# generated using pymatgen data_Co3P3O11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.60362200 _cell_length_b 9.69726100 _cell_length_c 10.51945992 _cell_angle_alpha 59.25344844 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3P3O11 _chemical_formula_sum 'Co12 P12 O44' _cell_volume 841.96051487 _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 Co Co0 1 0.36794100 0.27413100 0.86470400 1.0 Co Co1 1 0.12593600 0.09281600 0.72840900 1.0 Co Co2 1 0.85684700 0.10892800 0.86467200 1.0 Co Co3 1 0.35684700 0.89107200 0.63532800 1.0 Co Co4 1 0.64315300 0.10892800 0.36467200 1.0 Co Co5 1 0.87406400 0.90718400 0.27159100 1.0 Co Co6 1 0.13205900 0.27413100 0.36470400 1.0 Co Co7 1 0.86794100 0.72586900 0.63529600 1.0 Co Co8 1 0.14315300 0.89107200 0.13532800 1.0 Co Co9 1 0.37406400 0.09281600 0.22840900 1.0 Co Co10 1 0.63205900 0.72586900 0.13529600 1.0 Co Co11 1 0.62593600 0.90718400 0.77159100 1.0 P P12 1 0.83583000 0.10024800 0.56346900 1.0 P P13 1 0.06444400 0.40834800 0.75626000 1.0 P P14 1 0.41647800 0.23630900 0.57448000 1.0 P P15 1 0.93555600 0.59165200 0.24374000 1.0 P P16 1 0.16417000 0.89975200 0.43653100 1.0 P P17 1 0.91647800 0.76369100 0.92552000 1.0 P P18 1 0.33583000 0.89975200 0.93653100 1.0 P P19 1 0.58352200 0.76369100 0.42552000 1.0 P P20 1 0.66417000 0.10024800 0.06346900 1.0 P P21 1 0.43555600 0.40834800 0.25626000 1.0 P P22 1 0.08352200 0.23630900 0.07448000 1.0 P P23 1 0.56444400 0.59165200 0.74374000 1.0 O O24 1 0.72801100 0.22565300 0.91713200 1.0 O O25 1 0.27198900 0.77434700 0.08286800 1.0 O O26 1 0.53742700 0.73333100 0.30463500 1.0 O O27 1 0.48687300 0.25834700 0.25282200 1.0 O O28 1 0.21835500 0.06916000 0.41154300 1.0 O O29 1 0.24458000 0.23468000 0.05594100 1.0 O O30 1 0.97319300 0.62052300 0.08109800 1.0 O O31 1 0.51312700 0.74165300 0.74717800 1.0 O O32 1 0.01628200 0.07995000 0.09163400 1.0 O O33 1 0.22161700 0.41962000 0.73486600 1.0 O O34 1 0.28164500 0.06916000 0.91154300 1.0 O O35 1 0.26632500 0.90008300 0.80182200 1.0 O O36 1 0.01817200 0.44292800 0.35083600 1.0 O O37 1 0.51628200 0.92005000 0.40836600 1.0 O O38 1 0.71835500 0.93084000 0.08845700 1.0 O O39 1 0.96257300 0.73333100 0.80463500 1.0 O O40 1 0.47319300 0.37947700 0.41890200 1.0 O O41 1 0.02680700 0.37947700 0.91890200 1.0 O O42 1 0.03742700 0.26666900 0.19536500 1.0 O O43 1 0.98687300 0.74165300 0.24717800 1.0 O O44 1 0.50398000 0.11311400 0.06366700 1.0 O O45 1 0.99602000 0.11311400 0.56366700 1.0 O O46 1 0.98371800 0.92005000 0.90836600 1.0 O O47 1 0.23367500 0.90008300 0.30182200 1.0 O O48 1 0.76632500 0.09991700 0.69817800 1.0 O O49 1 0.27838300 0.41962000 0.23486600 1.0 O O50 1 0.75542000 0.76532000 0.94405900 1.0 O O51 1 0.77838300 0.58038000 0.26513400 1.0 O O52 1 0.51817200 0.55707200 0.14916400 1.0 O O53 1 0.49602000 0.88688600 0.93633300 1.0 O O54 1 0.74458000 0.76532000 0.44405900 1.0 O O55 1 0.00398000 0.88688600 0.43633300 1.0 O O56 1 0.77198900 0.22565300 0.41713200 1.0 O O57 1 0.72161700 0.58038000 0.76513400 1.0 O O58 1 0.48371800 0.07995000 0.59163400 1.0 O O59 1 0.46257300 0.26666900 0.69536500 1.0 O O60 1 0.78164500 0.93084000 0.58845700 1.0 O O61 1 0.73367500 0.09991700 0.19817800 1.0 O O62 1 0.52680700 0.62052300 0.58109800 1.0 O O63 1 0.25542000 0.23468000 0.55594100 1.0 O O64 1 0.01312700 0.25834700 0.75282200 1.0 O O65 1 0.22801100 0.77434700 0.58286800 1.0 O O66 1 0.48182800 0.44292800 0.85083600 1.0 O O67 1 0.98182800 0.55707200 0.64916400 1.0