# generated using pymatgen data_Zr24Ge3Se5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.00858283 _cell_length_b 11.03349542 _cell_length_c 5.48577608 _cell_angle_alpha 89.91849495 _cell_angle_beta 89.77063158 _cell_angle_gamma 90.01047780 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr24Ge3Se5 _chemical_formula_sum 'Zr24 Ge3 Se5' _cell_volume 666.31360782 _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 Zr Zr0 1 0.91605042 0.60591280 0.54346565 1.0 Zr Zr1 1 0.08443096 0.39516304 0.54075575 1.0 Zr Zr2 1 0.89508016 0.41508600 0.03423824 1.0 Zr Zr3 1 0.10514211 0.58354340 0.03892433 1.0 Zr Zr4 1 0.58351724 0.89646381 0.96026083 1.0 Zr Zr5 1 0.41643177 0.10338328 0.96062453 1.0 Zr Zr6 1 0.60412972 0.08322003 0.46307529 1.0 Zr Zr7 1 0.39646678 0.91641343 0.46140959 1.0 Zr Zr8 1 0.85972302 0.97388238 0.71607610 1.0 Zr Zr9 1 0.13898027 0.02627695 0.71619322 1.0 Zr Zr10 1 0.52828020 0.36089097 0.21231418 1.0 Zr Zr11 1 0.47493521 0.63958083 0.21571316 1.0 Zr Zr12 1 0.63896041 0.52521316 0.78717341 1.0 Zr Zr13 1 0.36048071 0.47418777 0.78350677 1.0 Zr Zr14 1 0.97237577 0.14013750 0.28351801 1.0 Zr Zr15 1 0.02490168 0.85998417 0.28391172 1.0 Zr Zr16 1 0.81642423 0.71537858 0.01240268 1.0 Zr Zr17 1 0.18283548 0.28543265 0.01030607 1.0 Zr Zr18 1 0.78515310 0.31871035 0.51441136 1.0 Zr Zr19 1 0.21441102 0.68204476 0.51003088 1.0 Zr Zr20 1 0.68194488 0.78516413 0.48922590 1.0 Zr Zr21 1 0.31883529 0.21515789 0.48648006 1.0 Zr Zr22 1 0.71449449 0.18161266 0.98641028 1.0 Zr Zr23 1 0.28426889 0.81800518 0.98799539 1.0 Ge Ge24 1 0.29640302 0.46034253 0.28881875 1.0 Ge Ge25 1 0.96046946 0.20451101 0.78918989 1.0 Ge Ge26 1 0.03908750 0.79565905 0.79056073 1.0 Se Se27 1 0.79291056 0.96062799 0.21075693 1.0 Se Se28 1 0.20626395 0.03969751 0.21119064 1.0 Se Se29 1 0.53860836 0.29260591 0.70976601 1.0 Se Se30 1 0.46041278 0.70705978 0.71026955 1.0 Se Se31 1 0.70759356 0.53864848 0.29102509 1.0