# generated using pymatgen
data_LiFe(SiO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.78816300
_cell_length_b   10.43084000
_cell_length_c   5.34275700
_cell_angle_alpha   89.99825772
_cell_angle_beta   90.00001682
_cell_angle_gamma   90.00005186
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe(SiO3)2
_chemical_formula_sum   'Li8 Fe8 Si16 O48'
_cell_volume   1047.05386674
_cell_formula_units_Z   8
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
  Li  Li0  1  0.12436700  0.44631100  0.47540100  1
  Li  Li1  1  0.12436800  0.05367800  0.97536800  1
  Li  Li2  1  0.37563000  0.55367800  0.97537300  1
  Li  Li3  1  0.37563200  0.94631200  0.47539600  1
  Li  Li4  1  0.62436800  0.05368800  0.52460400  1
  Li  Li5  1  0.62437000  0.44632200  0.02462700  1
  Li  Li6  1  0.87563300  0.55368900  0.52459900  1
  Li  Li7  1  0.87563200  0.94632200  0.02463200  1
  Fe  Fe8  1  0.12507900  0.03861100  0.47558300  1
  Fe  Fe9  1  0.12506800  0.46136300  0.97562300  1
  Fe  Fe10  1  0.37492900  0.96136200  0.97562500  1
  Fe  Fe11  1  0.37492100  0.53861800  0.47558900  1
  Fe  Fe12  1  0.62507900  0.46138200  0.52441100  1
  Fe  Fe13  1  0.62507100  0.03863800  0.02437500  1
  Fe  Fe14  1  0.87492100  0.96138900  0.52441700  1
  Fe  Fe15  1  0.87493200  0.53863700  0.02437700  1
  Si  Si16  1  0.01812400  0.66740100  0.25364400  1
  Si  Si17  1  0.01811900  0.83260800  0.75363900  1
  Si  Si18  1  0.23174200  0.66689700  0.69652200  1
  Si  Si19  1  0.23175000  0.83308500  0.19651800  1
  Si  Si20  1  0.26825800  0.16689700  0.69652300  1
  Si  Si21  1  0.26825000  0.33308500  0.19651800  1
  Si  Si22  1  0.48187600  0.16740100  0.25364300  1
  Si  Si23  1  0.48188100  0.33260900  0.75363800  1
  Si  Si24  1  0.51811900  0.66739100  0.24636200  1
  Si  Si25  1  0.51812400  0.83259900  0.74635700  1
  Si  Si26  1  0.73175000  0.66691500  0.80348200  1
  Si  Si27  1  0.73174200  0.83310300  0.30347700  1
  Si  Si28  1  0.76825000  0.16691500  0.80348200  1
  Si  Si29  1  0.76825800  0.33310300  0.30347800  1
  Si  Si30  1  0.98188100  0.16739200  0.24636100  1
  Si  Si31  1  0.98187600  0.33259900  0.74635600  1
  O  O32  1  0.03615000  0.73311000  0.52458200  1
  O  O33  1  0.03615600  0.76689900  0.02457500  1
  O  O34  1  0.06636300  0.12929000  0.24819500  1
  O  O35  1  0.06635800  0.37068800  0.74821000  1
  O  O36  1  0.06929600  0.54153100  0.22348800  1
  O  O37  1  0.06929500  0.95846700  0.72346700  1
  O  O38  1  0.18416300  0.12625700  0.70694300  1
  O  O39  1  0.18415300  0.37371100  0.20696800  1
  O  O40  1  0.17946200  0.95749600  0.22527900  1
  O  O41  1  0.17944900  0.54249300  0.72532000  1
  O  O42  1  0.21449200  0.76680500  0.92521200  1
  O  O43  1  0.21448100  0.73318400  0.42521300  1
  O  O44  1  0.28550900  0.26680600  0.92521000  1
  O  O45  1  0.28551800  0.23318300  0.42521300  1
  O  O46  1  0.32053800  0.45749800  0.22528200  1
  O  O47  1  0.32055200  0.04249300  0.72531600  1
  O  O48  1  0.31583800  0.62625700  0.70694000  1
  O  O49  1  0.31584700  0.87371200  0.20697000  1
  O  O50  1  0.43070400  0.04152900  0.22348700  1
  O  O51  1  0.43070600  0.45846900  0.72346700  1
  O  O52  1  0.43363800  0.62929200  0.24819800  1
  O  O53  1  0.43364200  0.87068900  0.74820600  1
  O  O54  1  0.46385000  0.23311100  0.52458100  1
  O  O55  1  0.46384400  0.26690000  0.02457400  1
  O  O56  1  0.53615600  0.73310000  0.97542600  1
  O  O57  1  0.53615000  0.76688900  0.47541900  1
  O  O58  1  0.56635800  0.12931100  0.25179400  1
  O  O59  1  0.56636200  0.37070800  0.75180200  1
  O  O60  1  0.56929400  0.54153100  0.27653300  1
  O  O61  1  0.56929600  0.95847100  0.77651300  1
  O  O62  1  0.68415300  0.12628800  0.79303000  1
  O  O63  1  0.68416200  0.37374300  0.29306000  1
  O  O64  1  0.67944800  0.95750700  0.27468400  1
  O  O65  1  0.67946200  0.54250200  0.77471800  1
  O  O66  1  0.71448200  0.76681700  0.57478700  1
  O  O67  1  0.71449100  0.73319400  0.07479000  1
  O  O68  1  0.78551900  0.26681600  0.57478700  1
  O  O69  1  0.78550800  0.23319500  0.07478800  1
  O  O70  1  0.82055100  0.45750700  0.27468000  1
  O  O71  1  0.82053800  0.04250400  0.77472100  1
  O  O72  1  0.81584700  0.62628900  0.79303200  1
  O  O73  1  0.81583700  0.87374300  0.29305700  1
  O  O74  1  0.93070500  0.04153300  0.27653300  1
  O  O75  1  0.93070400  0.45846900  0.77651200  1
  O  O76  1  0.93364200  0.62931200  0.25179000  1
  O  O77  1  0.93363700  0.87071000  0.75180500  1
  O  O78  1  0.96384400  0.23310100  0.97542500  1
  O  O79  1  0.96385000  0.26689000  0.47541800  1
