# generated using pymatgen data_Nb8P5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.44918400 _cell_length_b 9.43412400 _cell_length_c 26.68277200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8P5 _chemical_formula_sum 'Nb32 P20' _cell_volume 868.25818948 _cell_formula_units_Z 4 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 0.50000000 0.58327500 0.37916900 1.0 Nb Nb1 1 0.50000000 0.92008700 0.62308500 1.0 Nb Nb2 1 0.50000000 0.41672500 0.87916900 1.0 Nb Nb3 1 0.50000000 0.07991300 0.12308500 1.0 Nb Nb4 1 0.00000000 0.66268300 0.17496600 1.0 Nb Nb5 1 0.00000000 0.83769900 0.82589600 1.0 Nb Nb6 1 0.00000000 0.33731700 0.67496600 1.0 Nb Nb7 1 0.00000000 0.16230100 0.32589600 1.0 Nb Nb8 1 0.50000000 0.42503300 0.12666500 1.0 Nb Nb9 1 0.50000000 0.08115900 0.87541200 1.0 Nb Nb10 1 0.50000000 0.57496700 0.62666500 1.0 Nb Nb11 1 0.50000000 0.91884100 0.37541200 1.0 Nb Nb12 1 0.50000000 0.47843500 0.00131800 1.0 Nb Nb13 1 0.50000000 0.01781700 0.99519500 1.0 Nb Nb14 1 0.50000000 0.52156500 0.50131800 1.0 Nb Nb15 1 0.50000000 0.98218300 0.49519500 1.0 Nb Nb16 1 0.00000000 0.25002700 0.50117300 1.0 Nb Nb17 1 0.00000000 0.74997300 0.00117300 1.0 Nb Nb18 1 0.50000000 0.25257300 0.23605300 1.0 Nb Nb19 1 0.50000000 0.24835300 0.76527700 1.0 Nb Nb20 1 0.50000000 0.74742700 0.73605300 1.0 Nb Nb21 1 0.50000000 0.75164700 0.26527700 1.0 Nb Nb22 1 0.50000000 0.25416900 0.41667000 1.0 Nb Nb23 1 0.50000000 0.24839600 0.58400300 1.0 Nb Nb24 1 0.50000000 0.74583100 0.91667000 1.0 Nb Nb25 1 0.50000000 0.75160400 0.08400300 1.0 Nb Nb26 1 0.00000000 0.49987600 0.28349400 1.0 Nb Nb27 1 0.00000000 0.00072100 0.71641000 1.0 Nb Nb28 1 0.00000000 0.50012400 0.78349400 1.0 Nb Nb29 1 0.00000000 0.99927900 0.21641000 1.0 Nb Nb30 1 0.00000000 0.75261400 0.44781400 1.0 Nb Nb31 1 0.00000000 0.24738600 0.94781400 1.0 P P32 1 0.00000000 0.54598400 0.07254000 1.0 P P33 1 0.00000000 0.94860600 0.92726600 1.0 P P34 1 0.00000000 0.45401600 0.57254000 1.0 P P35 1 0.00000000 0.05139400 0.42726600 1.0 P P36 1 0.50000000 0.50639600 0.21396300 1.0 P P37 1 0.50000000 0.99342000 0.78594100 1.0 P P38 1 0.50000000 0.49360400 0.71396300 1.0 P P39 1 0.50000000 0.00658000 0.28594100 1.0 P P40 1 0.00000000 0.45920300 0.43520600 1.0 P P41 1 0.00000000 0.03568800 0.56488100 1.0 P P42 1 0.00000000 0.54079700 0.93520600 1.0 P P43 1 0.00000000 0.96431200 0.06488100 1.0 P P44 1 0.00000000 0.24409900 0.16143900 1.0 P P45 1 0.00000000 0.25612700 0.83778400 1.0 P P46 1 0.00000000 0.75590100 0.66143900 1.0 P P47 1 0.00000000 0.74387300 0.33778400 1.0 P P48 1 0.50000000 0.35651300 0.33015800 1.0 P P49 1 0.50000000 0.14210400 0.66972100 1.0 P P50 1 0.50000000 0.64348700 0.83015800 1.0 P P51 1 0.50000000 0.85789600 0.16972100 1.0