# generated using pymatgen data_Sm3Re(P3Rh4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.94173519 _cell_length_b 11.09066034 _cell_length_c 12.79781246 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm3Re(P3Rh4)2 _chemical_formula_sum 'Sm6 Re2 P12 Rh16' _cell_volume 559.47487936 _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 0.00000000 0.50000000 0.52169021 1.0 Sm Sm1 1 0.50000000 0.00000000 0.47830979 1.0 Sm Sm2 1 0.50000000 0.81646623 0.20503619 1.0 Sm Sm3 1 0.50000000 0.18353377 0.20503619 1.0 Sm Sm4 1 0.00000000 0.68353377 0.79496381 1.0 Sm Sm5 1 0.00000000 0.31646623 0.79496381 1.0 Re Re6 1 0.50000000 0.50000000 0.15907180 1.0 Re Re7 1 0.00000000 0.00000000 0.84092820 1.0 P P8 1 0.50000000 0.50000000 0.87767352 1.0 P P9 1 0.00000000 0.00000000 0.12232648 1.0 P P10 1 0.50000000 0.50000000 0.34444366 1.0 P P11 1 0.00000000 0.00000000 0.65555634 1.0 P P12 1 0.50000000 0.31376675 0.61707548 1.0 P P13 1 0.50000000 0.68623325 0.61707548 1.0 P P14 1 0.00000000 0.18623325 0.38292452 1.0 P P15 1 0.00000000 0.81376675 0.38292452 1.0 P P16 1 0.50000000 0.84926872 0.88881770 1.0 P P17 1 0.50000000 0.15073128 0.88881770 1.0 P P18 1 0.00000000 0.65073128 0.11118230 1.0 P P19 1 0.00000000 0.34926872 0.11118230 1.0 Rh Rh20 1 0.50000000 0.50000000 0.70052225 1.0 Rh Rh21 1 0.00000000 0.00000000 0.29947775 1.0 Rh Rh22 1 0.00000000 0.50000000 0.99081964 1.0 Rh Rh23 1 0.50000000 0.00000000 0.00918036 1.0 Rh Rh24 1 0.50000000 0.33136425 0.98499720 1.0 Rh Rh25 1 0.50000000 0.66863575 0.98499720 1.0 Rh Rh26 1 0.00000000 0.16863575 0.01500280 1.0 Rh Rh27 1 0.00000000 0.83136425 0.01500280 1.0 Rh Rh28 1 0.50000000 0.29463027 0.43093939 1.0 Rh Rh29 1 0.50000000 0.70536973 0.43093939 1.0 Rh Rh30 1 0.00000000 0.20536973 0.56906061 1.0 Rh Rh31 1 0.00000000 0.79463027 0.56906061 1.0 Rh Rh32 1 0.50000000 0.87657151 0.71049779 1.0 Rh Rh33 1 0.50000000 0.12342849 0.71049779 1.0 Rh Rh34 1 0.00000000 0.62342849 0.28950221 1.0 Rh Rh35 1 0.00000000 0.37657151 0.28950221 1.0