# generated using pymatgen data_TiNb3(VP)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.39753481 _cell_length_b 6.38871169 _cell_length_c 7.68941153 _cell_angle_alpha 90.27398405 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiNb3(VP)4 _chemical_formula_sum 'Ti1 Nb3 V4 P4' _cell_volume 166.90346160 _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 0.03984627 0.83156042 1.0 Nb Nb1 1 0.25000000 0.53807872 0.66852572 1.0 Nb Nb2 1 0.75000000 0.96061976 0.16738711 1.0 Nb Nb3 1 0.75000000 0.45803003 0.33138430 1.0 V V4 1 0.25000000 0.13640256 0.44309680 1.0 V V5 1 0.25000000 0.63505198 0.05617876 1.0 V V6 1 0.75000000 0.86545155 0.55822782 1.0 V V7 1 0.75000000 0.36615898 0.94189548 1.0 P P8 1 0.25000000 0.76000755 0.36121667 1.0 P P9 1 0.25000000 0.25779984 0.13580081 1.0 P P10 1 0.75000000 0.23561694 0.64504915 1.0 P P11 1 0.75000000 0.74693782 0.85967795 1.0