# generated using pymatgen data_ScTa2TiPt12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.59755636 _cell_length_b 5.59758136 _cell_length_c 9.17800296 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00025487 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScTa2TiPt12 _chemical_formula_sum 'Sc1 Ta2 Ti1 Pt12' _cell_volume 249.04429593 _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 Sc Sc0 1 0.33333877 0.66668391 0.25000000 1.0 Ta Ta1 1 0.99998161 0.99999265 0.49643418 1.0 Ta Ta2 1 0.99998161 0.99999265 0.00356582 1.0 Ti Ti3 1 0.66669707 0.33337174 0.75000000 1.0 Pt Pt4 1 0.50208266 0.49792648 0.50625053 1.0 Pt Pt5 1 0.50208732 0.00415388 0.50624580 1.0 Pt Pt6 1 0.99583918 0.49791377 0.50624993 1.0 Pt Pt7 1 0.50208266 0.49792648 0.99374947 1.0 Pt Pt8 1 0.50208732 0.00415388 0.99375420 1.0 Pt Pt9 1 0.99583918 0.49791377 0.99375007 1.0 Pt Pt10 1 0.83377258 0.66754326 0.25000000 1.0 Pt Pt11 1 0.33245524 0.16622082 0.25000000 1.0 Pt Pt12 1 0.83376745 0.16621994 0.25000000 1.0 Pt Pt13 1 0.16663346 0.33328359 0.75000000 1.0 Pt Pt14 1 0.66672161 0.83335770 0.75000000 1.0 Pt Pt15 1 0.16663129 0.83334648 0.75000000 1.0