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Coordinates

To view the coordinates we have to go to a different input panel. The input panels can be selected with the pull-down menu on the top of the input panels on the right side.

In the right side of the ADFinput window: 
click and hold on the pull-down menu on the top, currently named 'Main Options'

Select the Coordinates panel

You get a list of all Cartesian coordinates. They will be updated in real time when you make changes to the molecule, and you can also edit the values yourself. In that case, the picture of the molecule will be updated automatically.

Note that some atoms are highlighted. These are the currently selected atoms.

The 'Move Atom(s)' buttons will move the selected atoms up or down. In this way you can re-order the atoms.

You may, in some cases, wish to revert to Internal coordinates. These will be updated in real time as well, and you can also edit the values yourself. If you re-order the atoms while using the Internal coordinates, the matrix will be recalculated from scratch.

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