# generated using pymatgen data_Ca2GaAg6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.40184437 _cell_length_b 5.40184505 _cell_length_c 13.94665734 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 117.46931834 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2GaAg6 _chemical_formula_sum 'Ca4 Ga2 Ag12' _cell_volume 361.08066201 _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 0.32672065 0.32672065 0.11635497 1.0 Ca Ca1 1 0.67327935 0.67327935 0.61635497 1.0 Ca Ca2 1 0.32672065 0.32672065 0.38364503 1.0 Ca Ca3 1 0.67327935 0.67327935 0.88364503 1.0 Ga Ga4 1 0.83643132 0.83643132 0.25000000 1.0 Ga Ga5 1 0.16356868 0.16356868 0.75000000 1.0 Ag Ag6 1 0.83227839 0.33719030 0.25000000 1.0 Ag Ag7 1 0.16772161 0.66280970 0.75000000 1.0 Ag Ag8 1 0.33719030 0.83227839 0.25000000 1.0 Ag Ag9 1 0.66280970 0.16772161 0.75000000 1.0 Ag Ag10 1 0.99608471 0.67230481 0.07668462 1.0 Ag Ag11 1 0.00391529 0.32769519 0.57668462 1.0 Ag Ag12 1 0.67230481 0.99608471 0.42331538 1.0 Ag Ag13 1 0.32769519 0.00391529 0.92331538 1.0 Ag Ag14 1 0.00391529 0.32769519 0.92331538 1.0 Ag Ag15 1 0.99608471 0.67230481 0.42331538 1.0 Ag Ag16 1 0.32769519 0.00391529 0.57668462 1.0 Ag Ag17 1 0.67230481 0.99608471 0.07668462 1.0