# generated using pymatgen data_Na5Mn2P2(CO7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73180500 _cell_length_b 9.00593521 _cell_length_c 15.68195613 _cell_angle_alpha 90.68923374 _cell_angle_beta 90.12285279 _cell_angle_gamma 90.20423343 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Mn2P2(CO7)2 _chemical_formula_sum 'Na15 Mn6 P6 C6 O42' _cell_volume 950.66030278 _cell_formula_units_Z 3 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 0.25965900 0.07236400 0.74568400 1.0 Na Na1 1 0.00953900 0.25021400 0.25073700 1.0 Na Na2 1 0.49058600 0.25014300 0.25055300 1.0 Na Na3 1 0.00514900 0.25661500 0.57858400 1.0 Na Na4 1 0.49377900 0.25667100 0.57723000 1.0 Na Na5 1 0.00583400 0.25250000 0.92459000 1.0 Na Na6 1 0.49348700 0.25338000 0.92562000 1.0 Na Na7 1 0.50261600 0.74929000 0.08083000 1.0 Na Na8 1 0.99871700 0.74952400 0.07936300 1.0 Na Na9 1 0.50222300 0.74827800 0.41999200 1.0 Na Na10 1 0.00091000 0.74945500 0.41905200 1.0 Na Na11 1 0.98567600 0.73588700 0.74856600 1.0 Na Na12 1 0.75038300 0.92130100 0.25380300 1.0 Na Na13 1 0.73981500 0.91521600 0.59342000 1.0 Na Na14 1 0.74005600 0.91647500 0.91601500 1.0 Mn Mn15 1 0.75005500 0.35964100 0.07682400 1.0 Mn Mn16 1 0.75162500 0.35798300 0.40460100 1.0 Mn Mn17 1 0.74741500 0.35749300 0.74009100 1.0 Mn Mn18 1 0.25044600 0.64621600 0.26101600 1.0 Mn Mn19 1 0.25816300 0.64688000 0.59810400 1.0 Mn Mn20 1 0.25535200 0.64802100 0.92248700 1.0 P P21 1 0.25005400 0.42401600 0.09913000 1.0 P P22 1 0.25107400 0.42113600 0.43121900 1.0 P P23 1 0.24713900 0.41589800 0.76579000 1.0 P P24 1 0.75039000 0.58602400 0.23404800 1.0 P P25 1 0.75198300 0.58461000 0.56453000 1.0 P P26 1 0.75205300 0.58028000 0.90161800 1.0 C C27 1 0.75006700 0.06145500 0.08945400 1.0 C C28 1 0.75022000 0.06316200 0.42316400 1.0 C C29 1 0.75374600 0.06556000 0.75693400 1.0 C C30 1 0.25019400 0.92472900 0.24260100 1.0 C C31 1 0.24651300 0.93486200 0.57744500 1.0 C C32 1 0.24588500 0.93403900 0.90689900 1.0 O O33 1 0.24930300 0.06392100 0.24257200 1.0 O O34 1 0.24874200 0.07664300 0.58058800 1.0 O O35 1 0.25078900 0.07581000 0.90482800 1.0 O O36 1 0.74924200 0.12334200 0.01478500 1.0 O O37 1 0.74979000 0.13096900 0.34933600 1.0 O O38 1 0.74640000 0.13501600 0.68327600 1.0 O O39 1 0.74986900 0.14660400 0.15756900 1.0 O O40 1 0.74980600 0.14423200 0.49210000 1.0 O O41 1 0.74479700 0.14688700 0.82628600 1.0 O O42 1 0.06314600 0.33266500 0.07711700 1.0 O O43 1 0.43650500 0.33311500 0.07737200 1.0 O O44 1 0.06347000 0.33019800 0.40623400 1.0 O O45 1 0.43962900 0.33193600 0.40691100 1.0 O O46 1 0.06423100 0.31583400 0.74366600 1.0 O O47 1 0.43229100 0.32213300 0.74087500 1.0 O O48 1 0.25006900 0.45409000 0.20019000 1.0 O O49 1 0.75005900 0.42907300 0.27301500 1.0 O O50 1 0.25068000 0.44912600 0.53053700 1.0 O O51 1 0.74802800 0.43141900 0.60803200 1.0 O O52 1 0.25064100 0.44463400 0.86563900 1.0 O O53 1 0.75119300 0.42742800 0.94533200 1.0 O O54 1 0.25042400 0.57661100 0.05488700 1.0 O O55 1 0.75027000 0.57244700 0.13511700 1.0 O O56 1 0.25104500 0.57525600 0.38695200 1.0 O O57 1 0.76024700 0.56112100 0.46499000 1.0 O O58 1 0.23864000 0.56603300 0.72131100 1.0 O O59 1 0.75792700 0.55509500 0.80344800 1.0 O O60 1 0.56611100 0.67905200 0.26275800 1.0 O O61 1 0.93518900 0.67931500 0.26308500 1.0 O O62 1 0.56543400 0.67993700 0.58370500 1.0 O O63 1 0.93522500 0.67930400 0.59233400 1.0 O O64 1 0.56810500 0.67504500 0.92849900 1.0 O O65 1 0.93631700 0.67721500 0.92789600 1.0 O O66 1 0.25018300 0.83866900 0.17525800 1.0 O O67 1 0.25065700 0.85546100 0.50846900 1.0 O O68 1 0.23205100 0.85340100 0.83825300 1.0 O O69 1 0.25126100 0.84874300 0.31492300 1.0 O O70 1 0.24205500 0.86200300 0.64964200 1.0 O O71 1 0.25736600 0.86050400 0.97911000 1.0 O O72 1 0.75101400 0.91922500 0.09651700 1.0 O O73 1 0.75098000 0.92064400 0.42592000 1.0 O O74 1 0.76791400 0.92482600 0.75876800 1.0