# generated using pymatgen data_CeReH9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.93534637 _cell_length_b 4.93534639 _cell_length_c 8.85376584 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999985 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeReH9 _chemical_formula_sum 'Ce2 Re2 H18' _cell_volume 186.76433285 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ce Ce0 1 0.00000000 0.00000000 0.00000000 1.0 Ce Ce1 1 0.00000000 0.00000000 0.50000000 1.0 Re Re2 1 0.33333300 0.66666700 0.25000000 1.0 Re Re3 1 0.66666700 0.33333300 0.75000000 1.0 H H4 1 0.47568075 0.52431925 0.38626381 1.0 H H5 1 0.47568075 0.95136150 0.38626381 1.0 H H6 1 0.04863850 0.52431925 0.38626381 1.0 H H7 1 0.95136150 0.47568075 0.88626381 1.0 H H8 1 0.13457347 0.26914694 0.25000000 1.0 H H9 1 0.86542653 0.13457347 0.75000000 1.0 H H10 1 0.26914694 0.13457347 0.75000000 1.0 H H11 1 0.73085306 0.86542653 0.25000000 1.0 H H12 1 0.13457347 0.86542653 0.25000000 1.0 H H13 1 0.86542653 0.73085306 0.75000000 1.0 H H14 1 0.47568075 0.95136150 0.11373619 1.0 H H15 1 0.52431925 0.47568075 0.61373619 1.0 H H16 1 0.95136150 0.47568075 0.61373619 1.0 H H17 1 0.04863850 0.52431925 0.11373619 1.0 H H18 1 0.47568075 0.52431925 0.11373619 1.0 H H19 1 0.52431925 0.04863850 0.88626381 1.0 H H20 1 0.52431925 0.47568075 0.88626381 1.0 H H21 1 0.52431925 0.04863850 0.61373619 1.0