# generated using pymatgen data_Ca5Pd2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.67744998 _cell_length_b 7.71543536 _cell_length_c 8.91467393 _cell_angle_alpha 96.80180831 _cell_angle_beta 111.99466532 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Pd2 _chemical_formula_sum 'Ca10 Pd4' _cell_volume 422.36378493 _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 0.98267414 0.91757354 0.18179829 1.0 Ca Ca1 1 0.80087686 0.58242646 0.81820171 1.0 Ca Ca2 1 0.01732586 0.08242646 0.81820171 1.0 Ca Ca3 1 0.19912314 0.41757354 0.18179829 1.0 Ca Ca4 1 0.63672538 0.82035811 0.43363236 1.0 Ca Ca5 1 0.20309302 0.67964189 0.56636764 1.0 Ca Ca6 1 0.36327462 0.17964189 0.56636764 1.0 Ca Ca7 1 0.79690698 0.32035811 0.43363236 1.0 Ca Ca8 1 0.42338116 0.75000000 0.00000000 1.0 Ca Ca9 1 0.57661884 0.25000000 1.00000000 1.0 Pd Pd10 1 0.81914122 0.58183796 0.22120409 1.0 Pd Pd11 1 0.59793813 0.91816204 0.77879591 1.0 Pd Pd12 1 0.18085878 0.41816204 0.77879591 1.0 Pd Pd13 1 0.40206187 0.08183796 0.22120409 1.0