# generated using pymatgen data_CaTb11(NdSi2)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.80309369 _cell_length_b 7.80309369 _cell_length_c 14.40061568 _cell_angle_alpha 90.08876554 _cell_angle_beta 89.91123446 _cell_angle_gamma 90.06340060 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaTb11(NdSi2)8 _chemical_formula_sum 'Ca1 Tb11 Nd8 Si16' _cell_volume 876.82595294 _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 Ca Ca0 1 0.31565769 0.31565769 0.50000000 1.0 Tb Tb1 1 0.48936689 0.36486104 0.12344281 1.0 Tb Tb2 1 0.99260529 0.13457166 0.62549735 1.0 Tb Tb3 1 0.86419618 0.00955597 0.87341799 1.0 Tb Tb4 1 0.13457166 0.99260529 0.37450265 1.0 Tb Tb5 1 0.50805027 0.63542728 0.62378328 1.0 Tb Tb6 1 0.36486104 0.48936689 0.87655719 1.0 Tb Tb7 1 0.63542728 0.50805027 0.37621672 1.0 Tb Tb8 1 0.00955597 0.86419618 0.12658201 1.0 Tb Tb9 1 0.18587461 0.81496162 0.75027273 1.0 Tb Tb10 1 0.81496162 0.18587461 0.24972727 1.0 Tb Tb11 1 0.68440337 0.68440337 0.00000000 1.0 Nd Nd12 1 0.63678773 0.99358222 0.45691203 1.0 Nd Nd13 1 0.36292080 0.00836717 0.95681428 1.0 Nd Nd14 1 0.99358222 0.63678773 0.54308797 1.0 Nd Nd15 1 0.49013657 0.86158506 0.20804954 1.0 Nd Nd16 1 0.50801651 0.13543769 0.70605532 1.0 Nd Nd17 1 0.86158506 0.49013657 0.79195046 1.0 Nd Nd18 1 0.13543769 0.50801651 0.29394468 1.0 Nd Nd19 1 0.00836717 0.36292080 0.04318572 1.0 Si Si20 1 0.28918550 0.92573351 0.56057400 1.0 Si Si21 1 0.70990630 0.06612856 0.05977636 1.0 Si Si22 1 0.92573351 0.28918550 0.43942600 1.0 Si Si23 1 0.43400336 0.21003610 0.30746593 1.0 Si Si24 1 0.56724729 0.78959534 0.80982513 1.0 Si Si25 1 0.21003610 0.43400336 0.69253407 1.0 Si Si26 1 0.78959534 0.56724729 0.19017487 1.0 Si Si27 1 0.06612856 0.70990630 0.94022364 1.0 Si Si28 1 0.79672241 0.84370113 0.68961709 1.0 Si Si29 1 0.20262427 0.15686926 0.19080053 1.0 Si Si30 1 0.84370113 0.79672241 0.31038291 1.0 Si Si31 1 0.34822763 0.71212021 0.43700590 1.0 Si Si32 1 0.65619322 0.29533928 0.93999204 1.0 Si Si33 1 0.71212021 0.34822763 0.56299410 1.0 Si Si34 1 0.29533928 0.65619322 0.06000796 1.0 Si Si35 1 0.15686926 0.20262427 0.80919947 1.0