# generated using pymatgen data_Sm2(Ga3Ru)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43601306 _cell_length_b 7.43601416 _cell_length_c 9.76101685 _cell_angle_alpha 90.00027624 _cell_angle_beta 90.00018338 _cell_angle_gamma 118.83410213 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2(Ga3Ru)3 _chemical_formula_sum 'Sm4 Ga18 Ru6' _cell_volume 472.81291468 _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 Sm Sm0 1 0.99784669 0.67430652 0.25001562 1.0 Sm Sm1 1 0.00215118 0.32569361 0.74998477 1.0 Sm Sm2 1 0.67430663 0.99784845 0.25001534 1.0 Sm Sm3 1 0.32569376 0.00215313 0.74998449 1.0 Ga Ga4 1 0.13557413 0.13557346 0.24992602 1.0 Ga Ga5 1 0.86442828 0.86442335 0.75007501 1.0 Ga Ga6 1 0.01247661 0.33848299 0.07375860 1.0 Ga Ga7 1 0.98752530 0.66151748 0.92624118 1.0 Ga Ga8 1 0.98747630 0.66152418 0.57380695 1.0 Ga Ga9 1 0.33847536 0.01252342 0.42619339 1.0 Ga Ga10 1 0.01251893 0.33847275 0.42619385 1.0 Ga Ga11 1 0.66152668 0.98748100 0.57380650 1.0 Ga Ga12 1 0.66151740 0.98752338 0.92624115 1.0 Ga Ga13 1 0.33848243 0.01247447 0.07375868 1.0 Ga Ga14 1 0.34009033 0.34008825 0.55950406 1.0 Ga Ga15 1 0.65991190 0.65990964 0.44049637 1.0 Ga Ga16 1 0.65993096 0.65993181 0.05942138 1.0 Ga Ga17 1 0.34006882 0.34006921 0.94057801 1.0 Ga Ga18 1 0.33892833 0.55119706 0.24993895 1.0 Ga Ga19 1 0.66106464 0.44880007 0.75006222 1.0 Ga Ga20 1 0.55119969 0.33893510 0.24993766 1.0 Ga Ga21 1 0.44880295 0.66107140 0.75006097 1.0 Ru Ru22 1 0.67600209 0.32399850 0.00000035 1.0 Ru Ru23 1 0.32399954 0.67600149 0.00000045 1.0 Ru Ru24 1 0.32401545 0.67598418 0.49999954 1.0 Ru Ru25 1 0.67598525 0.32401385 0.49999949 1.0 Ru Ru26 1 0.00000022 -0.00000034 0.00000013 1.0 Ru Ru27 1 0.00000013 0.00000060 0.49999889 1.0