# generated using pymatgen data_Tm4ScPPb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.89209800 _cell_length_b 8.89209728 _cell_length_c 6.64541765 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999908 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4ScPPb3 _chemical_formula_sum 'Tm8 Sc2 P2 Pb6' _cell_volume 455.05235087 _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 0.76157255 0.76157255 0.24882722 1.0 Tm Tm1 1 0.23842745 0.00000000 0.24882722 1.0 Tm Tm2 1 1.00000000 0.23842745 0.24882722 1.0 Tm Tm3 1 0.23842745 0.23842745 0.75117278 1.0 Tm Tm4 1 0.76157255 1.00000000 0.75117278 1.0 Tm Tm5 1 0.00000000 0.76157255 0.75117278 1.0 Tm Tm6 1 0.66666700 0.33333300 0.50000000 1.0 Tm Tm7 1 0.33333300 0.66666700 0.50000000 1.0 Sc Sc8 1 0.33333300 0.66666700 0.00000000 1.0 Sc Sc9 1 0.66666700 0.33333300 0.00000000 1.0 P P10 1 0.00000000 0.00000000 0.50000000 1.0 P P11 1 0.00000000 0.00000000 0.00000000 1.0 Pb Pb12 1 0.40215120 0.40215120 0.24344095 1.0 Pb Pb13 1 0.59784880 1.00000000 0.24344095 1.0 Pb Pb14 1 0.00000000 0.59784880 0.24344095 1.0 Pb Pb15 1 0.59784880 0.59784880 0.75655905 1.0 Pb Pb16 1 0.40215120 0.00000000 0.75655905 1.0 Pb Pb17 1 1.00000000 0.40215120 0.75655905 1.0