# generated using pymatgen data_TbSm7(SiI6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.29226522 _cell_length_b 14.27908253 _cell_length_c 14.95714025 _cell_angle_alpha 89.80578619 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbSm7(SiI6)2 _chemical_formula_sum 'Tb1 Sm7 Si2 I12' _cell_volume 916.71201701 _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 Tb Tb0 1 0.00000000 0.39223047 0.07738103 1.0 Sm Sm1 1 0.50000000 0.11901121 0.34834184 1.0 Sm Sm2 1 0.50000000 0.88172410 0.65088817 1.0 Sm Sm3 1 0.50000000 0.61759433 0.15085383 1.0 Sm Sm4 1 0.50000000 0.38133865 0.84974218 1.0 Sm Sm5 1 0.00000000 0.10933600 0.57807622 1.0 Sm Sm6 1 0.00000000 0.89088470 0.42139633 1.0 Sm Sm7 1 0.00000000 0.60822029 0.92220335 1.0 Si Si8 1 0.50000000 0.00029087 0.49948806 1.0 Si Si9 1 0.50000000 0.49850778 0.00098604 1.0 I I10 1 0.50000000 0.25800506 0.16903987 1.0 I I11 1 0.50000000 0.74581698 0.82932532 1.0 I I12 1 0.50000000 0.75323276 0.32899239 1.0 I I13 1 0.50000000 0.24543798 0.67238734 1.0 I I14 1 0.00000000 0.26112667 0.42071896 1.0 I I15 1 0.00000000 0.73946924 0.57881978 1.0 I I16 1 0.00000000 0.76009065 0.07838113 1.0 I I17 1 0.00000000 0.24070358 0.92542631 1.0 I I18 1 0.00000000 0.00596239 0.23808578 1.0 I I19 1 0.00000000 0.99429181 0.76153417 1.0 I I20 1 0.00000000 0.50231519 0.25924999 1.0 I I21 1 0.00000000 0.49440528 0.73868293 1.0