# generated using pymatgen data_ZrTi3Nb2Si3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.87940561 _cell_length_b 6.87940464 _cell_length_c 3.61285122 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.25293610 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTi3Nb2Si3 _chemical_formula_sum 'Zr1 Ti3 Nb2 Si3' _cell_volume 147.69640313 _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 0.58943547 0.58943447 0.50000000 1.0 Ti Ti1 1 0.74909286 0.00061581 0.00000000 1.0 Ti Ti2 1 0.25318373 0.25318273 0.00000000 1.0 Ti Ti3 1 0.00061581 0.74909286 0.00000000 1.0 Nb Nb4 1 0.40825007 0.99870527 0.50000000 1.0 Nb Nb5 1 0.99870527 0.40825007 0.50000000 1.0 Si Si6 1 0.66811918 0.32786135 0.00000000 1.0 Si Si7 1 0.32786035 0.66811818 0.00000000 1.0 Si Si8 1 0.00473926 0.00473926 0.50000000 1.0