# generated using pymatgen data_Ca2NdGa8Ag3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.31102040 _cell_length_b 8.35866727 _cell_length_c 8.35866801 _cell_angle_alpha 71.77743740 _cell_angle_beta 75.05584705 _cell_angle_gamma 75.05585529 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2NdGa8Ag3 _chemical_formula_sum 'Ca2 Nd1 Ga8 Ag3' _cell_volume 271.21374826 _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 0.30595242 0.69404758 0.69404758 1.0 Ca Ca1 1 0.69404758 0.30595242 0.30595242 1.0 Nd Nd2 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga3 1 0.33710500 0.29301430 0.03277569 1.0 Ga Ga4 1 0.66289500 0.70698570 0.96722431 1.0 Ga Ga5 1 0.33710500 0.03277569 0.29301430 1.0 Ga Ga6 1 0.66289500 0.96722431 0.70698570 1.0 Ga Ga7 1 0.14113532 0.58204761 0.13568175 1.0 Ga Ga8 1 0.85886468 0.41795239 0.86431825 1.0 Ga Ga9 1 0.14113532 0.13568175 0.58204761 1.0 Ga Ga10 1 0.85886468 0.86431825 0.41795239 1.0 Ag Ag11 1 0.50000000 0.29890004 0.70109996 1.0 Ag Ag12 1 0.50000000 0.70109996 0.29890004 1.0 Ag Ag13 1 0.00000000 0.50000000 0.50000000 1.0