# generated using pymatgen data_Ti6InSn4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.25985216 _cell_length_b 9.25991674 _cell_length_c 5.70908495 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99813382 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6InSn4 _chemical_formula_sum 'Ti12 In2 Sn8' _cell_volume 423.95175611 _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 0.84236480 0.68482113 0.75000000 1.0 Ti Ti1 1 0.15755720 0.84239545 0.25000000 1.0 Ti Ti2 1 0.68482716 0.84234436 0.25000000 1.0 Ti Ti3 1 0.31517284 0.15765564 0.75000000 1.0 Ti Ti4 1 0.84244280 0.15760455 0.75000000 1.0 Ti Ti5 1 0.15763520 0.31517887 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 In In12 1 0.00000000 0.00000000 0.50000000 1.0 In In13 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn14 1 0.19988649 0.39974303 0.75000000 1.0 Sn Sn15 1 0.80016614 0.19985496 0.25000000 1.0 Sn Sn16 1 0.39972384 0.19988434 0.25000000 1.0 Sn Sn17 1 0.60027616 0.80011566 0.75000000 1.0 Sn Sn18 1 0.19983386 0.80014504 0.75000000 1.0 Sn Sn19 1 0.80011351 0.60025697 0.25000000 1.0 Sn Sn20 1 0.66666028 0.33336294 0.75000000 1.0 Sn Sn21 1 0.33333972 0.66663706 0.25000000 1.0