# generated using pymatgen data_RbZr2(H6Ir)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.67932694 _cell_length_b 4.67932802 _cell_length_c 9.43116342 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999236 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbZr2(H6Ir)2 _chemical_formula_sum 'Rb1 Zr2 H12 Ir2' _cell_volume 178.83924020 _cell_formula_units_Z 1 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 Rb Rb0 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr1 1 0.66666700 0.33333300 0.38523298 1.0 Zr Zr2 1 0.33333300 0.66666700 0.61476702 1.0 H H3 1 0.16570986 0.83429014 0.40149488 1.0 H H4 1 0.66857929 0.83429014 0.40149488 1.0 H H5 1 0.16570986 0.33142071 0.40149488 1.0 H H6 1 0.83429014 0.16570986 0.59850512 1.0 H H7 1 0.33142071 0.16570986 0.59850512 1.0 H H8 1 0.83429014 0.66857929 0.59850512 1.0 H H9 1 0.49728579 0.99457158 0.80881015 1.0 H H10 1 0.49728579 0.50271421 0.80881015 1.0 H H11 1 0.00542842 0.50271421 0.80881015 1.0 H H12 1 0.50271421 0.00542842 0.19118985 1.0 H H13 1 0.50271421 0.49728579 0.19118985 1.0 H H14 1 0.99457158 0.49728579 0.19118985 1.0 Ir Ir15 1 0.66666700 0.33333300 0.70837942 1.0 Ir Ir16 1 0.33333300 0.66666700 0.29162058 1.0