# generated using pymatgen data_Tb7Ho(PBr6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.99863857 _cell_length_b 13.08492201 _cell_length_c 13.80673480 _cell_angle_alpha 89.89834011 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb7Ho(PBr6)2 _chemical_formula_sum 'Tb7 Ho1 P2 Br12' _cell_volume 722.39309819 _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 0.50000000 0.88308296 0.65660328 1.0 Tb Tb1 1 0.50000000 0.61737391 0.15734591 1.0 Tb Tb2 1 0.50000000 0.38243986 0.84276318 1.0 Tb Tb3 1 0.00000000 0.11465495 0.57716083 1.0 Tb Tb4 1 0.00000000 0.88469671 0.42369785 1.0 Tb Tb5 1 0.00000000 0.61506058 0.92320463 1.0 Tb Tb6 1 0.00000000 0.38466554 0.07712253 1.0 Ho Ho7 1 0.50000000 0.11745729 0.34257992 1.0 P P8 1 0.50000000 0.00099571 0.49864339 1.0 P P9 1 0.50000000 0.49976779 0.00014155 1.0 Br Br10 1 0.50000000 0.24325017 0.16573067 1.0 Br Br11 1 0.50000000 0.75592017 0.83578271 1.0 Br Br12 1 0.50000000 0.74457715 0.33549645 1.0 Br Br13 1 0.50000000 0.25633289 0.66345684 1.0 Br Br14 1 0.00000000 0.25464401 0.41103574 1.0 Br Br15 1 0.00000000 0.74292200 0.58712219 1.0 Br Br16 1 0.00000000 0.75695462 0.08689268 1.0 Br Br17 1 0.00000000 0.24291740 0.91331323 1.0 Br Br18 1 0.00000000 0.00265757 0.24299246 1.0 Br Br19 1 0.00000000 0.99971955 0.75856665 1.0 Br Br20 1 0.00000000 0.50005832 0.25853740 1.0 Br Br21 1 0.00000000 0.49985186 0.74180991 1.0