# generated using pymatgen
data_Li9Fe4(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.34855000
_cell_length_b   10.44804888
_cell_length_c   11.03777072
_cell_angle_alpha   102.70624610
_cell_angle_beta   102.79939039
_cell_angle_gamma   119.29168856
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li9Fe4(BO3)8
_chemical_formula_sum   'Li18 Fe8 B16 O48'
_cell_volume   936.28142911
_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
  Li  Li0  1  0.12268600  0.15792700  0.93335800  1
  Li  Li1  1  0.39910600  0.06601900  0.61945100  1
  Li  Li2  1  0.23610100  0.25249500  0.32194500  1
  Li  Li3  1  0.42270800  0.47386300  0.83493900  1
  Li  Li4  1  0.10716300  0.45138600  0.38086800  1
  Li  Li5  1  0.48900600  0.02013600  0.15679000  1
  Li  Li6  1  0.99416400  0.52314600  0.16435100  1
  Li  Li7  1  0.01028100  0.47623700  0.83036700  1
  Li  Li8  1  0.50289900  0.97789800  0.82299900  1
  Li  Li9  1  0.47476300  0.46094300  0.11383700  1
  Li  Li10  1  0.70874700  0.85556400  0.86836900  1
  Li  Li11  1  0.89703500  0.56293900  0.62722100  1
  Li  Li12  1  0.79437900  0.28055400  0.41071600  1
  Li  Li13  1  0.29449700  0.78113300  0.40383600  1
  Li  Li14  1  0.73783800  0.75991200  0.34037600  1
  Li  Li15  1  0.61127200  0.95221400  0.37749900  1
  Li  Li16  1  0.79774400  0.64460100  0.11740700  1
  Li  Li17  1  0.98454100  0.96320400  0.09785800  1
  Fe  Fe18  1  0.83315500  0.14990100  0.12637300  1
  Fe  Fe19  1  0.33299200  0.65417600  0.12394400  1
  Fe  Fe20  1  0.67456000  0.35249400  0.87799500  1
  Fe  Fe21  1  0.17234300  0.85578300  0.88080900  1
  Fe  Fe22  1  0.90720600  0.08067300  0.62808600  1
  Fe  Fe23  1  0.40451500  0.58487900  0.62258900  1
  Fe  Fe24  1  0.60407900  0.42354800  0.37805400  1
  Fe  Fe25  1  0.10059400  0.92079700  0.37154900  1
  B  B26  1  0.37646400  0.18676700  0.88965200  1
  B  B27  1  0.07124800  0.39040300  0.61867400  1
  B  B28  1  0.43735800  0.11283000  0.37448600  1
  B  B29  1  0.84275200  0.18521400  0.86947500  1
  B  B30  1  0.34817100  0.69858100  0.87215300  1
  B  B31  1  0.13388400  0.32816100  0.12796600  1
  B  B32  1  0.56363100  0.40797400  0.63691000  1
  B  B33  1  0.06312300  0.89827400  0.62786700  1
  B  B34  1  0.94282100  0.09713700  0.36956100  1
  B  B35  1  0.44122100  0.59995900  0.36831300  1
  B  B36  1  0.86917900  0.68308000  0.88498200  1
  B  B37  1  0.66844500  0.32261700  0.13739400  1
  B  B38  1  0.15770100  0.81360600  0.13312600  1
  B  B39  1  0.57259700  0.89578800  0.61714000  1
  B  B40  1  0.93690900  0.61319200  0.37734700  1
  B  B41  1  0.64294200  0.82039200  0.12370900  1
  O  O42  1  0.24284100  0.06903600  0.89872800  1
  O  O43  1  0.09047000  0.27897100  0.65018900  1
  O  O44  1  0.06401300  0.08119700  0.35333800  1
  O  O45  1  0.48007400  0.15411000  0.84979000  1
  O  O46  1  0.40863700  0.33527400  0.92093700  1
  O  O47  1  0.32518200  0.99378800  0.40505000  1
  O  O48  1  0.74905800  0.08109000  0.92186900  1
  O  O49  1  0.25555800  0.59558800  0.92500600  1
  O  O50  1  0.18128600  0.49805000  0.58188600  1
  O  O51  1  0.10881200  0.18467200  0.11969600  1
  O  O52  1  0.02363300  0.35684100  0.15584600  1
  O  O53  1  0.57553700  0.29948300  0.68312800  1
  O  O54  1  0.07021600  0.79109500  0.67775300  1
  O  O55  1  0.56597200  0.11487400  0.36109600  1
  O  O56  1  0.06761600  0.61812000  0.36630600  1
  O  O57  1  0.45691600  0.44245500  0.65904100  1
  O  O58  1  0.41219700  0.22817600  0.35686300  1
  O  O59  1  0.94474400  0.15832400  0.82313300  1
  O  O60  1  0.45177500  0.67409400  0.82522300  1
  O  O61  1  0.83574400  0.31206400  0.86275100  1
  O  O62  1  0.33738300  0.82286800  0.86323400  1
  O  O63  1  0.83824100  0.00158300  0.42033600  1
  O  O64  1  0.33506000  0.50588700  0.41933600  1
  O  O65  1  0.74855700  0.57146700  0.91269700  1
  O  O66  1  0.26096200  0.43629800  0.10396800  1
  O  O67  1  0.66509600  0.47806900  0.57449100  1
  O  O68  1  0.16654900  0.96904800  0.56799200  1
  O  O69  1  0.67804500  0.19783100  0.14715600  1
  O  O70  1  0.17618600  0.69550000  0.15135700  1
  O  O71  1  0.57031300  0.35279500  0.18626500  1
  O  O72  1  0.04495300  0.82948700  0.17167300  1
  O  O73  1  0.59294900  0.78790300  0.65707700  1
  O  O74  1  0.55989300  0.57892300  0.35375200  1
  O  O75  1  0.94272500  0.39555100  0.62099000  1
  O  O76  1  0.44274100  0.89957000  0.61584700  1
  O  O77  1  0.92282700  0.20660900  0.33046100  1
  O  O78  1  0.42905400  0.71404100  0.33148300  1
  O  O79  1  0.97350600  0.65180400  0.84614100  1
  O  O80  1  0.88825000  0.82516800  0.90462000  1
  O  O81  1  0.83144800  0.49923400  0.41621100  1
  O  O82  1  0.75740400  0.42291400  0.08024400  1
  O  O83  1  0.24860100  0.91187600  0.07776600  1
  O  O84  1  0.68357800  0.00079500  0.57973100  1
  O  O85  1  0.63272800  0.68807300  0.13364300  1
  O  O86  1  0.53148600  0.85108900  0.14833000  1
  O  O87  1  0.95003700  0.92654000  0.63831000  1
  O  O88  1  0.90336300  0.71882000  0.34416000  1
  O  O89  1  0.76476100  0.92941000  0.09355800  1
