# generated using pymatgen data_Na5Ni2P2(CO7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.40690100 _cell_length_b 8.41764743 _cell_length_c 10.18118159 _cell_angle_alpha 107.40831387 _cell_angle_beta 107.75332799 _cell_angle_gamma 103.35538251 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Ni2P2(CO7)2 _chemical_formula_sum 'Na10 Ni4 P4 C4 O28' _cell_volume 612.20644913 _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 Na Na0 1 0.48579900 0.97389200 0.73089100 1.0 Na Na1 1 0.72545700 0.73771800 0.73047800 1.0 Na Na2 1 0.77410500 0.75079000 0.27105500 1.0 Na Na3 1 0.05613600 0.79653700 0.08475300 1.0 Na Na4 1 0.56855600 0.30921900 0.08554200 1.0 Na Na5 1 0.94151600 0.20134600 0.92110600 1.0 Na Na6 1 0.24074300 0.25219700 0.73267300 1.0 Na Na7 1 0.00412800 0.49143800 0.73202500 1.0 Na Na8 1 0.26314800 0.25682700 0.27054200 1.0 Na Na9 1 0.50982300 0.01399700 0.26455800 1.0 Ni Ni10 1 0.06218500 0.81427900 0.65350400 1.0 Ni Ni11 1 0.42965200 0.68435400 0.34454600 1.0 Ni Ni12 1 0.56332700 0.31187600 0.65305400 1.0 Ni Ni13 1 0.93752800 0.19219000 0.34482000 1.0 P P14 1 0.19474100 0.94591400 0.42174200 1.0 P P15 1 0.69093900 0.44103900 0.41990400 1.0 P P16 1 0.30099800 0.55400000 0.57608500 1.0 P P17 1 0.80810500 0.05685300 0.58167200 1.0 C C18 1 0.23718400 0.98744300 0.93612100 1.0 C C19 1 0.26396700 0.51303000 0.06711700 1.0 C C20 1 0.73347100 0.48803400 0.93170700 1.0 C C21 1 0.76682300 0.01250200 0.06542800 1.0 O O22 1 0.68303200 0.93212600 0.92347500 1.0 O O23 1 0.91516900 0.97867000 0.68224500 1.0 O O24 1 0.83747100 0.58806700 0.56632700 1.0 O O25 1 0.43358200 0.68446400 0.53856600 1.0 O O26 1 0.06571100 0.82312300 0.45967100 1.0 O O27 1 0.65984300 0.90659500 0.43098500 1.0 O O28 1 0.27868800 0.83851200 0.32256400 1.0 O O29 1 0.57985900 0.52125700 0.31870200 1.0 O O30 1 0.75826900 0.32349300 0.31823400 1.0 O O31 1 0.71778400 0.96452100 0.16077200 1.0 O O32 1 0.21367900 0.45844800 0.16023600 1.0 O O33 1 0.40359400 0.65862400 0.13182200 1.0 O O34 1 0.91033800 0.15322900 0.12297100 1.0 O O35 1 0.81163200 0.57314100 0.07336000 1.0 O O36 1 0.18035100 0.42991600 0.92482100 1.0 O O37 1 0.09464900 0.84461800 0.87666500 1.0 O O38 1 0.59248500 0.34116300 0.87013400 1.0 O O39 1 0.78989000 0.53680200 0.83832800 1.0 O O40 1 0.29032800 0.04118100 0.84387500 1.0 O O41 1 0.22483200 0.66544300 0.67320700 1.0 O O42 1 0.41408200 0.47855200 0.67457500 1.0 O O43 1 0.72736800 0.16222600 0.67979700 1.0 O O44 1 0.34240300 0.09190200 0.56980000 1.0 O O45 1 0.93566100 0.18568100 0.54504400 1.0 O O46 1 0.55871600 0.31439400 0.45669800 1.0 O O47 1 0.15738900 0.40637400 0.43020500 1.0 O O48 1 0.08865800 0.02191500 0.31860400 1.0 O O49 1 0.31926200 0.07329700 0.07932100 1.0