COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.496  -0.709  -0.875  1.00  0.00           N  
HETATM    2  C   UNL     1       5.279   0.542   0.459  1.00  0.00           C  
HETATM    3  C   UNL     1       5.350  -1.307  -0.724  1.00  0.00           C  
HETATM    4  C   UNL     1       3.259  -0.869   0.505  1.00  0.00           C  
HETATM    5  C   UNL     1       7.598   1.409  -0.060  1.00  0.00           C  
HETATM    6  C   UNL     1       2.304  -1.218  -0.438  1.00  0.00           C  
HETATM    7  C   UNL     1       1.012  -1.518  -0.035  1.00  0.00           C  
HETATM    8  C   UNL     1       4.818   1.656   1.364  1.00  0.00           C  
HETATM    9  C   UNL     1       0.677  -1.468   1.311  1.00  0.00           C  
HETATM   10  C   UNL     1       1.630  -1.119   2.249  1.00  0.00           C  
HETATM   11  C   UNL     1       9.797   2.182  -0.582  1.00  0.00           C  
HETATM   12  C   UNL     1      11.017   1.759  -1.403  1.00  0.00           C  
HETATM   13  C   UNL     1       6.493   0.443  -0.157  1.00  0.00           C  
HETATM   14  N   UNL     1       4.565  -0.559   0.100  1.00  0.00           N  
HETATM   15  O   UNL     1       7.474   2.409   0.620  1.00  0.00           O  
HETATM   16  O   UNL     1       8.750   1.186  -0.725  1.00  0.00           O  
HETATM   17  C   UNL     1       2.919  -0.820   1.850  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.194   0.792  -0.043  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.353  -0.378   0.134  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.275   1.516   0.648  1.00  0.00           N  
HETATM   21  C   UNL     1      -5.617  -0.402  -0.369  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.180   0.822   0.754  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.402  -1.403   0.032  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.563   1.216  -0.374  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.743  -2.704   0.376  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.806  -3.715   0.275  1.00  0.00           C  
HETATM   27  O   UNL     1      -8.294   0.474  -1.001  1.00  0.00           O  
HETATM   28  O   UNL     1      -8.008   2.427   0.017  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.258  -1.529  -1.137  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.120  -1.119  -0.417  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.527  -3.433  -0.167  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.182  -2.135  -0.516  1.00  0.00           C  
HETATM   33  O   UNL     1       0.073  -1.860  -0.956  1.00  0.00           O  
HETATM   34  C   UNL     1      -9.369   2.778  -0.345  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.692   4.178   0.181  1.00  0.00           C  
HETATM   36  H   UNL     1       5.067  -2.245  -1.179  1.00  0.00           H  
HETATM   37  H   UNL     1       2.566  -1.257  -1.485  1.00  0.00           H  
HETATM   38  H   UNL     1       4.335   2.431   0.769  1.00  0.00           H  
HETATM   39  H   UNL     1       4.109   1.262   2.092  1.00  0.00           H  
HETATM   40  H   UNL     1       5.677   2.079   1.885  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.329  -1.701   1.626  1.00  0.00           H  
HETATM   42  H   UNL     1       1.367  -1.080   3.296  1.00  0.00           H  
HETATM   43  H   UNL     1      10.077   2.267   0.467  1.00  0.00           H  
HETATM   44  H   UNL     1       9.434   3.145  -0.941  1.00  0.00           H  
HETATM   45  H   UNL     1      11.803   2.506  -1.296  1.00  0.00           H  
HETATM   46  H   UNL     1      11.380   0.796  -1.044  1.00  0.00           H  
HETATM   47  H   UNL     1      10.737   1.673  -2.453  1.00  0.00           H  
HETATM   48  H   UNL     1       3.662  -0.548   2.585  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.279   1.144   1.254  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.741  -2.927   0.722  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.073  -4.726   0.543  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.070  -1.396  -2.202  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.835  -2.478  -0.809  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.333  -1.528  -0.955  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.854  -0.108  -0.689  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.797  -4.225  -0.244  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.472   2.765  -1.430  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.059   2.057   0.094  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.590   4.191   1.266  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.002   4.899  -0.258  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.714   4.441  -0.091  1.00  0.00           H  
CONECT    1   13    3    3                                            
CONECT    2   13   13   14    8                                       
CONECT    3   14    1    1   36                                       
CONECT    4   14    6    6   17                                       
CONECT    5   13   15   15   16                                       
CONECT    6    4    4    7   37                                       
CONECT    7    6    9    9   33                                       
CONECT    8    2   38   39   40                                       
CONECT    9    7    7   10   41                                       
CONECT   10   17   17    9   42                                       
CONECT   11   16   12   43   44                                       
CONECT   12   11   45   46   47                                       
CONECT   13    1    2    2    5                                       
CONECT   14    2    3    4                                            
CONECT   15    5    5                                                 
CONECT   16    5   11                                                 
CONECT   17    4   10   10   48                                       
CONECT   18   20   21   21   24                                       
CONECT   19   21   22   23                                            
CONECT   20   18   22   22                                            
CONECT   21   18   18   19   29                                       
CONECT   22   19   20   20   49                                       
CONECT   23   19   25   25   30                                       
CONECT   24   18   27   27   28                                       
CONECT   25   23   23   26   50                                       
CONECT   26   25   31   31   51                                       
CONECT   27   24   24                                                 
CONECT   28   24   34                                                 
CONECT   29   21   52   53   54                                       
CONECT   30   23   32   32   55                                       
CONECT   31   26   26   32   56                                       
CONECT   32   30   30   31   33                                       
CONECT   33    7   32                                                 
CONECT   34   28   35   57   58                                       
CONECT   35   34   59   60   61                                       
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   17                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
