# generated using pymatgen data_Ca2Ac3Pb4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92567622 _cell_length_b 8.40559687 _cell_length_c 8.99540799 _cell_angle_alpha 71.69032955 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Ac3Pb4 _chemical_formula_sum 'Ca4 Ac6 Pb8' _cell_volume 640.71838320 _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 0.00007357 0.99516815 0.00184825 1.0 Ca Ca1 1 0.16879751 0.75462702 0.74493755 1.0 Ca Ca2 1 0.66879751 0.74537298 0.25506245 1.0 Ca Ca3 1 0.50007357 0.50483185 0.99815175 1.0 Ac Ac4 1 0.31730432 0.06111306 0.31234958 1.0 Ac Ac5 1 0.18601554 0.57007724 0.30858748 1.0 Ac Ac6 1 0.81730432 0.43888694 0.68765042 1.0 Ac Ac7 1 0.32892104 0.25410502 0.74490045 1.0 Ac Ac8 1 0.68601554 0.92992276 0.69141252 1.0 Ac Ac9 1 0.82892104 0.24589498 0.25509955 1.0 Pb Pb10 1 0.87407509 0.63693644 0.98705296 1.0 Pb Pb11 1 0.96089535 0.83777397 0.42344371 1.0 Pb Pb12 1 0.12975071 0.37267101 0.00916079 1.0 Pb Pb13 1 0.53416686 0.35563013 0.41569432 1.0 Pb Pb14 1 0.37407509 0.86306356 0.01294704 1.0 Pb Pb15 1 0.46089535 0.66222603 0.57655629 1.0 Pb Pb16 1 0.03416686 0.14436987 0.58430568 1.0 Pb Pb17 1 0.62975071 0.12732899 0.99083921 1.0