# generated using pymatgen data_ZrSc3Tc8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.21813878 _cell_length_b 5.21813908 _cell_length_c 8.59134033 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000428 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrSc3Tc8 _chemical_formula_sum 'Zr1 Sc3 Tc8' _cell_volume 202.59224275 _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 Zr Zr0 1 0.33333300 0.66666700 0.43696969 1.0 Sc Sc1 1 0.66666700 0.33333300 0.56403608 1.0 Sc Sc2 1 0.66666700 0.33333300 0.93789754 1.0 Sc Sc3 1 0.33333300 0.66666700 0.06070095 1.0 Tc Tc4 1 0.00000000 0.00000000 0.49994704 1.0 Tc Tc5 1 0.00000000 0.00000000 0.00085306 1.0 Tc Tc6 1 0.82770053 0.17229947 0.24995722 1.0 Tc Tc7 1 0.82770053 0.65540206 0.24995722 1.0 Tc Tc8 1 0.34459794 0.17229947 0.24995722 1.0 Tc Tc9 1 0.17180097 0.82819903 0.74990866 1.0 Tc Tc10 1 0.17180097 0.34360094 0.74990866 1.0 Tc Tc11 1 0.65639906 0.82819903 0.74990866 1.0