# generated using pymatgen data_Nb2V2GaP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.40896145 _cell_length_b 6.54717294 _cell_length_c 7.94155607 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2V2GaP _chemical_formula_sum 'Nb4 V4 Ga2 P2' _cell_volume 177.24806752 _cell_formula_units_Z 2 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 0.04209081 0.82579052 1.0 Nb Nb1 1 0.25000000 0.54209081 0.67420948 1.0 Nb Nb2 1 0.75000000 0.94766889 0.15840918 1.0 Nb Nb3 1 0.75000000 0.44766889 0.34159082 1.0 V V4 1 0.25000000 0.13626186 0.44891742 1.0 V V5 1 0.25000000 0.63626186 0.05108258 1.0 V V6 1 0.75000000 0.87504187 0.56878341 1.0 V V7 1 0.75000000 0.37504187 0.93121659 1.0 Ga Ga8 1 0.25000000 0.75372619 0.36193877 1.0 Ga Ga9 1 0.25000000 0.25372619 0.13806123 1.0 P P10 1 0.75000000 0.24521037 0.63956091 1.0 P P11 1 0.75000000 0.74521037 0.86043909 1.0