COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.056  -0.600   1.014  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.098  -0.138  -0.427  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.271  -1.376  -1.204  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.319  -2.405  -0.296  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.193  -1.939   0.991  1.00  0.00           N  
HETATM    6  O   UNL     1      -1.921   0.098   1.996  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.282   0.804  -0.652  1.00  0.00           C  
HETATM    8  C   UNL     1       0.392  -0.346  -0.419  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.576   0.108  -0.225  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.760   1.051  -0.450  1.00  0.00           C  
HETATM   11  C   UNL     1       1.699   0.435  -0.568  1.00  0.00           C  
HETATM   12  C   UNL     1       2.876  -0.463  -0.182  1.00  0.00           C  
HETATM   13  C   UNL     1       2.907  -1.687  -1.099  1.00  0.00           C  
HETATM   14  C   UNL     1       1.600  -2.468  -0.950  1.00  0.00           C  
HETATM   15  C   UNL     1       0.422  -1.570  -1.336  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.064   0.313  -0.140  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.249   1.255  -0.366  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.118   2.469   0.557  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.813   3.206   0.248  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.629   2.264   0.473  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.466  -3.659  -0.612  1.00  0.00           N  
HETATM   22  N   UNL     1       4.128   0.285  -0.324  1.00  0.00           N  
HETATM   23  C   UNL     1       5.210  -0.068   0.398  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.785   0.552  -0.805  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.206  -2.790   2.183  1.00  0.00           C  
HETATM   26  O   UNL     1       5.148  -1.007   1.167  1.00  0.00           O  
HETATM   27  C   UNL     1       6.476   0.688   0.254  1.00  0.00           C  
HETATM   28  C   UNL     1       7.610   0.339   0.993  1.00  0.00           C  
HETATM   29  C   UNL     1       8.769   1.071   0.827  1.00  0.00           C  
HETATM   30  C   UNL     1       6.571   1.768  -0.629  1.00  0.00           C  
HETATM   31  C   UNL     1       7.772   2.442  -0.737  1.00  0.00           C  
HETATM   32  N   UNL     1       8.815   2.086  -0.012  1.00  0.00           N  
HETATM   33  H   UNL     1      -3.144   1.709  -0.061  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.342   1.066  -1.709  1.00  0.00           H  
HETATM   35  H   UNL     1       0.278  -0.670   0.615  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.714  -0.797  -0.816  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.515  -0.153   0.832  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.768   1.383  -1.488  1.00  0.00           H  
HETATM   39  H   UNL     1       1.813   0.759  -1.602  1.00  0.00           H  
HETATM   40  H   UNL     1       1.678   1.307   0.086  1.00  0.00           H  
HETATM   41  H   UNL     1       2.763  -0.786   0.853  1.00  0.00           H  
HETATM   42  H   UNL     1       3.021  -1.363  -2.134  1.00  0.00           H  
HETATM   43  H   UNL     1       3.746  -2.326  -0.824  1.00  0.00           H  
HETATM   44  H   UNL     1       1.621  -3.340  -1.604  1.00  0.00           H  
HETATM   45  H   UNL     1       1.486  -2.792   0.084  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.509  -2.127  -1.230  1.00  0.00           H  
HETATM   47  H   UNL     1       0.536  -1.247  -2.371  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.158  -0.551  -0.798  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.057  -0.019   0.898  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.257   1.587  -1.404  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.178   0.730  -0.145  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.961   3.140   0.397  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.110   2.136   1.595  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.821   3.538  -0.790  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.720   4.071   0.905  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.621   1.932   1.511  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.700   2.789   0.253  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.491  -4.335   0.083  1.00  0.00           H  
HETATM   59  H   UNL     1       4.178   1.035  -0.938  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.767   0.733  -1.880  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.707   1.501  -0.275  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.229  -2.898   2.542  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.803  -3.772   1.933  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.594  -2.334   2.961  1.00  0.00           H  
HETATM   65  H   UNL     1       7.580  -0.491   1.683  1.00  0.00           H  
HETATM   66  H   UNL     1       9.651   0.809   1.394  1.00  0.00           H  
HETATM   67  H   UNL     1       5.719   2.071  -1.219  1.00  0.00           H  
HETATM   68  H   UNL     1       7.854   3.280  -1.413  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.338  -1.451  -2.169  1.00  0.00           H  
CONECT    1    2    6    6    5                                       
CONECT    2   24    7    3    1                                       
CONECT    3    2    4   69                                            
CONECT    4    3    5   21   21                                       
CONECT    5    1    4   25                                            
CONECT    6    1    1                                                 
CONECT    7    2    9   33   34                                       
CONECT    8   11   15   24   35                                       
CONECT    9    7   10   36   37                                       
CONECT   10   20    9   16   38                                       
CONECT   11   12    8   39   40                                       
CONECT   12   22   13   11   41                                       
CONECT   13   12   14   42   43                                       
CONECT   14   13   15   44   45                                       
CONECT   15   14    8   46   47                                       
CONECT   16   10   17   48   49                                       
CONECT   17   18   16   50   51                                       
CONECT   18   19   17   52   53                                       
CONECT   19   20   18   54   55                                       
CONECT   20   19   10   56   57                                       
CONECT   21    4    4   58                                            
CONECT   22   23   12   59                                            
CONECT   23   27   22   26   26                                       
CONECT   24    8    2   60   61                                       
CONECT   25    5   62   63   64                                       
CONECT   26   23   23                                                 
CONECT   27   30   30   28   23                                       
CONECT   28   29   29   27   65                                       
CONECT   29   32   28   28   66                                       
CONECT   30   31   27   27   67                                       
CONECT   31   32   32   30   68                                       
CONECT   32   31   31   29                                            
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69    3                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
