# generated using pymatgen data_NaCa(Si2Pd3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.70256139 _cell_length_b 6.70256119 _cell_length_c 6.70256162 _cell_angle_alpha 129.70277396 _cell_angle_beta 116.05455408 _cell_angle_gamma 85.52455520 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaCa(Si2Pd3)2 _chemical_formula_sum 'Na1 Ca1 Si4 Pd6' _cell_volume 198.98377721 _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 Na Na0 1 0.50000000 0.02241414 0.52241414 1.0 Ca Ca1 1 0.00000000 0.95499392 0.95499392 1.0 Si Si2 1 0.31697458 0.38975534 0.07278077 1.0 Si Si3 1 0.83772140 0.27402107 0.43630067 1.0 Si Si4 1 0.68302542 0.75580519 0.07278077 1.0 Si Si5 1 0.16227860 0.59857927 0.43630067 1.0 Pd Pd6 1 0.95017384 0.49472227 0.94789245 1.0 Pd Pd7 1 0.54682982 0.49472227 0.54454843 1.0 Pd Pd8 1 0.04982616 0.99771761 0.54454843 1.0 Pd Pd9 1 0.72741939 0.50227615 0.22969554 1.0 Pd Pd10 1 0.27258061 0.50227615 0.77485575 1.0 Pd Pd11 1 0.45317018 0.99771761 0.94789245 1.0