# generated using pymatgen data_LiNd2(TmSi2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.70544509 _cell_length_b 7.70544509 _cell_length_c 13.70500531 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNd2(TmSi2)2 _chemical_formula_sum 'Li4 Nd8 Tm8 Si16' _cell_volume 813.71939673 _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 0.30937239 0.30937239 0.50000000 1.0 Li Li1 1 0.19062761 0.80937239 0.75000000 1.0 Li Li2 1 0.80937239 0.19062761 0.25000000 1.0 Li Li3 1 0.69062761 0.69062761 0.00000000 1.0 Nd Nd4 1 0.63672673 0.99979294 0.45888455 1.0 Nd Nd5 1 0.36327327 0.00020706 0.95888455 1.0 Nd Nd6 1 0.99979294 0.63672673 0.54111545 1.0 Nd Nd7 1 0.49979294 0.86327327 0.20888455 1.0 Nd Nd8 1 0.50020706 0.13672673 0.70888455 1.0 Nd Nd9 1 0.86327327 0.49979294 0.79111545 1.0 Nd Nd10 1 0.13672673 0.50020706 0.29111545 1.0 Nd Nd11 1 0.00020706 0.36327327 0.04111545 1.0 Tm Tm12 1 0.50458324 0.36828354 0.12289979 1.0 Tm Tm13 1 0.00458324 0.13171646 0.62710021 1.0 Tm Tm14 1 0.86828354 0.99541676 0.87289979 1.0 Tm Tm15 1 0.13171646 0.00458324 0.37289979 1.0 Tm Tm16 1 0.49541676 0.63171646 0.62289979 1.0 Tm Tm17 1 0.36828354 0.50458324 0.87710021 1.0 Tm Tm18 1 0.63171646 0.49541676 0.37710021 1.0 Tm Tm19 1 0.99541676 0.86828354 0.12710021 1.0 Si Si20 1 0.28723870 0.92387449 0.55874178 1.0 Si Si21 1 0.71276130 0.07612551 0.05874178 1.0 Si Si22 1 0.92387449 0.28723870 0.44125822 1.0 Si Si23 1 0.42387449 0.21276130 0.30874178 1.0 Si Si24 1 0.57612551 0.78723870 0.80874178 1.0 Si Si25 1 0.21276130 0.42387449 0.69125822 1.0 Si Si26 1 0.78723870 0.57612551 0.19125822 1.0 Si Si27 1 0.07612551 0.71276130 0.94125822 1.0 Si Si28 1 0.78155356 0.85216139 0.68129002 1.0 Si Si29 1 0.21844644 0.14783861 0.18129002 1.0 Si Si30 1 0.85216139 0.78155356 0.31870998 1.0 Si Si31 1 0.35216139 0.71844644 0.43129002 1.0 Si Si32 1 0.64783861 0.28155356 0.93129002 1.0 Si Si33 1 0.71844644 0.35216139 0.56870998 1.0 Si Si34 1 0.28155356 0.64783861 0.06870998 1.0 Si Si35 1 0.14783861 0.21844644 0.81870998 1.0