# generated using pymatgen data_Tb10B2Br15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.00366618 _cell_length_b 9.79539816 _cell_length_c 10.60191909 _cell_angle_alpha 91.08674977 _cell_angle_beta 114.53020688 _cell_angle_gamma 110.94550123 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb10B2Br15 _chemical_formula_sum 'Tb10 B2 Br15' _cell_volume 778.85893739 _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 0.80085750 0.40985398 0.27763547 1.0 Tb Tb1 1 0.19914250 0.59014602 0.72236453 1.0 Tb Tb2 1 0.67454887 0.74547289 0.82011501 1.0 Tb Tb3 1 0.32545113 0.25452711 0.17988499 1.0 Tb Tb4 1 0.52543056 0.70561048 0.09616231 1.0 Tb Tb5 1 0.47456944 0.29438952 0.90383769 1.0 Tb Tb6 1 0.58513190 0.03905115 0.32358962 1.0 Tb Tb7 1 0.41486810 0.96094885 0.67641038 1.0 Tb Tb8 1 0.72219480 0.07465414 0.04828311 1.0 Tb Tb9 1 0.27780520 0.92534586 0.95171689 1.0 B B10 1 0.46686248 0.81700857 0.87526953 1.0 B B11 1 0.53313752 0.18299143 0.12473047 1.0 Br Br12 1 0.00000000 0.00000000 0.00000000 1.0 Br Br13 1 0.63908637 0.88379767 0.58227821 1.0 Br Br14 1 0.36091363 0.11620233 0.41772179 1.0 Br Br15 1 0.88573816 0.29826021 0.53125664 1.0 Br Br16 1 0.11426184 0.70173979 0.46874336 1.0 Br Br17 1 0.28589900 0.75901805 0.18051550 1.0 Br Br18 1 0.71410100 0.24098195 0.81948450 1.0 Br Br19 1 0.05943718 0.34523832 0.22907058 1.0 Br Br20 1 0.16046455 0.05734960 0.70030336 1.0 Br Br21 1 0.83953545 0.94265040 0.29969664 1.0 Br Br22 1 0.22955363 0.40965885 0.94282103 1.0 Br Br23 1 0.77044637 0.59034115 0.05717897 1.0 Br Br24 1 0.40703160 0.46040411 0.65549693 1.0 Br Br25 1 0.59296840 0.53959589 0.34450307 1.0 Br Br26 1 0.94056282 0.65476168 0.77092942 1.0