   0.063  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.529  -1.380  -1.360  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3    5   38   39                                       
CONECT    5    4    6   40   41                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9                                                 
CONECT    9    8   10   42   43                                       
CONECT   10    9   11   19   44                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   45   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   15   17   49   50                                       
CONECT   17   16   18   51   52                                       
CONECT   18   17   53   54   55                                       
CONECT   19   10   20   56   57                                       
CONECT   20   19   21   58   59                                       
CONECT   21   20   22   23   23                                       
CONECT   21   24                                                      
CONECT   22   21                                                      
CONECT   23   21   21                                                 
CONECT   24   21   25                                                 
CONECT   25   24   26   60   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   26   28   29   30                                       
CONECT   28   27   64   65   66                                       
CONECT   29   27   67   68   69                                       
CONECT   30   27   70   71   72                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   20                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
