# generated using pymatgen data_Tm3Zr(Al3Rh)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.46208817 _cell_length_b 7.45550897 _cell_length_c 9.31953709 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.54947209 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Zr(Al3Rh)6 _chemical_formula_sum 'Tm3 Zr1 Al18 Rh6' _cell_volume 451.04140994 _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 0.00582725 0.32686174 0.75000000 1.0 Tm Tm1 1 0.67152167 0.99497477 0.25000000 1.0 Tm Tm2 1 0.32871416 0.00679362 0.75000000 1.0 Zr Zr3 1 0.99560004 0.67156759 0.25000000 1.0 Al Al4 1 0.12590526 0.12347371 0.25000000 1.0 Al Al5 1 0.87073761 0.86971760 0.75000000 1.0 Al Al6 1 0.00019445 0.33766313 0.07778377 1.0 Al Al7 1 0.99961876 0.66495322 0.92858594 1.0 Al Al8 1 0.99961876 0.66495322 0.57141406 1.0 Al Al9 1 0.33274283 0.99835855 0.42216570 1.0 Al Al10 1 0.00019445 0.33766313 0.42221623 1.0 Al Al11 1 0.66431360 0.99837326 0.57455112 1.0 Al Al12 1 0.66431360 0.99837326 0.92544888 1.0 Al Al13 1 0.33274283 0.99835855 0.07783430 1.0 Al Al14 1 0.33415678 0.33424995 0.54883361 1.0 Al Al15 1 0.66931966 0.66726081 0.44401380 1.0 Al Al16 1 0.66931966 0.66726081 0.05598620 1.0 Al Al17 1 0.33415678 0.33424995 0.95116639 1.0 Al Al18 1 0.33563552 0.55046267 0.25000000 1.0 Al Al19 1 0.66055217 0.45064877 0.75000000 1.0 Al Al20 1 0.55522081 0.34351065 0.25000000 1.0 Al Al21 1 0.44944911 0.65952488 0.75000000 1.0 Rh Rh22 1 0.67289297 0.32751820 0.00098961 1.0 Rh Rh23 1 0.32771332 0.67304859 0.00153814 1.0 Rh Rh24 1 0.32771332 0.67304859 0.49846186 1.0 Rh Rh25 1 0.67289297 0.32751820 0.49901039 1.0 Rh Rh26 1 0.99946732 0.99980529 0.00084655 1.0 Rh Rh27 1 0.99946732 0.99980529 0.49915345 1.0