# generated using pymatgen data_Tm2Ta3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.97430941 _cell_length_b 6.81190670 _cell_length_c 6.95899705 _cell_angle_alpha 71.17855774 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2Ta3Si4 _chemical_formula_sum 'Tm4 Ta6 Si8' _cell_volume 312.93222685 _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 Tm Tm0 1 0.32986444 0.56428206 0.81259486 1.0 Tm Tm1 1 0.82986444 0.93571794 0.18740514 1.0 Tm Tm2 1 0.67013556 0.43571794 0.18740514 1.0 Tm Tm3 1 0.17013556 0.06428206 0.81259486 1.0 Ta Ta4 1 0.50000000 0.00000000 0.50000000 1.0 Ta Ta5 1 0.00000000 0.50000000 0.50000000 1.0 Ta Ta6 1 0.82275271 0.74743298 0.74481187 1.0 Ta Ta7 1 0.32275271 0.75256702 0.25518813 1.0 Ta Ta8 1 0.17724729 0.25256702 0.25518813 1.0 Ta Ta9 1 0.67724729 0.24743298 0.74481187 1.0 Si Si10 1 0.53464226 0.86573837 0.91771204 1.0 Si Si11 1 0.03464226 0.63426163 0.08228796 1.0 Si Si12 1 0.46535774 0.13426163 0.08228796 1.0 Si Si13 1 0.96535774 0.36573837 0.91771204 1.0 Si Si14 1 0.12543129 0.87146597 0.50847511 1.0 Si Si15 1 0.62543129 0.62853403 0.49152489 1.0 Si Si16 1 0.87456871 0.12853403 0.49152489 1.0 Si Si17 1 0.37456871 0.37146597 0.50847511 1.0