# generated using pymatgen data_Tm4MnB16W3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.52509022 _cell_length_b 5.96539402 _cell_length_c 11.52248316 _cell_angle_alpha 89.97230529 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4MnB16W3 _chemical_formula_sum 'Tm4 Mn1 B16 W3' _cell_volume 242.30110913 _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 Tm Tm0 1 0.50000000 0.37676520 0.14878279 1.0 Tm Tm1 1 0.50000000 0.62728528 0.85224053 1.0 Tm Tm2 1 0.50000000 0.12806675 0.65021020 1.0 Tm Tm3 1 0.50000000 0.87203142 0.34680159 1.0 Mn Mn4 1 0.50000000 0.87150799 0.08233131 1.0 B B5 1 0.00000000 0.10965779 0.05174957 1.0 B B6 1 0.00000000 0.88056077 0.95638517 1.0 B B7 1 0.00000000 0.38401192 0.54682592 1.0 B B8 1 0.00000000 0.61583538 0.45109052 1.0 B B9 1 0.00000000 0.13157141 0.46680477 1.0 B B10 1 0.00000000 0.86834026 0.53156327 1.0 B B11 1 0.00000000 0.36781728 0.97150282 1.0 B B12 1 0.00000000 0.63753110 0.03411847 1.0 B B13 1 0.00000000 0.01867639 0.19172671 1.0 B B14 1 0.00000000 0.97467156 0.80802820 1.0 B B15 1 0.00000000 0.47581097 0.69468730 1.0 B B16 1 0.00000000 0.52702978 0.30334281 1.0 B B17 1 0.00000000 0.20857775 0.31042720 1.0 B B18 1 0.00000000 0.78941536 0.68765888 1.0 B B19 1 0.00000000 0.28761495 0.81466622 1.0 B B20 1 0.00000000 0.71891540 0.18227248 1.0 W W21 1 0.50000000 0.36933632 0.41321162 1.0 W W22 1 0.50000000 0.63053010 0.58467428 1.0 W W23 1 0.50000000 0.12843786 0.91889735 1.0