# generated using pymatgen data_Er2Ga(BIr2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.50678299 _cell_length_b 5.50678391 _cell_length_c 13.00492702 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000625 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er2Ga(BIr2)3 _chemical_formula_sum 'Er4 Ga2 B6 Ir12' _cell_volume 341.53445308 _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 Er Er0 1 0.00000000 0.00000000 0.00000000 1.0 Er Er1 1 0.00000000 0.00000000 0.50000000 1.0 Er Er2 1 0.00000000 0.00000000 0.74255877 1.0 Er Er3 1 0.00000000 0.00000000 0.25744123 1.0 Ga Ga4 1 0.66666700 0.33333300 0.00000000 1.0 Ga Ga5 1 0.33333300 0.66666700 0.00000000 1.0 B B6 1 0.66666700 0.33333300 0.50000000 1.0 B B7 1 0.33333300 0.66666700 0.50000000 1.0 B B8 1 0.66666700 0.33333300 0.73478359 1.0 B B9 1 0.33333300 0.66666700 0.73478359 1.0 B B10 1 0.33333300 0.66666700 0.26521641 1.0 B B11 1 0.66666700 0.33333300 0.26521641 1.0 Ir Ir12 1 0.50000000 0.50000000 0.84332675 1.0 Ir Ir13 1 0.50000000 0.00000000 0.84332675 1.0 Ir Ir14 1 0.00000000 0.50000000 0.84332675 1.0 Ir Ir15 1 0.50000000 0.50000000 0.15667325 1.0 Ir Ir16 1 0.50000000 0.00000000 0.15667325 1.0 Ir Ir17 1 0.00000000 0.50000000 0.15667325 1.0 Ir Ir18 1 0.50000000 0.50000000 0.61475933 1.0 Ir Ir19 1 0.50000000 0.00000000 0.61475933 1.0 Ir Ir20 1 0.00000000 0.50000000 0.61475933 1.0 Ir Ir21 1 0.50000000 0.50000000 0.38524067 1.0 Ir Ir22 1 0.50000000 0.00000000 0.38524067 1.0 Ir Ir23 1 0.00000000 0.50000000 0.38524067 1.0