# generated using pymatgen data_Ca5Yb(TmBi3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.12022806 _cell_length_b 8.31981418 _cell_length_c 8.32718276 _cell_angle_alpha 109.97385206 _cell_angle_beta 108.98476261 _cell_angle_gamma 108.94591578 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Yb(TmBi3)2 _chemical_formula_sum 'Ca5 Yb1 Tm2 Bi6' _cell_volume 435.73589795 _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 Ca Ca0 1 0.50102194 0.99982078 0.64501021 1.0 Ca Ca1 1 0.35576357 0.35474275 0.35536671 1.0 Ca Ca2 1 0.50187248 0.00040570 0.14552249 1.0 Ca Ca3 1 0.00122808 0.64531670 0.50032477 1.0 Ca Ca4 1 0.85596782 0.85504054 0.85493278 1.0 Yb Yb5 1 0.00103563 0.14476370 0.49978219 1.0 Tm Tm6 1 0.14069982 0.49953384 0.99941522 1.0 Tm Tm7 1 0.64121479 0.50003165 0.99999550 1.0 Bi Bi8 1 0.37577988 0.61995962 0.75801783 1.0 Bi Bi9 1 0.87732625 0.25863584 0.12227935 1.0 Bi Bi10 1 0.61948030 0.74279803 0.36300075 1.0 Bi Bi11 1 0.11782572 0.86350155 0.24209794 1.0 Bi Bi12 1 0.25463118 0.13738384 0.87733960 1.0 Bi Bi13 1 0.75615054 0.37806746 0.63691566 1.0