# generated using pymatgen data_Nb2Co4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.91821975 _cell_length_b 11.91821975 _cell_length_c 3.60721700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999862 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2Co4P3 _chemical_formula_sum 'Nb8 Co16 P12' _cell_volume 443.73704236 _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 0.82394500 0.00000000 0.50000000 1.0 Nb Nb1 1 0.00000000 0.82394500 0.50000000 1.0 Nb Nb2 1 0.17605500 0.17605500 0.50000000 1.0 Nb Nb3 1 0.33333300 0.66666700 0.00000000 1.0 Nb Nb4 1 0.66666700 0.33333300 0.00000000 1.0 Nb Nb5 1 0.44770400 0.00000000 0.00000000 1.0 Nb Nb6 1 0.00000000 0.44770400 0.00000000 1.0 Nb Nb7 1 0.55229600 0.55229600 0.00000000 1.0 Co Co8 1 0.27578100 0.00000000 0.50000000 1.0 Co Co9 1 0.00000000 0.27578100 0.50000000 1.0 Co Co10 1 0.72421900 0.72421900 0.50000000 1.0 Co Co11 1 0.62940900 0.80804900 0.00000000 1.0 Co Co12 1 0.19195100 0.82136000 0.00000000 1.0 Co Co13 1 0.17864000 0.37059100 0.00000000 1.0 Co Co14 1 0.37059100 0.17864000 0.00000000 1.0 Co Co15 1 0.80804900 0.62940900 0.00000000 1.0 Co Co16 1 0.82136000 0.19195100 0.00000000 1.0 Co Co17 1 0.51688500 0.87090300 0.50000000 1.0 Co Co18 1 0.12909700 0.64598200 0.50000000 1.0 Co Co19 1 0.35401800 0.48311500 0.50000000 1.0 Co Co20 1 0.48311500 0.35401800 0.50000000 1.0 Co Co21 1 0.87090300 0.51688500 0.50000000 1.0 Co Co22 1 0.64598200 0.12909700 0.50000000 1.0 Co Co23 1 0.00000000 0.00000000 0.00000000 1.0 P P24 1 0.17584900 0.00000000 0.00000000 1.0 P P25 1 0.00000000 0.17584900 0.00000000 1.0 P P26 1 0.82415100 0.82415100 0.00000000 1.0 P P27 1 0.51607600 0.68788700 0.50000000 1.0 P P28 1 0.31211300 0.82818900 0.50000000 1.0 P P29 1 0.17181100 0.48392400 0.50000000 1.0 P P30 1 0.48392400 0.17181100 0.50000000 1.0 P P31 1 0.68788700 0.51607600 0.50000000 1.0 P P32 1 0.82818900 0.31211300 0.50000000 1.0 P P33 1 0.65027500 0.00000000 0.00000000 1.0 P P34 1 0.00000000 0.65027500 0.00000000 1.0 P P35 1 0.34972500 0.34972500 0.00000000 1.0