[CP2K-user] Orientation of the xyz content in unit cell

[Monu Joy]

Hi there
How does the orientation of a molecule in a given unit cell for a CELL_OPT calculation...? If the initial geometry is reading from a CIF, then no concerns at all but since we are using xyz format and providing lattice parameters and symmetry in the input file, does the xyz content fit exactly in the given cell as it is expected...? Maybe it's a dumb question but a little curious! 
Thanks in advance!
-Monu
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