# generated using pymatgen data_LiPr2(ErSi2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.21111713 _cell_length_b 7.73990039 _cell_length_c 14.87629725 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiPr2(ErSi2)2 _chemical_formula_sum 'Li4 Pr8 Er8 Si16' _cell_volume 830.29566191 _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 0.65543068 0.98966379 0.75000000 1.0 Li Li1 1 0.84456932 0.48966379 0.25000000 1.0 Li Li2 1 0.34456932 0.01033621 0.25000000 1.0 Li Li3 1 0.15543068 0.51033621 0.75000000 1.0 Pr Pr4 1 0.02213140 0.18391536 0.39715479 1.0 Pr Pr5 1 0.52213140 0.31608464 0.39715479 1.0 Pr Pr6 1 0.47786860 0.68391536 0.89715479 1.0 Pr Pr7 1 0.47786860 0.68391536 0.60284521 1.0 Pr Pr8 1 0.97786860 0.81608464 0.60284521 1.0 Pr Pr9 1 0.97786860 0.81608464 0.89715479 1.0 Pr Pr10 1 0.52213140 0.31608464 0.10284521 1.0 Pr Pr11 1 0.02213140 0.18391536 0.10284521 1.0 Er Er12 1 0.32793429 0.18164910 0.62607446 1.0 Er Er13 1 0.67206571 0.81835090 0.37392554 1.0 Er Er14 1 0.17206571 0.68164910 0.37392554 1.0 Er Er15 1 0.82793429 0.31835090 0.87392554 1.0 Er Er16 1 0.82793429 0.31835090 0.62607446 1.0 Er Er17 1 0.32793429 0.18164910 0.87392554 1.0 Er Er18 1 0.17206571 0.68164910 0.12607446 1.0 Er Er19 1 0.67206571 0.81835090 0.12607446 1.0 Si Si20 1 0.27412946 0.88992742 0.75000000 1.0 Si Si21 1 0.47017725 0.60087129 0.25000000 1.0 Si Si22 1 0.02982275 0.10087129 0.75000000 1.0 Si Si23 1 0.52982275 0.39912871 0.75000000 1.0 Si Si24 1 0.14993240 0.46491970 0.53413679 1.0 Si Si25 1 0.97017725 0.89912871 0.25000000 1.0 Si Si26 1 0.72587054 0.11007258 0.25000000 1.0 Si Si27 1 0.85006760 0.53508030 0.03413679 1.0 Si Si28 1 0.35006760 0.96491970 0.03413679 1.0 Si Si29 1 0.14993240 0.46491970 0.96586321 1.0 Si Si30 1 0.64993240 0.03508030 0.53413679 1.0 Si Si31 1 0.35006760 0.96491970 0.46586321 1.0 Si Si32 1 0.85006760 0.53508030 0.46586321 1.0 Si Si33 1 0.77412946 0.61007258 0.75000000 1.0 Si Si34 1 0.22587054 0.38992742 0.25000000 1.0 Si Si35 1 0.64993240 0.03508030 0.96586321 1.0