# generated using pymatgen data_TmHf(Ga3Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.41601095 _cell_length_b 7.41191185 _cell_length_c 9.31056908 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.94483076 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmHf(Ga3Rh)3 _chemical_formula_sum 'Tm2 Hf2 Ga18 Rh6' _cell_volume 443.45405651 _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 0.66839651 0.99619143 0.25000000 1.0 Tm Tm1 1 0.33160349 0.00380857 0.75000000 1.0 Hf Hf2 1 0.99646217 0.67101692 0.25000000 1.0 Hf Hf3 1 0.00353783 0.32898308 0.75000000 1.0 Ga Ga4 1 0.12615755 0.12611221 0.25000000 1.0 Ga Ga5 1 0.87384245 0.87388779 0.75000000 1.0 Ga Ga6 1 0.99932056 0.33734905 0.07889110 1.0 Ga Ga7 1 0.00067944 0.66265095 0.92110890 1.0 Ga Ga8 1 0.00067944 0.66265095 0.57889110 1.0 Ga Ga9 1 0.33106930 0.99757051 0.41799674 1.0 Ga Ga10 1 0.99932056 0.33734905 0.42110890 1.0 Ga Ga11 1 0.66893070 0.00242949 0.58200326 1.0 Ga Ga12 1 0.66893070 0.00242949 0.91799674 1.0 Ga Ga13 1 0.33106930 0.99757051 0.08200326 1.0 Ga Ga14 1 0.33088774 0.33367468 0.57181626 1.0 Ga Ga15 1 0.66911226 0.66632532 0.42818374 1.0 Ga Ga16 1 0.66911226 0.66632532 0.07181626 1.0 Ga Ga17 1 0.33088774 0.33367468 0.92818374 1.0 Ga Ga18 1 0.33331524 0.54534089 0.25000000 1.0 Ga Ga19 1 0.66668476 0.45465911 0.75000000 1.0 Ga Ga20 1 0.55194408 0.33974217 0.25000000 1.0 Ga Ga21 1 0.44805592 0.66025783 0.75000000 1.0 Rh Rh22 1 0.67111058 0.32751213 0.99923579 1.0 Rh Rh23 1 0.32888942 0.67248787 0.00076421 1.0 Rh Rh24 1 0.32888942 0.67248787 0.49923579 1.0 Rh Rh25 1 0.67111058 0.32751213 0.50076421 1.0 Rh Rh26 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh27 1 0.00000000 0.00000000 0.50000000 1.0