# generated using pymatgen data_Er3Zr5(Nb3Si4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93655339 _cell_length_b 6.93900847 _cell_length_c 12.80800960 _cell_angle_alpha 90.00274498 _cell_angle_beta 90.01548232 _cell_angle_gamma 90.06518770 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er3Zr5(Nb3Si4)4 _chemical_formula_sum 'Er3 Zr5 Nb12 Si16' _cell_volume 616.48497751 _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 Er Er0 1 0.99777114 0.33954860 0.21810036 1.0 Er Er1 1 0.00219431 0.66082442 0.71847955 1.0 Er Er2 1 0.16106645 0.49806957 0.46776971 1.0 Zr Zr3 1 0.49768319 0.84108835 0.03207642 1.0 Zr Zr4 1 0.84161085 0.49792954 0.96682422 1.0 Zr Zr5 1 0.50465422 0.15576558 0.53306111 1.0 Zr Zr6 1 0.34428188 0.00413539 0.78408042 1.0 Zr Zr7 1 0.65639184 0.99567945 0.28221403 1.0 Nb Nb8 1 0.17079619 0.16946808 0.99973019 1.0 Nb Nb9 1 0.82655323 0.83252115 0.49962566 1.0 Nb Nb10 1 0.33222529 0.67351335 0.24867908 1.0 Nb Nb11 1 0.66851435 0.32716313 0.75092830 1.0 Nb Nb12 1 0.15362022 0.99734039 0.37610936 1.0 Nb Nb13 1 0.84614963 0.00311458 0.87756501 1.0 Nb Nb14 1 0.50350109 0.65348168 0.62726959 1.0 Nb Nb15 1 0.34867936 0.49373381 0.87490804 1.0 Nb Nb16 1 0.49728625 0.34944209 0.12479072 1.0 Nb Nb17 1 0.65107775 0.50753504 0.37325021 1.0 Nb Nb18 1 0.99260733 0.15116274 0.62436312 1.0 Nb Nb19 1 0.00521370 0.84916116 0.12241592 1.0 Si Si20 1 0.29941369 0.04559610 0.18638466 1.0 Si Si21 1 0.70101908 0.95380793 0.68792289 1.0 Si Si22 1 0.45455801 0.79910220 0.43698267 1.0 Si Si23 1 0.20281950 0.54611720 0.06226699 1.0 Si Si24 1 0.54580239 0.20195172 0.93747269 1.0 Si Si25 1 0.79364482 0.45451786 0.56260799 1.0 Si Si26 1 0.04514519 0.29411846 0.81323109 1.0 Si Si27 1 0.95400489 0.70704550 0.31209091 1.0 Si Si28 1 0.36966776 0.29052101 0.31992238 1.0 Si Si29 1 0.63324875 0.70727313 0.82291479 1.0 Si Si30 1 0.20992210 0.86930304 0.57041552 1.0 Si Si31 1 0.13637597 0.79231953 0.92886936 1.0 Si Si32 1 0.78978410 0.13337724 0.07024299 1.0 Si Si33 1 0.86052361 0.20508678 0.42930533 1.0 Si Si34 1 0.29527021 0.36055352 0.67985885 1.0 Si Si35 1 0.70691765 0.63863468 0.17727190 1.0