# generated using pymatgen data_Tb4C2Cl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65648693 _cell_length_b 10.54536010 _cell_length_c 19.66171022 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb4C2Cl3 _chemical_formula_sum 'Tb16 C8 Cl12' _cell_volume 758.13532158 _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 Tb Tb0 1 0.25000000 0.13931093 0.57261989 1.0 Tb Tb1 1 0.25000000 0.63931093 0.92738011 1.0 Tb Tb2 1 0.75000000 0.86068907 0.42738011 1.0 Tb Tb3 1 0.75000000 0.36068907 0.07261989 1.0 Tb Tb4 1 0.25000000 0.63587118 0.75599204 1.0 Tb Tb5 1 0.25000000 0.13587118 0.74400796 1.0 Tb Tb6 1 0.75000000 0.36412882 0.24400796 1.0 Tb Tb7 1 0.75000000 0.86412882 0.25599204 1.0 Tb Tb8 1 0.25000000 0.10232167 0.33308364 1.0 Tb Tb9 1 0.25000000 0.60232167 0.16691636 1.0 Tb Tb10 1 0.75000000 0.89767833 0.66691636 1.0 Tb Tb11 1 0.75000000 0.39767833 0.83308364 1.0 Tb Tb12 1 0.25000000 0.12492691 0.16466351 1.0 Tb Tb13 1 0.25000000 0.62492691 0.33533649 1.0 Tb Tb14 1 0.75000000 0.87507309 0.83533649 1.0 Tb Tb15 1 0.75000000 0.37507309 0.66466351 1.0 C C16 1 0.25000000 0.86469621 0.34849808 1.0 C C17 1 0.25000000 0.36469621 0.15150192 1.0 C C18 1 0.75000000 0.13530379 0.65150192 1.0 C C19 1 0.75000000 0.63530379 0.84849808 1.0 C C20 1 0.25000000 0.38680391 0.75078128 1.0 C C21 1 0.25000000 0.88680391 0.74921872 1.0 C C22 1 0.75000000 0.61319609 0.24921872 1.0 C C23 1 0.75000000 0.11319609 0.25078128 1.0 Cl Cl24 1 0.25000000 0.37767562 0.95319262 1.0 Cl Cl25 1 0.25000000 0.87767562 0.54680738 1.0 Cl Cl26 1 0.75000000 0.62232438 0.04680738 1.0 Cl Cl27 1 0.75000000 0.12232438 0.45319262 1.0 Cl Cl28 1 0.25000000 0.88782202 0.94515885 1.0 Cl Cl29 1 0.25000000 0.38782202 0.55484115 1.0 Cl Cl30 1 0.75000000 0.11217798 0.05484115 1.0 Cl Cl31 1 0.75000000 0.61217798 0.44515885 1.0 Cl Cl32 1 0.25000000 0.36232388 0.35469994 1.0 Cl Cl33 1 0.25000000 0.86232388 0.14530006 1.0 Cl Cl34 1 0.75000000 0.63767612 0.64530006 1.0 Cl Cl35 1 0.75000000 0.13767612 0.85469994 1.0