# generated using pymatgen data_Zr3TaOs2O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.70348952 _cell_length_b 8.70348879 _cell_length_c 8.70348906 _cell_angle_alpha 59.99999523 _cell_angle_beta 59.99999798 _cell_angle_gamma 59.99999807 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3TaOs2O _chemical_formula_sum 'Zr12 Ta4 Os8 O4' _cell_volume 466.19235411 _cell_formula_units_Z 4 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 Zr Zr0 1 0.80896518 0.80896518 0.19103482 1.0 Zr Zr1 1 0.19103482 0.19103482 0.80896518 1.0 Zr Zr2 1 0.80896518 0.19103482 0.80896518 1.0 Zr Zr3 1 0.19103482 0.80896518 0.19103482 1.0 Zr Zr4 1 0.19103482 0.80896518 0.80896518 1.0 Zr Zr5 1 0.80896518 0.19103482 0.19103482 1.0 Zr Zr6 1 0.44103482 0.44103482 0.05896518 1.0 Zr Zr7 1 0.05896518 0.05896518 0.44103482 1.0 Zr Zr8 1 0.44103482 0.05896518 0.44103482 1.0 Zr Zr9 1 0.05896518 0.44103482 0.05896518 1.0 Zr Zr10 1 0.05896518 0.44103482 0.44103482 1.0 Zr Zr11 1 0.44103482 0.05896518 0.05896518 1.0 Ta Ta12 1 0.12500000 0.62500000 0.62500000 1.0 Ta Ta13 1 0.62500000 0.12500000 0.62500000 1.0 Ta Ta14 1 0.62500000 0.62500000 0.12500000 1.0 Ta Ta15 1 0.62500000 0.62500000 0.62500000 1.0 Os Os16 1 0.75132300 0.41622500 0.41622500 1.0 Os Os17 1 0.41622500 0.75132300 0.41622500 1.0 Os Os18 1 0.41622500 0.41622500 0.75132300 1.0 Os Os19 1 0.41622500 0.41622500 0.41622500 1.0 Os Os20 1 0.49867700 0.83377500 0.83377500 1.0 Os Os21 1 0.83377500 0.49867700 0.83377500 1.0 Os Os22 1 0.83377500 0.83377500 0.49867700 1.0 Os Os23 1 0.83377500 0.83377500 0.83377500 1.0 O O24 1 0.62500000 0.12500000 0.12500000 1.0 O O25 1 0.12500000 0.62500000 0.12500000 1.0 O O26 1 0.12500000 0.12500000 0.62500000 1.0 O O27 1 0.12500000 0.12500000 0.12500000 1.0