COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.093  -0.733  -4.013  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.355  -1.605  -4.421  1.00  0.00           O  
HETATM    3  N   UNL     1      -3.385  -0.710  -4.396  1.00  0.00           N  
HETATM    4  O   UNL     1      -3.881  -1.703  -5.275  1.00  0.00           O  
HETATM    5  C   UNL     1      -1.565   0.323  -3.078  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.081   0.068  -2.805  1.00  0.00           C  
HETATM    7  C   UNL     1       0.446   1.125  -1.870  1.00  0.00           C  
HETATM    8  O   UNL     1       0.800   2.199  -2.308  1.00  0.00           O  
HETATM    9  N   UNL     1       0.525   0.877  -0.548  1.00  0.00           N  
HETATM   10  C   UNL     1       0.925   1.941   0.373  1.00  0.00           C  
HETATM   11  C   UNL     1       2.093   1.492   1.211  1.00  0.00           C  
HETATM   12  O   UNL     1       2.261   1.959   2.321  1.00  0.00           O  
HETATM   13  N   UNL     1       2.963   0.567   0.714  1.00  0.00           N  
HETATM   14  C   UNL     1       3.971   0.050   1.668  1.00  0.00           C  
HETATM   15  C   UNL     1       3.949  -1.478   1.615  1.00  0.00           C  
HETATM   16  C   UNL     1       3.362  -2.032   2.914  1.00  0.00           C  
HETATM   17  C   UNL     1       1.930  -2.513   2.670  1.00  0.00           C  
HETATM   18  C   UNL     1       1.064  -2.174   3.884  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.413  -2.213   3.494  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.837  -0.893   3.022  1.00  0.00           N  
HETATM   21  C   UNL     1       0.695   0.117  -4.122  1.00  0.00           C  
HETATM   22  C   UNL     1       2.143  -0.311  -3.877  1.00  0.00           C  
HETATM   23  C   UNL     1       2.873  -0.433  -5.216  1.00  0.00           C  
HETATM   24  C   UNL     1       2.844   0.734  -3.007  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.249   2.304   1.280  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.739   1.092   2.027  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.044  -0.009   2.340  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.092   0.904   2.565  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.092  -0.354   3.193  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.252   1.680   2.559  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.249  -0.800   3.823  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.380   1.219   3.177  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.381  -0.015   3.811  1.00  0.00           C  
HETATM   34  H   UNL     1      -3.975  -0.012  -4.070  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.816  -1.506  -5.420  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.118   0.288  -2.140  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.686   1.305  -3.535  1.00  0.00           H  
HETATM   38  H   UNL     1       0.039  -0.914  -2.348  1.00  0.00           H  
HETATM   39  H   UNL     1       0.315  -0.006  -0.207  1.00  0.00           H  
HETATM   40  H   UNL     1       1.218   2.822  -0.204  1.00  0.00           H  
HETATM   41  H   UNL     1       2.939   0.267  -0.208  1.00  0.00           H  
HETATM   42  H   UNL     1       3.734   0.385   2.676  1.00  0.00           H  
HETATM   43  H   UNL     1       4.960   0.411   1.385  1.00  0.00           H  
HETATM   44  H   UNL     1       4.967  -1.849   1.490  1.00  0.00           H  
HETATM   45  H   UNL     1       3.341  -1.803   0.771  1.00  0.00           H  
HETATM   46  H   UNL     1       3.359  -1.254   3.676  1.00  0.00           H  
HETATM   47  H   UNL     1       3.970  -2.870   3.257  1.00  0.00           H  
HETATM   48  H   UNL     1       1.933  -3.593   2.517  1.00  0.00           H  
HETATM   49  H   UNL     1       1.526  -2.026   1.783  1.00  0.00           H  
HETATM   50  H   UNL     1       1.320  -1.179   4.248  1.00  0.00           H  
HETATM   51  H   UNL     1       1.249  -2.904   4.674  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.009  -2.496   4.363  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.561  -2.947   2.701  1.00  0.00           H  
HETATM   54  H   UNL     1       0.679   1.134  -4.515  1.00  0.00           H  
HETATM   55  H   UNL     1       0.233  -0.557  -4.842  1.00  0.00           H  
HETATM   56  H   UNL     1       2.155  -1.274  -3.367  1.00  0.00           H  
HETATM   57  H   UNL     1       3.904  -0.739  -5.041  1.00  0.00           H  
HETATM   58  H   UNL     1       2.373  -1.178  -5.835  1.00  0.00           H  
HETATM   59  H   UNL     1       2.861   0.530  -5.725  1.00  0.00           H  
HETATM   60  H   UNL     1       2.526   1.731  -3.310  1.00  0.00           H  
HETATM   61  H   UNL     1       2.583   0.571  -1.961  1.00  0.00           H  
HETATM   62  H   UNL     1       3.923   0.644  -3.130  1.00  0.00           H  
HETATM   63  H   UNL     1       0.063   3.068   1.993  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.064   2.703   0.670  1.00  0.00           H  
HETATM   65  H   UNL     1       0.992  -0.187   2.097  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.258   2.641   2.066  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.260  -1.759   4.321  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.277   1.819   3.172  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.278  -0.363   4.302  1.00  0.00           H  
CONECT    1    2    2    3    5                                       
CONECT    2    1    1                                                 
CONECT    3    1    4   34                                            
CONECT    4    3   35                                                 
CONECT    5    1    6   36   37                                       
CONECT    6    5    7   21   38                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   39                                            
CONECT   10    9   11   25   40                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   41                                            
CONECT   14   13   15   42   43                                       
CONECT   15   14   16   44   45                                       
CONECT   16   15   17   46   47                                       
CONECT   17   16   18   48   49                                       
CONECT   18   17   19   50   51                                       
CONECT   19   18   20   52   53                                       
CONECT   20   19   27   29                                            
CONECT   21    6   22   54   55                                       
CONECT   22   21   23   24   56                                       
CONECT   23   22   57   58   59                                       
CONECT   24   22   60   61   62                                       
CONECT   25   10   26   63   64                                       
CONECT   26   25   27   27   28                                       
CONECT   27   20   26   26   65                                       
CONECT   28   26   29   29   30                                       
CONECT   29   20   28   28   31                                       
CONECT   30   28   32   32   66                                       
CONECT   31   29   33   33   67                                       
CONECT   32   30   30   33   68                                       
CONECT   33   31   31   32   69                                       
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   27                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
