# generated using pymatgen data_Tb7Yb(ZrIr3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.82042566 _cell_length_b 10.78892576 _cell_length_c 6.26673296 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.39329262 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb7Yb(ZrIr3)2 _chemical_formula_sum 'Tb14 Yb2 Zr4 Ir12' _cell_volume 731.56599104 _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 Tb Tb0 1 0.71057615 0.08451451 0.87848481 1.0 Tb Tb1 1 0.71057615 0.91548549 0.37848481 1.0 Tb Tb2 1 0.58328571 0.79046256 0.87466127 1.0 Tb Tb3 1 0.58328571 0.20953744 0.37466127 1.0 Tb Tb4 1 0.41221184 0.79298329 0.37517047 1.0 Tb Tb5 1 0.41221184 0.20701671 0.87517047 1.0 Tb Tb6 1 0.21163380 0.41406397 0.62830122 1.0 Tb Tb7 1 0.21163380 0.58593603 0.12830122 1.0 Tb Tb8 1 0.78865873 0.41265593 0.12515313 1.0 Tb Tb9 1 0.78865873 0.58734407 0.62515313 1.0 Tb Tb10 1 0.91359009 0.71181051 0.12654568 1.0 Tb Tb11 1 0.91359009 0.28818949 0.62654568 1.0 Tb Tb12 1 0.08740426 0.71114873 0.62703501 1.0 Tb Tb13 1 0.08740426 0.28885127 0.12703501 1.0 Yb Yb14 1 0.28815350 0.08605317 0.37235905 1.0 Yb Yb15 1 0.28815350 0.91394683 0.87235905 1.0 Zr Zr16 1 0.00315008 0.00005382 0.49608900 1.0 Zr Zr17 1 0.00315008 0.99994618 0.99608900 1.0 Zr Zr18 1 0.49982328 0.49920892 0.99749160 1.0 Zr Zr19 1 0.49982328 0.50079108 0.49749160 1.0 Ir Ir20 1 0.85915419 0.14329744 0.24835324 1.0 Ir Ir21 1 0.85915419 0.85670256 0.74835324 1.0 Ir Ir22 1 0.14154315 0.14834685 0.75099987 1.0 Ir Ir23 1 0.14154315 0.85165315 0.25099987 1.0 Ir Ir24 1 0.64173543 0.35550562 0.74944773 1.0 Ir Ir25 1 0.64173543 0.64449438 0.24944773 1.0 Ir Ir26 1 0.35634634 0.35923914 0.24594332 1.0 Ir Ir27 1 0.35634634 0.64076086 0.74594332 1.0 Ir Ir28 1 0.50285364 0.00007076 0.12202883 1.0 Ir Ir29 1 0.50285364 0.99992924 0.62202883 1.0 Ir Ir30 1 0.99988181 0.50014132 0.88193576 1.0 Ir Ir31 1 0.99988181 0.49985868 0.38193576 1.0