# generated using pymatgen data_Zr3Ti3Si2Sb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.09247574 _cell_length_b 7.09267745 _cell_length_c 3.84239937 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00107813 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Ti3Si2Sb _chemical_formula_sum 'Zr3 Ti3 Si2 Sb1' _cell_volume 167.39268866 _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 0.39438540 0.98484781 0.50000000 1.0 Zr Zr1 1 0.01513789 0.40941138 0.50000000 1.0 Zr Zr2 1 0.59054053 0.60571791 0.50000000 1.0 Ti Ti3 1 0.75837930 0.99054834 0.00000000 1.0 Ti Ti4 1 0.23218305 0.24162094 0.00000000 1.0 Ti Ti5 1 0.00936925 0.76780309 0.00000000 1.0 Si Si6 1 0.33335968 0.66669133 0.00000000 1.0 Si Si7 1 0.99998956 0.00001684 0.50000000 1.0 Sb Sb8 1 0.66665734 0.33334237 0.00000000 1.0