# generated using pymatgen data_Na9Fe10(SiO3)20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.80899200 _cell_length_b 10.38722803 _cell_length_c 11.26935624 _cell_angle_alpha 94.92037743 _cell_angle_beta 98.33949567 _cell_angle_gamma 99.05196718 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na9Fe10(SiO3)20 _chemical_formula_sum 'Na9 Fe10 Si20 O60' _cell_volume 1114.97512239 _cell_formula_units_Z 1 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 0.99049100 0.71304200 0.98143400 1.0 Na Na1 1 0.80898400 0.48761400 0.61847400 1.0 Na Na2 1 0.78979300 0.91282100 0.58058500 1.0 Na Na3 1 0.60879300 0.68829800 0.21889700 1.0 Na Na4 1 0.39169500 0.31185200 0.78198200 1.0 Na Na5 1 0.41154400 0.88848100 0.82002300 1.0 Na Na6 1 0.21031600 0.08827900 0.41876300 1.0 Na Na7 1 0.19013800 0.51099400 0.38043800 1.0 Na Na8 1 0.00801600 0.28775200 0.01891000 1.0 Fe Fe9 1 0.86891000 0.23009000 0.73923300 1.0 Fe Fe10 1 0.72651800 0.16856700 0.45420600 1.0 Fe Fe11 1 0.92897200 0.96992700 0.86024000 1.0 Fe Fe12 1 0.66968500 0.42859600 0.33902400 1.0 Fe Fe13 1 0.53197300 0.36430600 0.06228500 1.0 Fe Fe14 1 0.47077500 0.62981200 0.94130300 1.0 Fe Fe15 1 0.32939200 0.56925100 0.65971300 1.0 Fe Fe16 1 0.27061600 0.83082700 0.54004000 1.0 Fe Fe17 1 0.07018200 0.03067000 0.14040100 1.0 Fe Fe18 1 0.13116500 0.76980500 0.25959800 1.0 Si Si19 1 0.92433800 0.27536200 0.26988300 1.0 Si Si20 1 0.86183900 0.51858500 0.14140500 1.0 Si Si21 1 0.93928800 0.68186200 0.45882000 1.0 Si Si22 1 0.87454100 0.92404900 0.32934600 1.0 Si Si23 1 0.73687700 0.88372000 0.05948500 1.0 Si Si24 1 0.72525700 0.47525900 0.87075500 1.0 Si Si25 1 0.67410700 0.12362000 0.93070500 1.0 Si Si26 1 0.66104100 0.71805200 0.74175700 1.0 Si Si27 1 0.53905700 0.08202200 0.65831500 1.0 Si Si28 1 0.52582300 0.67637900 0.47032700 1.0 Si Si29 1 0.47382800 0.32396100 0.52972700 1.0 Si Si30 1 0.46162800 0.91893000 0.34014400 1.0 Si Si31 1 0.33985400 0.28095600 0.25826700 1.0 Si Si32 1 0.32849800 0.87758100 0.07114100 1.0 Si Si33 1 0.27445500 0.52313100 0.12991300 1.0 Si Si34 1 0.26092500 0.11774200 0.94131600 1.0 Si Si35 1 0.12517700 0.07612900 0.66991300 1.0 Si Si36 1 0.06031100 0.31816100 0.54070700 1.0 Si Si37 1 0.13859100 0.48131800 0.85857000 1.0 Si Si38 1 0.07464900 0.72448000 0.73019200 1.0 O O39 1 0.94940800 0.15596800 0.17848600 1.0 O O40 1 0.94935300 0.40689800 0.19545000 1.0 O O41 1 0.97066000 0.06435300 0.71281400 1.0 O O42 1 0.95198200 0.66373600 0.18235600 1.0 O O43 1 0.85071700 0.04417100 0.42087500 1.0 O O44 1 0.90210500 0.29060700 0.57595600 1.0 O O45 1 0.89630100 0.91027000 0.02425600 1.0 O O46 1 0.95308300 0.70091500 0.60855700 1.0 O O47 1 0.84895600 0.53697100 0.41779100 1.0 O O48 1 0.77284300 0.26862200 0.31621900 1.0 O O49 1 0.82855400 0.13423300 0.88578900 1.0 O O50 1 0.85193800 0.79385200 0.40552900 1.0 O O51 1 0.65730000 0.25008400 0.01709900 1.0 O O52 1 0.84801700 0.50005400 0.99166800 1.0 O O53 1 0.70334200 0.49163100 0.17629400 1.0 O O54 1 0.69747400 0.10986100 0.62303200 1.0 O O55 1 0.75354200 0.89697600 0.20857200 1.0 O O56 1 0.74889400 0.35655000 0.77781900 1.0 O O57 1 0.64885300 0.73688700 0.01761000 1.0 O O58 1 0.74889700 0.60701100 0.79646700 1.0 O O59 1 0.62835200 0.33611100 0.48699400 1.0 O O60 1 0.64834400 0.99083200 0.00044300 1.0 O O61 1 0.75082300 0.86341300 0.78130800 1.0 O O62 1 0.54629200 0.06376300 0.38949300 1.0 O O63 1 0.64715400 0.69839900 0.59206200 1.0 O O64 1 0.49794100 0.31420800 0.22518400 1.0 O O65 1 0.55282000 0.10211500 0.80802000 1.0 O O66 1 0.54956300 0.55691800 0.37835900 1.0 O O67 1 0.55007300 0.80810600 0.39673400 1.0 O O68 1 0.57085300 0.46459800 0.91421400 1.0 O O69 1 0.42887200 0.53495200 0.08678600 1.0 O O70 1 0.45015000 0.19309800 0.60462500 1.0 O O71 1 0.45046300 0.44381600 0.62165600 1.0 O O72 1 0.44818600 0.89461400 0.19220400 1.0 O O73 1 0.50231600 0.69022800 0.77650400 1.0 O O74 1 0.35230000 0.30077500 0.40813100 1.0 O O75 1 0.44914600 0.93626900 0.61897800 1.0 O O76 1 0.24904000 0.13605200 0.21772100 1.0 O O77 1 0.34685800 0.00462600 0.99216300 1.0 O O78 1 0.37119700 0.66480900 0.51340400 1.0 O O79 1 0.24984300 0.39137000 0.20344000 1.0 O O80 1 0.35136200 0.26289000 0.98272200 1.0 O O81 1 0.25043700 0.64240500 0.22210500 1.0 O O82 1 0.24664200 0.10021500 0.79147500 1.0 O O83 1 0.30256400 0.88948100 0.37577100 1.0 O O84 1 0.29725300 0.50900500 0.82368000 1.0 O O85 1 0.15280300 0.50094700 0.00819800 1.0 O O86 1 0.34974700 0.75590900 0.97882800 1.0 O O87 1 0.14888600 0.20734700 0.59547700 1.0 O O88 1 0.17276000 0.86529600 0.11359400 1.0 O O89 1 0.22914700 0.73560100 0.68703600 1.0 O O90 1 0.15043400 0.46361400 0.58159900 1.0 O O91 1 0.04751700 0.29829400 0.39118300 1.0 O O92 1 0.10213900 0.09109000 0.97616400 1.0 O O93 1 0.09799000 0.70937300 0.42407800 1.0 O O94 1 0.14910500 0.95621700 0.57834900 1.0 O O95 1 0.04862900 0.33609700 0.81784300 1.0 O O96 1 0.02968000 0.93561500 0.28717100 1.0 O O97 1 0.05087200 0.59281200 0.80420500 1.0 O O98 1 0.05050100 0.84400200 0.82182900 1.0