# generated using pymatgen data_Zr4Nb4GaP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57958175 _cell_length_b 6.98306763 _cell_length_c 8.46001725 _cell_angle_alpha 89.44177391 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Nb4GaP3 _chemical_formula_sum 'Zr4 Nb4 Ga1 P3' _cell_volume 211.46045842 _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 0.53354359 0.83898896 1.0 Zr Zr1 1 0.75000000 0.96056240 0.32958655 1.0 Zr Zr2 1 0.25000000 0.04685858 0.66869845 1.0 Zr Zr3 1 0.75000000 0.46314145 0.17099067 1.0 Nb Nb4 1 0.25000000 0.14145943 0.06029268 1.0 Nb Nb5 1 0.75000000 0.86757420 0.94605396 1.0 Nb Nb6 1 0.25000000 0.62877441 0.43267557 1.0 Nb Nb7 1 0.75000000 0.36000362 0.55687672 1.0 Ga Ga8 1 0.75000000 0.74370920 0.64146459 1.0 P P9 1 0.25000000 0.76103305 0.14064435 1.0 P P10 1 0.75000000 0.23965363 0.85583208 1.0 P P11 1 0.25000000 0.25368643 0.35789542 1.0