# generated using pymatgen data_LiPr2(TmSi2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.19190364 _cell_length_b 7.72365653 _cell_length_c 14.83930629 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiPr2(TmSi2)2 _chemical_formula_sum 'Li4 Pr8 Tm8 Si16' _cell_volume 824.29072183 _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 0.65526247 0.99272869 0.75000000 1.0 Li Li1 1 0.84473753 0.49272869 0.25000000 1.0 Li Li2 1 0.34473753 0.00727131 0.25000000 1.0 Li Li3 1 0.15526247 0.50727131 0.75000000 1.0 Pr Pr4 1 0.02207768 0.18348758 0.39671116 1.0 Pr Pr5 1 0.52207768 0.31651242 0.39671116 1.0 Pr Pr6 1 0.47792232 0.68348758 0.89671116 1.0 Pr Pr7 1 0.47792232 0.68348758 0.60328884 1.0 Pr Pr8 1 0.97792232 0.81651242 0.60328884 1.0 Pr Pr9 1 0.97792232 0.81651242 0.89671116 1.0 Pr Pr10 1 0.52207768 0.31651242 0.10328884 1.0 Pr Pr11 1 0.02207768 0.18348758 0.10328884 1.0 Tm Tm12 1 0.32801590 0.18159278 0.62553657 1.0 Tm Tm13 1 0.67198410 0.81840722 0.37446343 1.0 Tm Tm14 1 0.17198410 0.68159278 0.37446343 1.0 Tm Tm15 1 0.82801590 0.31840722 0.87446343 1.0 Tm Tm16 1 0.82801590 0.31840722 0.62553657 1.0 Tm Tm17 1 0.32801590 0.18159278 0.87446343 1.0 Tm Tm18 1 0.17198410 0.68159278 0.12553657 1.0 Tm Tm19 1 0.67198410 0.81840722 0.12553657 1.0 Si Si20 1 0.27487627 0.89166771 0.75000000 1.0 Si Si21 1 0.46942134 0.60373507 0.25000000 1.0 Si Si22 1 0.03057866 0.10373507 0.75000000 1.0 Si Si23 1 0.53057866 0.39626493 0.75000000 1.0 Si Si24 1 0.15019056 0.46463654 0.53420153 1.0 Si Si25 1 0.96942134 0.89626493 0.25000000 1.0 Si Si26 1 0.72512373 0.10833229 0.25000000 1.0 Si Si27 1 0.84980944 0.53536346 0.03420153 1.0 Si Si28 1 0.34980944 0.96463654 0.03420153 1.0 Si Si29 1 0.15019056 0.46463654 0.96579847 1.0 Si Si30 1 0.65019056 0.03536346 0.53420153 1.0 Si Si31 1 0.34980944 0.96463654 0.46579847 1.0 Si Si32 1 0.84980944 0.53536346 0.46579847 1.0 Si Si33 1 0.77487627 0.60833229 0.75000000 1.0 Si Si34 1 0.22512373 0.39166771 0.25000000 1.0 Si Si35 1 0.65019056 0.03536346 0.96579847 1.0