molsysmt.structure.align_principal_axes

molsysmt.structure.align_principal_axes(molecular_system, selection='all', principal_axes_of_selection=None, principal_axes_type='inertia', structure_indices='all', weights=None, axes=[[1, 0, 0], [0, 1, 0], [0, 0, 1]], center=False, syntax='MolSysMT', engine='MolSysMT', in_place=False)