# generated using pymatgen data_Cr4P9O32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.94349800 _cell_length_b 13.94349800 _cell_length_c 6.28832300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr4P9O32 _chemical_formula_sum 'Cr8 P18 O64' _cell_volume 1222.58290419 _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 Cr Cr0 1 0.11730800 0.19521100 0.12166000 1.0 Cr Cr1 1 0.19521100 0.88269200 0.87834000 1.0 Cr Cr2 1 0.61730800 0.30478900 0.37834000 1.0 Cr Cr3 1 0.69521100 0.61730800 0.62166000 1.0 Cr Cr4 1 0.30478900 0.38269200 0.62166000 1.0 Cr Cr5 1 0.38269200 0.69521100 0.37834000 1.0 Cr Cr6 1 0.88269200 0.80478900 0.12166000 1.0 Cr Cr7 1 0.80478900 0.11730800 0.87834000 1.0 P P8 1 0.10814300 0.24943900 0.63241500 1.0 P P9 1 0.56062600 0.80021600 0.61373500 1.0 P P10 1 0.80021600 0.43937400 0.38626500 1.0 P P11 1 0.75056100 0.10814300 0.36758500 1.0 P P12 1 0.43937400 0.19978400 0.61373500 1.0 P P13 1 0.30021600 0.06062600 0.11373500 1.0 P P14 1 0.19978400 0.56062600 0.38626500 1.0 P P15 1 0.25056100 0.39185700 0.13241500 1.0 P P16 1 0.69978400 0.93937400 0.11373500 1.0 P P17 1 0.60814300 0.25056100 0.86758500 1.0 P P18 1 0.24943900 0.89185700 0.36758500 1.0 P P19 1 0.00000000 0.00000000 0.00000000 1.0 P P20 1 0.39185700 0.74943900 0.86758500 1.0 P P21 1 0.89185700 0.75056100 0.63241500 1.0 P P22 1 0.93937400 0.30021600 0.88626500 1.0 P P23 1 0.50000000 0.50000000 0.50000000 1.0 P P24 1 0.06062600 0.69978400 0.88626500 1.0 P P25 1 0.74943900 0.60814300 0.13241500 1.0 O O26 1 0.63390700 0.31793100 0.68150700 1.0 O O27 1 0.68206900 0.63390700 0.31849300 1.0 O O28 1 0.21909300 0.50098000 0.17000100 1.0 O O29 1 0.75008000 0.34270300 0.35448400 1.0 O O30 1 0.25007800 0.00618000 0.93018700 1.0 O O31 1 0.92965600 0.40679500 0.92197400 1.0 O O32 1 0.49382000 0.24992200 0.43018700 1.0 O O33 1 0.56525400 0.56430900 0.63977200 1.0 O O34 1 0.93474600 0.06430900 0.86022800 1.0 O O35 1 0.43569100 0.56525400 0.36022800 1.0 O O36 1 0.99382000 0.25007800 0.06981300 1.0 O O37 1 0.33037400 0.83934000 0.87722800 1.0 O O38 1 0.57034400 0.90679500 0.57802600 1.0 O O39 1 0.42965600 0.09320500 0.57802600 1.0 O O40 1 0.18206900 0.86609300 0.18150700 1.0 O O41 1 0.19313500 0.89405400 0.57489700 1.0 O O42 1 0.93569100 0.93474600 0.13977200 1.0 O O43 1 0.74992200 0.99382000 0.93018700 1.0 O O44 1 0.06525400 0.93569100 0.86022800 1.0 O O45 1 0.30686500 0.39405400 0.92510300 1.0 O O46 1 0.83934000 0.66962600 0.12277200 1.0 O O47 1 0.09320500 0.57034400 0.42197400 1.0 O O48 1 0.50098000 0.78090700 0.82999900 1.0 O O49 1 0.75007800 0.49382000 0.56981300 1.0 O O50 1 0.16962600 0.33934000 0.62277200 1.0 O O51 1 0.74992000 0.84270300 0.14551600 1.0 O O52 1 0.36609300 0.68206900 0.68150700 1.0 O O53 1 0.16066000 0.33037400 0.12277200 1.0 O O54 1 0.80686500 0.10594600 0.57489700 1.0 O O55 1 0.56430900 0.43474600 0.36022800 1.0 O O56 1 0.40679500 0.07034400 0.07802600 1.0 O O57 1 0.24992200 0.50618000 0.56981300 1.0 O O58 1 0.07034400 0.59320500 0.92197400 1.0 O O59 1 0.69313500 0.60594600 0.92510300 1.0 O O60 1 0.34270300 0.24992000 0.64551600 1.0 O O61 1 0.24992000 0.65729700 0.35448400 1.0 O O62 1 0.49902000 0.21909300 0.82999900 1.0 O O63 1 0.81793100 0.13390700 0.18150700 1.0 O O64 1 0.15729700 0.74992000 0.85448400 1.0 O O65 1 0.25008000 0.15729700 0.14551600 1.0 O O66 1 0.66066000 0.16962600 0.37722800 1.0 O O67 1 0.83037400 0.66066000 0.62277200 1.0 O O68 1 0.71909300 0.99902000 0.32999900 1.0 O O69 1 0.66962600 0.16066000 0.87722800 1.0 O O70 1 0.90679500 0.42965600 0.42197400 1.0 O O71 1 0.89405400 0.80686500 0.42510300 1.0 O O72 1 0.06430900 0.06525400 0.13977200 1.0 O O73 1 0.31793100 0.36609300 0.31849300 1.0 O O74 1 0.84270300 0.25008000 0.85448400 1.0 O O75 1 0.65729700 0.75008000 0.64551600 1.0 O O76 1 0.99902000 0.28090700 0.67000100 1.0 O O77 1 0.59320500 0.92965600 0.07802600 1.0 O O78 1 0.60594600 0.30686500 0.07489700 1.0 O O79 1 0.78090700 0.49902000 0.17000100 1.0 O O80 1 0.28090700 0.00098000 0.32999900 1.0 O O81 1 0.50618000 0.75007800 0.43018700 1.0 O O82 1 0.00618000 0.74992200 0.06981300 1.0 O O83 1 0.86609300 0.81793100 0.81849300 1.0 O O84 1 0.13390700 0.18206900 0.81849300 1.0 O O85 1 0.00098000 0.71909300 0.67000100 1.0 O O86 1 0.43474600 0.43569100 0.63977200 1.0 O O87 1 0.33934000 0.83037400 0.37722800 1.0 O O88 1 0.39405400 0.69313500 0.07489700 1.0 O O89 1 0.10594600 0.19313500 0.42510300 1.0