# generated using pymatgen data_Ti9NbSn6P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.11597684 _cell_length_b 8.11597715 _cell_length_c 5.50112508 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000277 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti9NbSn6P _chemical_formula_sum 'Ti9 Nb1 Sn6 P1' _cell_volume 313.80781480 _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 Ti Ti0 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti1 1 0.33333300 0.66666700 0.00000000 1.0 Ti Ti2 1 0.66666700 0.33333300 0.00000000 1.0 Ti Ti3 1 0.75114461 0.74938662 0.24742529 1.0 Ti Ti4 1 0.25061338 0.00175799 0.24742529 1.0 Ti Ti5 1 0.99824201 0.24885539 0.24742529 1.0 Ti Ti6 1 0.25061338 0.24885539 0.75257471 1.0 Ti Ti7 1 0.75114461 0.00175799 0.75257471 1.0 Ti Ti8 1 0.99824201 0.74938662 0.75257471 1.0 Nb Nb9 1 0.66666700 0.33333300 0.50000000 1.0 Sn Sn10 1 0.39144105 0.39433400 0.24603158 1.0 Sn Sn11 1 0.60566600 0.99710705 0.24603158 1.0 Sn Sn12 1 0.00289295 0.60855895 0.24603158 1.0 Sn Sn13 1 0.60566600 0.60855895 0.75396842 1.0 Sn Sn14 1 0.39144105 0.99710705 0.75396842 1.0 Sn Sn15 1 0.00289295 0.39433400 0.75396842 1.0 P P16 1 0.00000000 0.00000000 0.50000000 1.0