# generated using pymatgen data_Sm5Zr3(P3Pd4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.12087670 _cell_length_b 13.12087483 _cell_length_c 4.02470226 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000222 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm5Zr3(P3Pd4)4 _chemical_formula_sum 'Sm5 Zr3 P12 Pd16' _cell_volume 600.05357277 _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 Sm Sm0 1 0.18953719 0.18953719 0.50000000 1.0 Sm Sm1 1 0.81046281 0.00000000 0.50000000 1.0 Sm Sm2 1 1.00000000 0.81046281 0.50000000 1.0 Sm Sm3 1 0.33333300 0.66666700 0.00000000 1.0 Sm Sm4 1 0.66666700 0.33333300 0.00000000 1.0 Zr Zr5 1 0.55587709 0.55587709 0.00000000 1.0 Zr Zr6 1 0.44412291 0.00000000 0.00000000 1.0 Zr Zr7 1 1.00000000 0.44412291 0.00000000 1.0 P P8 1 0.82583422 0.82583422 0.00000000 1.0 P P9 1 0.17416578 0.00000000 0.00000000 1.0 P P10 1 1.00000000 0.17416578 0.00000000 1.0 P P11 1 0.16484724 0.47872606 0.50000000 1.0 P P12 1 0.52127394 0.68612018 0.50000000 1.0 P P13 1 0.31387982 0.83515276 0.50000000 1.0 P P14 1 0.68612018 0.52127394 0.50000000 1.0 P P15 1 0.83515276 0.31387982 0.50000000 1.0 P P16 1 0.47872606 0.16484724 0.50000000 1.0 P P17 1 0.35977712 0.35977712 0.00000000 1.0 P P18 1 0.64022288 1.00000000 0.00000000 1.0 P P19 1 0.00000000 0.64022288 0.00000000 1.0 Pd Pd20 1 0.72735581 0.72735581 0.50000000 1.0 Pd Pd21 1 0.27264419 0.00000000 0.50000000 1.0 Pd Pd22 1 1.00000000 0.27264419 0.50000000 1.0 Pd Pd23 1 0.18486477 0.37773036 0.00000000 1.0 Pd Pd24 1 0.62226964 0.80713341 0.00000000 1.0 Pd Pd25 1 0.19286659 0.81513523 0.00000000 1.0 Pd Pd26 1 0.80713341 0.62226964 0.00000000 1.0 Pd Pd27 1 0.81513523 0.19286659 0.00000000 1.0 Pd Pd28 1 0.37773036 0.18486477 0.00000000 1.0 Pd Pd29 1 0.36029707 0.49050032 0.50000000 1.0 Pd Pd30 1 0.50949968 0.86979675 0.50000000 1.0 Pd Pd31 1 0.13020325 0.63970293 0.50000000 1.0 Pd Pd32 1 0.86979675 0.50949968 0.50000000 1.0 Pd Pd33 1 0.63970293 0.13020325 0.50000000 1.0 Pd Pd34 1 0.49050032 0.36029707 0.50000000 1.0 Pd Pd35 1 0.00000000 0.00000000 0.00000000 1.0