# generated using pymatgen data_Ti6CdSn4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.22083086 _cell_length_b 9.22083138 _cell_length_c 5.71829839 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000168 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6CdSn4 _chemical_formula_sum 'Ti12 Cd2 Sn8' _cell_volume 421.05378332 _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 Ti Ti0 1 0.84211447 0.68422893 0.75000000 1.0 Ti Ti1 1 0.15788553 0.84211447 0.25000000 1.0 Ti Ti2 1 0.68422893 0.84211447 0.25000000 1.0 Ti Ti3 1 0.31577107 0.15788553 0.75000000 1.0 Ti Ti4 1 0.84211447 0.15788553 0.75000000 1.0 Ti Ti5 1 0.15788553 0.31577107 0.25000000 1.0 Ti Ti6 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti7 1 0.50000000 0.50000000 0.00000000 1.0 Ti Ti8 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti9 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti10 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti11 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd12 1 0.00000000 0.00000000 0.50000000 1.0 Cd Cd13 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn14 1 0.19567808 0.39135616 0.75000000 1.0 Sn Sn15 1 0.80432192 0.19567808 0.25000000 1.0 Sn Sn16 1 0.39135616 0.19567808 0.25000000 1.0 Sn Sn17 1 0.60864384 0.80432192 0.75000000 1.0 Sn Sn18 1 0.19567808 0.80432192 0.75000000 1.0 Sn Sn19 1 0.80432192 0.60864384 0.25000000 1.0 Sn Sn20 1 0.66666700 0.33333300 0.75000000 1.0 Sn Sn21 1 0.33333300 0.66666700 0.25000000 1.0