# generated using pymatgen data_Ti6VTc12W5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.38040877 _cell_length_b 6.19060428 _cell_length_c 13.12801154 _cell_angle_alpha 89.99994729 _cell_angle_beta 90.00035733 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6VTc12W5 _chemical_formula_sum 'Ti6 V1 Tc12 W5' _cell_volume 355.99724208 _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 0.00000000 0.00000000 0.00000000 1.0 Ti Ti1 1 0.49996709 0.50000000 0.16413164 1.0 Ti Ti2 1 0.99997080 1.00000000 0.33191584 1.0 Ti Ti3 1 0.49999900 0.50000000 0.50000000 1.0 Ti Ti4 1 0.00003020 0.00000000 0.66808516 1.0 Ti Ti5 1 0.50003191 0.50000000 0.83586836 1.0 V V6 1 0.00000000 0.50000000 0.00000000 1.0 Tc Tc7 1 0.49999900 0.25204795 0.00000000 1.0 Tc Tc8 1 0.49999900 0.74795205 1.00000000 1.0 Tc Tc9 1 0.99997617 0.25136725 0.16557394 1.0 Tc Tc10 1 0.99997617 0.74863275 0.16557394 1.0 Tc Tc11 1 0.49997089 0.25018325 0.33289096 1.0 Tc Tc12 1 0.49996989 0.74981675 0.33289096 1.0 Tc Tc13 1 0.00000000 0.24988277 0.50000000 1.0 Tc Tc14 1 0.00000000 0.75011723 0.50000000 1.0 Tc Tc15 1 0.50002911 0.25018325 0.66710904 1.0 Tc Tc16 1 0.50002811 0.74981675 0.66710904 1.0 Tc Tc17 1 0.00002483 0.25136725 0.83442606 1.0 Tc Tc18 1 0.00002483 0.74863275 0.83442606 1.0 W W19 1 0.49997716 0.00000000 0.16492965 1.0 W W20 1 0.99998303 0.50000000 0.33198916 1.0 W W21 1 0.49999900 0.00000000 0.50000000 1.0 W W22 1 0.00001797 0.50000000 0.66800984 1.0 W W23 1 0.50002184 1.00000000 0.83507035 1.0