# generated using pymatgen data_TmZr(Ga3Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.42494342 _cell_length_b 7.42297704 _cell_length_c 9.33149855 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.93064710 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmZr(Ga3Rh)3 _chemical_formula_sum 'Tm2 Zr2 Ga18 Rh6' _cell_volume 445.71409859 _cell_formula_units_Z 2 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 0.66858480 0.99618630 0.25000000 1.0 Tm Tm1 1 0.33141520 0.00381370 0.75000000 1.0 Zr Zr2 1 0.99654384 0.67111542 0.25000000 1.0 Zr Zr3 1 0.00345616 0.32888458 0.75000000 1.0 Ga Ga4 1 0.12653453 0.12660485 0.25000000 1.0 Ga Ga5 1 0.87346547 0.87339515 0.75000000 1.0 Ga Ga6 1 0.99934136 0.33658419 0.07794227 1.0 Ga Ga7 1 0.00065864 0.66341581 0.92205773 1.0 Ga Ga8 1 0.00065864 0.66341581 0.57794227 1.0 Ga Ga9 1 0.33192146 0.99846257 0.41885697 1.0 Ga Ga10 1 0.99934136 0.33658419 0.42205773 1.0 Ga Ga11 1 0.66807854 0.00153743 0.58114303 1.0 Ga Ga12 1 0.66807854 0.00153743 0.91885697 1.0 Ga Ga13 1 0.33192146 0.99846257 0.08114303 1.0 Ga Ga14 1 0.33181712 0.33387648 0.57046036 1.0 Ga Ga15 1 0.66818288 0.66612352 0.42953964 1.0 Ga Ga16 1 0.66818288 0.66612352 0.07046036 1.0 Ga Ga17 1 0.33181712 0.33387648 0.92953964 1.0 Ga Ga18 1 0.33322668 0.54521800 0.25000000 1.0 Ga Ga19 1 0.66677332 0.45478200 0.75000000 1.0 Ga Ga20 1 0.55179309 0.33997214 0.25000000 1.0 Ga Ga21 1 0.44820691 0.66002786 0.75000000 1.0 Rh Rh22 1 0.67118408 0.32745849 0.99923996 1.0 Rh Rh23 1 0.32881592 0.67254151 0.00076004 1.0 Rh Rh24 1 0.32881592 0.67254151 0.49923996 1.0 Rh Rh25 1 0.67118408 0.32745849 0.50076004 1.0 Rh Rh26 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh27 1 0.00000000 0.00000000 0.50000000 1.0