# generated using pymatgen data_Ca2Nd8Ga5Sb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.09957925 _cell_length_b 9.09957867 _cell_length_c 9.09957830 _cell_angle_alpha 127.76943114 _cell_angle_beta 127.76942276 _cell_angle_gamma 76.99884381 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Nd8Ga5Sb _chemical_formula_sum 'Ca2 Nd8 Ga5 Sb1' _cell_volume 457.01436488 _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 0.49840432 0.49840432 1.00000000 1.0 Ca Ca1 1 0.00159568 0.00159568 0.00000000 1.0 Nd Nd2 1 0.52998978 0.01933680 0.84100721 1.0 Nd Nd3 1 0.17832859 0.68898156 0.15899279 1.0 Nd Nd4 1 0.01933680 0.17832859 0.48934702 1.0 Nd Nd5 1 0.68898156 0.52998978 0.51065298 1.0 Nd Nd6 1 0.48066320 0.97001022 0.15899279 1.0 Nd Nd7 1 0.81101844 0.32167141 0.84100721 1.0 Nd Nd8 1 0.97001022 0.81101844 0.48934702 1.0 Nd Nd9 1 0.32167141 0.48066320 0.51065298 1.0 Ga Ga10 1 0.75000000 0.75000000 0.00000000 1.0 Ga Ga11 1 0.88184379 0.38184379 0.26368658 1.0 Ga Ga12 1 0.11815621 0.61815621 0.73631342 1.0 Ga Ga13 1 0.38184379 0.11815621 0.50000000 1.0 Ga Ga14 1 0.61815621 0.88184379 0.50000000 1.0 Sb Sb15 1 0.25000000 0.25000000 0.00000000 1.0