# generated using pymatgen data_NaCo2P2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.25761300 _cell_length_b 7.49620800 _cell_length_c 14.20491000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaCo2P2O9 _chemical_formula_sum 'Na4 Co8 P8 O36' _cell_volume 666.32915466 _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 Na Na0 1 0.75000000 0.89028700 0.77888900 1.0 Na Na1 1 0.75000000 0.60971300 0.27888900 1.0 Na Na2 1 0.25000000 0.39028700 0.72111100 1.0 Na Na3 1 0.25000000 0.10971300 0.22111100 1.0 Co Co4 1 0.75000000 0.35544600 0.87347000 1.0 Co Co5 1 0.25000000 0.64455400 0.12653000 1.0 Co Co6 1 0.25000000 0.85544600 0.62653000 1.0 Co Co7 1 0.75000000 0.14455400 0.37347000 1.0 Co Co8 1 0.50000000 0.00000000 0.00000000 1.0 Co Co9 1 0.50000000 0.50000000 0.50000000 1.0 Co Co10 1 0.00000000 0.50000000 0.50000000 1.0 Co Co11 1 0.00000000 0.00000000 0.00000000 1.0 P P12 1 0.25000000 0.36095900 0.93588300 1.0 P P13 1 0.75000000 0.63904100 0.06411700 1.0 P P14 1 0.75000000 0.86095900 0.56411700 1.0 P P15 1 0.25000000 0.13904100 0.43588300 1.0 P P16 1 0.75000000 0.39119700 0.68784200 1.0 P P17 1 0.75000000 0.10880300 0.18784200 1.0 P P18 1 0.25000000 0.89119700 0.81215800 1.0 P P19 1 0.25000000 0.60880300 0.31215800 1.0 O O20 1 0.04737800 0.59772200 0.37525100 1.0 O O21 1 0.54737800 0.40227800 0.62474900 1.0 O O22 1 0.95262200 0.09772200 0.12474900 1.0 O O23 1 0.45262200 0.90227800 0.87525100 1.0 O O24 1 0.95262200 0.40227800 0.62474900 1.0 O O25 1 0.45262200 0.59772200 0.37525100 1.0 O O26 1 0.04737800 0.90227800 0.87525100 1.0 O O27 1 0.54737800 0.09772200 0.12474900 1.0 O O28 1 0.25000000 0.32830700 0.48427800 1.0 O O29 1 0.75000000 0.67169300 0.51572200 1.0 O O30 1 0.75000000 0.82830700 0.01572200 1.0 O O31 1 0.25000000 0.17169300 0.98427800 1.0 O O32 1 0.75000000 0.12791600 0.95389000 1.0 O O33 1 0.25000000 0.87208400 0.04611000 1.0 O O34 1 0.25000000 0.62791600 0.54611000 1.0 O O35 1 0.75000000 0.37208400 0.45389000 1.0 O O36 1 0.75000000 0.21761100 0.74762200 1.0 O O37 1 0.25000000 0.78238900 0.25237800 1.0 O O38 1 0.25000000 0.71761100 0.75237800 1.0 O O39 1 0.75000000 0.28238900 0.24762200 1.0 O O40 1 0.44580800 0.13602600 0.36899400 1.0 O O41 1 0.94580800 0.86397400 0.63100600 1.0 O O42 1 0.55419200 0.63602600 0.13100600 1.0 O O43 1 0.05419200 0.36397400 0.86899400 1.0 O O44 1 0.55419200 0.86397400 0.63100600 1.0 O O45 1 0.05419200 0.13602600 0.36899400 1.0 O O46 1 0.44580800 0.36397400 0.86899400 1.0 O O47 1 0.94580800 0.63602600 0.13100600 1.0 O O48 1 0.75000000 0.49030200 0.99317100 1.0 O O49 1 0.25000000 0.03914000 0.73487000 1.0 O O50 1 0.25000000 0.46086000 0.23487000 1.0 O O51 1 0.75000000 0.53914000 0.76513000 1.0 O O52 1 0.75000000 0.00969800 0.49317100 1.0 O O53 1 0.25000000 0.99030200 0.50682900 1.0 O O54 1 0.25000000 0.50969800 0.00682900 1.0 O O55 1 0.75000000 0.96086000 0.26513000 1.0