# generated using pymatgen data_Zr5Ge4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.25376080 _cell_length_b 7.25376080 _cell_length_c 13.21204157 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5Ge4 _chemical_formula_sum 'Zr20 Ge16' _cell_volume 695.17859566 _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 0.82870581 0.17129319 0.75000000 1.0 Zr Zr1 1 0.17129319 0.82870581 0.25000000 1.0 Zr Zr2 1 0.67129419 0.67129419 0.50000000 1.0 Zr Zr3 1 0.32870681 0.32870681 0.00000000 1.0 Zr Zr4 1 0.99957432 0.34452410 0.53106406 1.0 Zr Zr5 1 0.00042568 0.65547590 0.03106406 1.0 Zr Zr6 1 0.84452410 0.50042568 0.28106406 1.0 Zr Zr7 1 0.15547590 0.49957432 0.78106406 1.0 Zr Zr8 1 0.65547590 0.00042568 0.96893594 1.0 Zr Zr9 1 0.34452410 0.99957432 0.46893594 1.0 Zr Zr10 1 0.50042568 0.84452410 0.71893594 1.0 Zr Zr11 1 0.49957432 0.15547590 0.21893594 1.0 Zr Zr12 1 0.50175109 0.34656056 0.62342545 1.0 Zr Zr13 1 0.49824891 0.65343944 0.12342545 1.0 Zr Zr14 1 0.84656056 0.99824891 0.37342545 1.0 Zr Zr15 1 0.15343944 0.00175109 0.87342545 1.0 Zr Zr16 1 0.65343944 0.49824891 0.87657455 1.0 Zr Zr17 1 0.34656056 0.50175109 0.37657455 1.0 Zr Zr18 1 0.99824891 0.84656056 0.62657455 1.0 Zr Zr19 1 0.00175109 0.15343944 0.12657455 1.0 Ge Ge20 1 0.64098258 0.29897665 0.42237949 1.0 Ge Ge21 1 0.35901742 0.70102335 0.92237949 1.0 Ge Ge22 1 0.79897665 0.85901742 0.17237949 1.0 Ge Ge23 1 0.20102335 0.14098258 0.67237949 1.0 Ge Ge24 1 0.70102335 0.35901742 0.07762051 1.0 Ge Ge25 1 0.29897665 0.64098258 0.57762051 1.0 Ge Ge26 1 0.85901742 0.79897665 0.82762051 1.0 Ge Ge27 1 0.14098258 0.20102335 0.32762051 1.0 Ge Ge28 1 0.69718138 0.03909506 0.56621981 1.0 Ge Ge29 1 0.30281862 0.96090494 0.06621981 1.0 Ge Ge30 1 0.53909506 0.80281862 0.31621981 1.0 Ge Ge31 1 0.46090494 0.19718138 0.81621981 1.0 Ge Ge32 1 0.96090494 0.30281862 0.93378019 1.0 Ge Ge33 1 0.03909506 0.69718138 0.43378019 1.0 Ge Ge34 1 0.80281862 0.53909506 0.68378019 1.0 Ge Ge35 1 0.19718138 0.46090494 0.18378019 1.0