Fixed a Bug in molecule.py -> reoriented_molecule #180
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The first collumn and not row should be multiplied with -1, otherwise it destroys the rotation along cartesian coordinates.
Setchatuan
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The first collumn and not row should be multiplied with -1, otherwise it fails the rotation along cartesian coordinates. Affects estimation of box volume (overestimation if the molecule is wrong aligned) and therefore the density of initial random molecular crystals (underestimated).