# generated using pymatgen data_Zr2TaNbSi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64846672 _cell_length_b 6.99134575 _cell_length_c 8.48605842 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2TaNbSi2 _chemical_formula_sum 'Zr4 Ta2 Nb2 Si4' _cell_volume 216.45976702 _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 Zr Zr0 1 0.25000000 0.04322459 0.33263576 1.0 Zr Zr1 1 0.25000000 0.54322459 0.16736424 1.0 Zr Zr2 1 0.75000000 0.95512585 0.66722718 1.0 Zr Zr3 1 0.75000000 0.45512585 0.83277282 1.0 Ta Ta4 1 0.75000000 0.86921179 0.05941336 1.0 Ta Ta5 1 0.75000000 0.36921179 0.44058664 1.0 Nb Nb6 1 0.25000000 0.13341622 0.94089103 1.0 Nb Nb7 1 0.25000000 0.63341622 0.55910897 1.0 Si Si8 1 0.25000000 0.25275796 0.63797833 1.0 Si Si9 1 0.25000000 0.75275796 0.86202167 1.0 Si Si10 1 0.75000000 0.74626359 0.35876521 1.0 Si Si11 1 0.75000000 0.24626359 0.14123479 1.0