# generated using pymatgen data_Ca(Ac2Ru)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37271992 _cell_length_b 9.37272051 _cell_length_c 7.65125630 _cell_angle_alpha 84.67302709 _cell_angle_beta 84.67302393 _cell_angle_gamma 43.62411131 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca(Ac2Ru)2 _chemical_formula_sum 'Ca2 Ac8 Ru4' _cell_volume 461.40587232 _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 0.00193997 0.81150319 0.90213868 1.0 Ca Ca1 1 0.18849681 0.99806003 0.59786132 1.0 Ac Ac2 1 0.99597990 0.19057019 0.09451386 1.0 Ac Ac3 1 0.80942981 0.00402010 0.40548614 1.0 Ac Ac4 1 0.35910325 0.21563534 0.81940721 1.0 Ac Ac5 1 0.78436466 0.64089675 0.68059279 1.0 Ac Ac6 1 0.64308422 0.78524868 0.18089311 1.0 Ac Ac7 1 0.21475132 0.35691578 0.31910689 1.0 Ac Ac8 1 0.56120464 0.43879536 0.75000000 1.0 Ac Ac9 1 0.42757313 0.57242687 0.25000000 1.0 Ru Ru10 1 0.17841642 0.59095712 0.55781318 1.0 Ru Ru11 1 0.40904288 0.82158358 0.94218682 1.0 Ru Ru12 1 0.82214495 0.39553395 0.42625894 1.0 Ru Ru13 1 0.60446605 0.17785505 0.07374106 1.0