# generated using pymatgen data_Zr3Ge _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.47230215 _cell_length_b 11.10850615 _cell_length_c 11.10821198 _cell_angle_alpha 89.99797412 _cell_angle_beta 89.99944480 _cell_angle_gamma 90.00062318 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Ge _chemical_formula_sum 'Zr24 Ge8' _cell_volume 675.25823185 _cell_formula_units_Z 8 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 0.78344920 0.85627981 0.16807869 1.0 Zr Zr1 1 0.78346577 0.64374219 0.33187464 1.0 Zr Zr2 1 0.28352441 0.66809095 0.14374442 1.0 Zr Zr3 1 0.28354351 0.83193534 0.35622172 1.0 Zr Zr4 1 0.21652785 0.14376731 0.83191074 1.0 Zr Zr5 1 0.21650707 0.35619860 0.66811082 1.0 Zr Zr6 1 0.71649608 0.33188525 0.85624447 1.0 Zr Zr7 1 0.71647476 0.16809718 0.64376640 1.0 Zr Zr8 1 0.97143862 0.22342729 0.11027632 1.0 Zr Zr9 1 0.97144534 0.27655317 0.38970470 1.0 Zr Zr10 1 0.47144408 0.61027058 0.77659824 1.0 Zr Zr11 1 0.47144395 0.88973946 0.72344715 1.0 Zr Zr12 1 0.02855078 0.77656557 0.88973359 1.0 Zr Zr13 1 0.02854670 0.72345017 0.61030913 1.0 Zr Zr14 1 0.52856053 0.38968760 0.22341935 1.0 Zr Zr15 1 0.52855958 0.11030625 0.27654974 1.0 Zr Zr16 1 0.25698698 0.96594228 0.06970624 1.0 Zr Zr17 1 0.25698166 0.53404031 0.43027105 1.0 Zr Zr18 1 0.75694453 0.56968590 0.03405984 1.0 Zr Zr19 1 0.75694293 0.93034429 0.46594081 1.0 Zr Zr20 1 0.74302741 0.03407220 0.93029911 1.0 Zr Zr21 1 0.74304527 0.46591336 0.56972125 1.0 Zr Zr22 1 0.24304227 0.43026455 0.96593913 1.0 Zr Zr23 1 0.24303532 0.06973662 0.53406287 1.0 Ge Ge24 1 0.46322321 0.20856880 0.04534299 1.0 Ge Ge25 1 0.46322591 0.29143049 0.45466066 1.0 Ge Ge26 1 0.96324686 0.54533039 0.79141867 1.0 Ge Ge27 1 0.96325246 0.95467073 0.70857562 1.0 Ge Ge28 1 0.53676801 0.79142295 0.95468297 1.0 Ge Ge29 1 0.53677069 0.70857540 0.54531702 1.0 Ge Ge30 1 0.03676687 0.45467842 0.20858677 1.0 Ge Ge31 1 0.03675740 0.04532359 0.29142387 1.0