# generated using pymatgen data_Na3(TiS2)10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.08019762 _cell_length_b 9.08019762 _cell_length_c 13.03789869 _cell_angle_alpha 87.17728714 _cell_angle_beta 87.17728714 _cell_angle_gamma 141.74259724 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na3(TiS2)10 _chemical_formula_sum 'Na3 Ti10 S20' _cell_volume 658.06013182 _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 Na Na0 1 0.28057293 0.28057293 0.99895685 1.0 Na Na1 1 0.11111972 0.73077384 0.00171212 1.0 Na Na2 1 0.73077384 0.11111972 0.00171212 1.0 Ti Ti3 1 0.57572448 0.77417885 0.27291401 1.0 Ti Ti4 1 0.17877139 0.17877139 0.27513275 1.0 Ti Ti5 1 0.02314735 0.02314735 0.72747020 1.0 Ti Ti6 1 0.77417885 0.57572448 0.27291401 1.0 Ti Ti7 1 0.62551484 0.42698434 0.72763010 1.0 Ti Ti8 1 0.37441806 0.97386463 0.27316748 1.0 Ti Ti9 1 0.22538031 0.82462904 0.72621209 1.0 Ti Ti10 1 0.97386463 0.37441806 0.27316748 1.0 Ti Ti11 1 0.82462904 0.22538031 0.72621209 1.0 Ti Ti12 1 0.42698434 0.62551484 0.72763010 1.0 S S13 1 0.94806351 0.14653191 0.16082601 1.0 S S14 1 0.79344639 0.99354523 0.62028607 1.0 S S15 1 0.54765777 0.54765777 0.16100829 1.0 S S16 1 0.39299273 0.39299273 0.62054205 1.0 S S17 1 0.14653191 0.94806351 0.16082601 1.0 S S18 1 0.99354523 0.79344639 0.62028607 1.0 S S19 1 0.74375634 0.34373386 0.15934194 1.0 S S20 1 0.80651651 0.80651651 0.38057081 1.0 S S21 1 0.59364439 0.19407053 0.62018114 1.0 S S22 1 0.65728698 0.65728698 0.84006428 1.0 S S23 1 0.34373386 0.74375634 0.15934194 1.0 S S24 1 0.40772148 0.20672673 0.38060565 1.0 S S25 1 0.19407053 0.59364439 0.62018114 1.0 S S26 1 0.25490697 0.05507917 0.84001148 1.0 S S27 1 0.00690076 0.60707184 0.37969135 1.0 S S28 1 0.85294181 0.45232131 0.84054943 1.0 S S29 1 0.60707184 0.00690076 0.37969135 1.0 S S30 1 0.45232131 0.85294181 0.84054943 1.0 S S31 1 0.20672673 0.40772148 0.38060565 1.0 S S32 1 0.05507917 0.25490697 0.84001148 1.0