# generated using pymatgen data_Ti3Nb4VP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.45897045 _cell_length_b 6.46412748 _cell_length_c 7.95338846 _cell_angle_alpha 90.31815240 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Nb4VP4 _chemical_formula_sum 'Ti3 Nb4 V1 P4' _cell_volume 177.82886809 _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 Ti Ti0 1 0.25000000 0.14593777 0.43835551 1.0 Ti Ti1 1 0.25000000 0.63585099 0.05961564 1.0 Ti Ti2 1 0.75000000 0.85968262 0.56302079 1.0 Nb Nb3 1 0.25000000 0.03958345 0.83156105 1.0 Nb Nb4 1 0.25000000 0.53505652 0.67397717 1.0 Nb Nb5 1 0.75000000 0.96571963 0.17016271 1.0 Nb Nb6 1 0.75000000 0.46301992 0.32296368 1.0 V V7 1 0.75000000 0.35878646 0.94038491 1.0 P P8 1 0.25000000 0.76080617 0.36060925 1.0 P P9 1 0.25000000 0.25801346 0.13340151 1.0 P P10 1 0.75000000 0.24028584 0.64467317 1.0 P P11 1 0.75000000 0.73725717 0.86127359 1.0