# generated using pymatgen data_Tb3Lu2In3Br _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.14091823 _cell_length_b 9.14093394 _cell_length_c 6.61619330 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00041999 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Lu2In3Br _chemical_formula_sum 'Tb6 Lu4 In6 Br2' _cell_volume 478.75946515 _cell_formula_units_Z 2 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 0.73453574 0.73453829 0.25000000 1.0 Tb Tb1 1 0.00000448 0.73453765 0.75000000 1.0 Tb Tb2 1 0.73453542 0.99999948 0.75000000 1.0 Tb Tb3 1 0.26546426 0.26546171 0.75000000 1.0 Tb Tb4 1 0.99999552 0.26546235 0.25000000 1.0 Tb Tb5 1 0.26546458 0.00000052 0.25000000 1.0 Lu Lu6 1 0.33335118 0.66667802 0.50002221 1.0 Lu Lu7 1 0.66664882 0.33332198 0.49997779 1.0 Lu Lu8 1 0.33335118 0.66667802 0.99997779 1.0 Lu Lu9 1 0.66664882 0.33332198 0.00002221 1.0 In In10 1 0.39476292 0.99998240 0.75000000 1.0 In In11 1 0.00001213 0.60523613 0.25000000 1.0 In In12 1 0.60523708 0.00001760 0.25000000 1.0 In In13 1 0.99998787 0.39476387 0.75000000 1.0 In In14 1 0.39477598 0.39475760 0.25000000 1.0 In In15 1 0.60522402 0.60524240 0.75000000 1.0 Br Br16 1 0.00000000 0.00000000 0.50000000 1.0 Br Br17 1 0.00000000 0.00000000 0.00000000 1.0