# generated using pymatgen data_Ba4Ga8Ir7Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.17814784 _cell_length_b 8.52141525 _cell_length_c 8.52207407 _cell_angle_alpha 76.98458602 _cell_angle_beta 90.31325293 _cell_angle_gamma 89.67713734 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4Ga8Ir7Ru _chemical_formula_sum 'Ba4 Ga8 Ir7 Ru1' _cell_volume 437.11428228 _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 Ba Ba0 1 0.87477657 0.50055327 0.75088634 1.0 Ba Ba1 1 0.37501710 0.00087146 0.25060377 1.0 Ba Ba2 1 0.62493701 0.99843872 0.74837230 1.0 Ba Ba3 1 0.12516371 0.50053819 0.25052702 1.0 Ga Ga4 1 0.87469093 0.81965030 0.42749381 1.0 Ga Ga5 1 0.12552224 0.82372197 0.92747493 1.0 Ga Ga6 1 0.62935441 0.32477806 0.42792039 1.0 Ga Ga7 1 0.12418204 0.17739968 0.57358449 1.0 Ga Ga8 1 0.62087241 0.67795560 0.07473646 1.0 Ga Ga9 1 0.87312616 0.17643386 0.07299667 1.0 Ga Ga10 1 0.37559000 0.67738592 0.56976809 1.0 Ga Ga11 1 0.37683793 0.32311904 0.92642759 1.0 Ir Ir12 1 0.87595276 0.11930242 0.37219952 1.0 Ir Ir13 1 0.12503491 0.87879631 0.62894935 1.0 Ir Ir14 1 0.12500965 0.12241086 0.87226056 1.0 Ir Ir15 1 0.37482836 0.37740854 0.62854608 1.0 Ir Ir16 1 0.37395031 0.62238613 0.86940462 1.0 Ir Ir17 1 0.87509104 0.87859310 0.12761461 1.0 Ir Ir18 1 0.62496751 0.37900446 0.12899216 1.0 Ru Ru19 1 0.62509695 0.62125409 0.37124124 1.0