# generated using pymatgen data_CaNd4Ga2Bi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.14810847 _cell_length_b 9.14810794 _cell_length_c 9.14810766 _cell_angle_alpha 127.12649705 _cell_angle_beta 127.12649120 _cell_angle_gamma 78.04440901 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaNd4Ga2Bi _chemical_formula_sum 'Ca2 Nd8 Ga4 Bi2' _cell_volume 471.57332637 _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 0.50000000 0.50000000 0.00000000 1.0 Ca Ca1 1 0.00000000 0.00000000 0.00000000 1.0 Nd Nd2 1 0.52085631 0.02085631 0.82642875 1.0 Nd Nd3 1 0.19442656 0.69442656 0.17357125 1.0 Nd Nd4 1 0.02085631 0.19442656 0.50000000 1.0 Nd Nd5 1 0.69442656 0.52085631 0.50000000 1.0 Nd Nd6 1 0.47914369 0.97914369 0.17357125 1.0 Nd Nd7 1 0.80557344 0.30557344 0.82642875 1.0 Nd Nd8 1 0.97914369 0.80557344 0.50000000 1.0 Nd Nd9 1 0.30557344 0.47914369 0.50000000 1.0 Ga Ga10 1 0.87451134 0.37451134 0.24902068 1.0 Ga Ga11 1 0.12548866 0.62548866 0.75097932 1.0 Ga Ga12 1 0.37451134 0.12548866 0.50000000 1.0 Ga Ga13 1 0.62548866 0.87451134 0.50000000 1.0 Bi Bi14 1 0.25000000 0.25000000 0.00000000 1.0 Bi Bi15 1 0.75000000 0.75000000 0.00000000 1.0