# generated using pymatgen data_Ca2Yb3AgBi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.26178302 _cell_length_b 9.26178310 _cell_length_c 7.10655601 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000315 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Yb3AgBi3 _chemical_formula_sum 'Ca4 Yb6 Ag2 Bi6' _cell_volume 527.93324302 _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 Ca Ca0 1 0.33333300 0.66666700 0.50000000 1.0 Ca Ca1 1 0.66666700 0.33333300 0.50000000 1.0 Ca Ca2 1 0.66666700 0.33333300 0.00000000 1.0 Ca Ca3 1 0.33333300 0.66666700 0.00000000 1.0 Yb Yb4 1 0.25946343 0.25946343 0.75000000 1.0 Yb Yb5 1 0.74053657 0.74053657 0.25000000 1.0 Yb Yb6 1 0.25946343 1.00000000 0.25000000 1.0 Yb Yb7 1 0.00000000 0.74053657 0.75000000 1.0 Yb Yb8 1 1.00000000 0.25946343 0.25000000 1.0 Yb Yb9 1 0.74053657 0.00000000 0.75000000 1.0 Ag Ag10 1 0.00000000 0.00000000 0.00000000 1.0 Ag Ag11 1 0.00000000 0.00000000 0.50000000 1.0 Bi Bi12 1 0.38725129 1.00000000 0.75000000 1.0 Bi Bi13 1 0.61274871 0.00000000 0.25000000 1.0 Bi Bi14 1 0.61274871 0.61274871 0.75000000 1.0 Bi Bi15 1 0.00000000 0.61274871 0.25000000 1.0 Bi Bi16 1 1.00000000 0.38725129 0.75000000 1.0 Bi Bi17 1 0.38725129 0.38725129 0.25000000 1.0