# generated using pymatgen data_Tm3Sc3TiBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99041461 _cell_length_b 7.99041366 _cell_length_c 4.25555038 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000394 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Sc3TiBi2 _chemical_formula_sum 'Tm3 Sc3 Ti1 Bi2' _cell_volume 235.30162615 _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 Tm Tm0 1 0.60192637 0.00000000 0.00000000 1.0 Tm Tm1 1 0.00000000 0.60192637 0.00000000 1.0 Tm Tm2 1 0.39807363 0.39807363 0.00000000 1.0 Sc Sc3 1 0.24079895 0.00000000 0.50000000 1.0 Sc Sc4 1 1.00000000 0.24079895 0.50000000 1.0 Sc Sc5 1 0.75920105 0.75920105 0.50000000 1.0 Ti Ti6 1 0.00000000 0.00000000 0.00000000 1.0 Bi Bi7 1 0.33333300 0.66666700 0.50000000 1.0 Bi Bi8 1 0.66666700 0.33333300 0.50000000 1.0