# generated using pymatgen data_Nb5Cr(Co3P2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.64201960 _cell_length_b 11.64201848 _cell_length_c 3.55959521 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.97426553 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb5Cr(Co3P2)6 _chemical_formula_sum 'Nb5 Cr1 Co18 P12' _cell_volume 417.92698818 _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 0.66746814 0.33451942 0.00000000 1.0 Nb Nb1 1 0.33451942 0.66746814 0.00000000 1.0 Nb Nb2 1 0.17838020 0.17838020 0.50000000 1.0 Nb Nb3 1 0.82023955 0.00023395 0.50000000 1.0 Nb Nb4 1 0.00023395 0.82023955 0.50000000 1.0 Cr Cr5 1 0.55561958 0.55561958 0.00000000 1.0 Co Co6 1 0.44804907 0.00034415 0.00000000 1.0 Co Co7 1 0.00034415 0.44804907 0.00000000 1.0 Co Co8 1 0.81961187 0.19665716 0.00000000 1.0 Co Co9 1 0.80661092 0.62348504 0.00000000 1.0 Co Co10 1 0.37587841 0.17958979 0.00000000 1.0 Co Co11 1 0.19665716 0.81961187 0.00000000 1.0 Co Co12 1 0.62348504 0.80661092 0.00000000 1.0 Co Co13 1 0.17958979 0.37587841 0.00000000 1.0 Co Co14 1 0.64089896 0.12550443 0.50000000 1.0 Co Co15 1 0.87565765 0.51590165 0.50000000 1.0 Co Co16 1 0.48300262 0.35514483 0.50000000 1.0 Co Co17 1 0.12550443 0.64089896 0.50000000 1.0 Co Co18 1 0.51590165 0.87565765 0.50000000 1.0 Co Co19 1 0.35514483 0.48300262 0.50000000 1.0 Co Co20 1 0.71947057 0.71947057 0.50000000 1.0 Co Co21 1 0.28254725 0.00036303 0.50000000 1.0 Co Co22 1 0.00036303 0.28254725 0.50000000 1.0 Co Co23 1 0.00007274 0.00007274 0.00000000 1.0 P P24 1 0.35670642 0.35670642 0.00000000 1.0 P P25 1 0.63980903 0.00133416 0.00000000 1.0 P P26 1 0.00133416 0.63980903 0.00000000 1.0 P P27 1 0.83113985 0.31435777 0.50000000 1.0 P P28 1 0.68546498 0.51707426 0.50000000 1.0 P P29 1 0.48291454 0.16807588 0.50000000 1.0 P P30 1 0.31435777 0.83113985 0.50000000 1.0 P P31 1 0.51707426 0.68546498 0.50000000 1.0 P P32 1 0.16807588 0.48291454 0.50000000 1.0 P P33 1 0.82233813 0.82233813 0.00000000 1.0 P P34 1 0.17668130 0.99885371 0.00000000 1.0 P P35 1 0.99885371 0.17668130 0.00000000 1.0