# generated using pymatgen data_Ta5VS _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.09899164 _cell_length_b 7.46213586 _cell_length_c 7.50823731 _cell_angle_alpha 114.08136470 _cell_angle_beta 98.86779402 _cell_angle_gamma 108.28092277 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta5VS _chemical_formula_sum 'Ta10 V2 S2' _cell_volume 234.17198872 _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 Ta Ta0 1 0.55751020 0.78169524 0.59671355 1.0 Ta Ta1 1 0.44248980 0.21830476 0.40328645 1.0 Ta Ta2 1 0.99615726 0.35994224 0.28601686 1.0 Ta Ta3 1 0.15100393 0.72410975 0.14576853 1.0 Ta Ta4 1 0.22558803 0.06552698 0.70212497 1.0 Ta Ta5 1 0.52694665 0.58031456 0.86498870 1.0 Ta Ta6 1 0.77441197 0.93447302 0.29787503 1.0 Ta Ta7 1 0.84899607 0.27589025 0.85423147 1.0 Ta Ta8 1 0.00384274 0.64005776 0.71398314 1.0 Ta Ta9 1 0.47305335 0.41968544 0.13501130 1.0 V V10 1 0.50000000 0.00000000 0.00000000 1.0 V V11 1 0.00000000 0.00000000 0.00000000 1.0 S S12 1 0.06268538 0.29851921 0.58426717 1.0 S S13 1 0.93731462 0.70148079 0.41573283 1.0