# generated using pymatgen data_Na(Ti3Se4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.82603261 _cell_length_b 9.77220311 _cell_length_c 3.67508727 _cell_angle_alpha 90.00074893 _cell_angle_beta 90.00686240 _cell_angle_gamma 120.28009655 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na(Ti3Se4)2 _chemical_formula_sum 'Na1 Ti6 Se8' _cell_volume 304.74477463 _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 0.00000088 0.00000216 0.50000111 1.0 Ti Ti1 1 0.12659827 0.49145142 0.74931936 1.0 Ti Ti2 1 0.51080382 0.63765534 0.74934926 1.0 Ti Ti3 1 0.36400259 0.87328403 0.74933521 1.0 Ti Ti4 1 0.87337145 0.50851637 0.25066936 1.0 Ti Ti5 1 0.48920687 0.36233823 0.25066381 1.0 Ti Ti6 1 0.63601064 0.12674397 0.25067651 1.0 Se Se7 1 0.66684146 0.33306496 0.75048332 1.0 Se Se8 1 0.33316424 0.66694011 0.24952098 1.0 Se Se9 1 0.29650334 0.34379577 0.75096527 1.0 Se Se10 1 0.65665283 0.95376505 0.75107829 1.0 Se Se11 1 0.04628426 0.70286748 0.75107919 1.0 Se Se12 1 0.70350805 0.65619834 0.24901499 1.0 Se Se13 1 0.34337295 0.04626998 0.24894350 1.0 Se Se14 1 0.95367836 0.29710676 0.24889984 1.0