# generated using pymatgen data_LiNd2(ErSi2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.18355348 _cell_length_b 14.80673795 _cell_length_c 7.70824438 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNd2(ErSi2)2 _chemical_formula_sum 'Li4 Nd8 Er8 Si16' _cell_volume 819.88736618 _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 Li Li0 1 0.34513359 0.25000000 0.01391716 1.0 Li Li1 1 0.84513359 0.25000000 0.48608284 1.0 Li Li2 1 0.15486641 0.75000000 0.51391816 1.0 Li Li3 1 0.65486641 0.75000000 0.98608184 1.0 Nd Nd4 1 0.02289141 0.10237055 0.18450803 1.0 Nd Nd5 1 0.02289141 0.39762945 0.18450803 1.0 Nd Nd6 1 0.52289141 0.10237055 0.31549197 1.0 Nd Nd7 1 0.52289141 0.39762945 0.31549197 1.0 Nd Nd8 1 0.47710759 0.60237055 0.68450803 1.0 Nd Nd9 1 0.47710759 0.89762945 0.68450803 1.0 Nd Nd10 1 0.97710859 0.60237055 0.81549197 1.0 Nd Nd11 1 0.97710859 0.89762945 0.81549197 1.0 Er Er12 1 0.32724422 0.62637435 0.18138943 1.0 Er Er13 1 0.32724422 0.87362465 0.18138943 1.0 Er Er14 1 0.82724322 0.62637435 0.31861057 1.0 Er Er15 1 0.82724322 0.87362465 0.31861057 1.0 Er Er16 1 0.17275578 0.12637435 0.68138943 1.0 Er Er17 1 0.17275578 0.37362465 0.68138943 1.0 Er Er18 1 0.67275578 0.12637435 0.81861057 1.0 Er Er19 1 0.67275578 0.37362465 0.81861057 1.0 Si Si20 1 0.65050648 0.53435370 0.03457352 1.0 Si Si21 1 0.65050648 0.96564630 0.03457352 1.0 Si Si22 1 0.02768000 0.75000000 0.09785593 1.0 Si Si23 1 0.72751294 0.25000000 0.11350753 1.0 Si Si24 1 0.22751194 0.25000000 0.38649247 1.0 Si Si25 1 0.52768000 0.75000000 0.40214407 1.0 Si Si26 1 0.15050648 0.53435370 0.46542748 1.0 Si Si27 1 0.15050648 0.96564630 0.46542748 1.0 Si Si28 1 0.84949452 0.03435270 0.53457152 1.0 Si Si29 1 0.84949452 0.46564630 0.53457152 1.0 Si Si30 1 0.47232100 0.25000000 0.59785493 1.0 Si Si31 1 0.77248806 0.75000000 0.61350753 1.0 Si Si32 1 0.27248806 0.75000000 0.88649247 1.0 Si Si33 1 0.97232000 0.25000000 0.90214507 1.0 Si Si34 1 0.34949352 0.03435270 0.96542748 1.0 Si Si35 1 0.34949352 0.46564630 0.96542748 1.0