# generated using pymatgen data_Tm4B16Ru13Rh3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.15871509 _cell_length_b 7.42069245 _cell_length_c 7.42925384 _cell_angle_alpha 90.05030079 _cell_angle_beta 114.03230254 _cell_angle_gamma 114.14315776 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4B16Ru13Rh3 _chemical_formula_sum 'Tm4 B16 Ru13 Rh3' _cell_volume 412.23313009 _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 0.75016049 0.87477649 0.12296214 1.0 Tm Tm1 1 0.25074940 0.62734136 0.37199430 1.0 Tm Tm2 1 0.74920572 0.37631246 0.62529882 1.0 Tm Tm3 1 0.24766352 0.12184323 0.87508025 1.0 B B4 1 0.91108069 0.28349607 0.06965933 1.0 B B5 1 0.41345006 0.56003799 0.12351143 1.0 B B6 1 0.08935784 0.21736631 0.15795604 1.0 B B7 1 0.58805809 0.15642349 0.21039008 1.0 B B8 1 0.41625146 0.06802303 0.29368405 1.0 B B9 1 0.91335945 0.62357038 0.35613368 1.0 B B10 1 0.58632738 0.65163672 0.37573572 1.0 B B11 1 0.08751022 0.87747409 0.44338712 1.0 B B12 1 0.91114761 0.12328230 0.56296855 1.0 B B13 1 0.41323920 0.34679617 0.62287790 1.0 B B14 1 0.08701148 0.37468084 0.65501413 1.0 B B15 1 0.58940588 0.93761594 0.71011394 1.0 B B16 1 0.41440776 0.84172765 0.78328696 1.0 B B17 1 0.91021128 0.79014733 0.84391619 1.0 B B18 1 0.58419395 0.43260967 0.87632286 1.0 B B19 1 0.08365552 0.70788968 0.92699982 1.0 Ru Ru20 1 0.62835037 0.46349757 0.17740970 1.0 Ru Ru21 1 0.37190659 0.33303808 0.32069102 1.0 Ru Ru22 1 0.87314663 0.32289036 0.33663385 1.0 Ru Ru23 1 0.62554093 0.96234661 0.44665750 1.0 Ru Ru24 1 0.12756215 0.17766134 0.46343550 1.0 Ru Ru25 1 0.87260507 0.82242051 0.53754610 1.0 Ru Ru26 1 0.37160166 0.03589335 0.54968493 1.0 Ru Ru27 1 0.12956251 0.67751479 0.66574201 1.0 Ru Ru28 1 0.62389535 0.66517546 0.67573494 1.0 Ru Ru29 1 0.37282189 0.53493707 0.82342646 1.0 Ru Ru30 1 0.87312587 0.05459127 0.83470184 1.0 Ru Ru31 1 0.62829248 0.16657805 0.94797998 1.0 Ru Ru32 1 0.12948472 0.45063094 0.96484416 1.0 Rh Rh33 1 0.87669628 0.55299512 0.03757074 1.0 Rh Rh34 1 0.37730921 0.83994470 0.05025576 1.0 Rh Rh35 1 0.12165230 0.94683258 0.16039622 1.0