# generated using pymatgen data_Zr4Ti3NbP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57488083 _cell_length_b 6.77721546 _cell_length_c 8.25084802 _cell_angle_alpha 89.99042442 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Ti3NbP4 _chemical_formula_sum 'Zr4 Ti3 Nb1 P4' _cell_volume 199.89937824 _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 0.25000000 0.53754286 0.83161341 1.0 Zr Zr1 1 0.75000000 0.96326953 0.32926845 1.0 Zr Zr2 1 0.25000000 0.03807583 0.67155207 1.0 Zr Zr3 1 0.75000000 0.46461093 0.16664992 1.0 Ti Ti4 1 0.25000000 0.13377122 0.06048610 1.0 Ti Ti5 1 0.75000000 0.86406474 0.94098980 1.0 Ti Ti6 1 0.25000000 0.63492925 0.44091984 1.0 Nb Nb7 1 0.75000000 0.36226809 0.55870834 1.0 P P8 1 0.75000000 0.74080966 0.63985085 1.0 P P9 1 0.25000000 0.76181222 0.13855342 1.0 P P10 1 0.75000000 0.23712733 0.86663468 1.0 P P11 1 0.25000000 0.26171933 0.35477312 1.0