# generated using pymatgen data_Nb4V4GaP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.41072050 _cell_length_b 6.47851794 _cell_length_c 7.81917737 _cell_angle_alpha 89.68792586 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4V4GaP3 _chemical_formula_sum 'Nb4 V4 Ga1 P3' _cell_volume 172.77321708 _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 Nb Nb0 1 0.25000000 0.03721011 0.82971288 1.0 Nb Nb1 1 0.25000000 0.54113744 0.67179540 1.0 Nb Nb2 1 0.75000000 0.96787555 0.16006607 1.0 Nb Nb3 1 0.75000000 0.44496510 0.33014488 1.0 V V4 1 0.25000000 0.13954264 0.44492033 1.0 V V5 1 0.25000000 0.62845859 0.05215773 1.0 V V6 1 0.75000000 0.87553451 0.56725462 1.0 V V7 1 0.75000000 0.36680354 0.94129199 1.0 Ga Ga8 1 0.25000000 0.75512722 0.36003406 1.0 P P9 1 0.25000000 0.25685149 0.13840771 1.0 P P10 1 0.75000000 0.24619094 0.64142825 1.0 P P11 1 0.75000000 0.74030288 0.86278809 1.0