# generated using pymatgen
data_Li3Fe2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.78202872
_cell_length_b   9.78202872
_cell_length_c   9.78082705
_cell_angle_alpha   86.55111142
_cell_angle_beta   86.55111142
_cell_angle_gamma   86.45219921
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2(PO4)3
_chemical_formula_sum   'Li12 Fe8 P12 O48'
_cell_volume   930.92596506
_cell_formula_units_Z   4
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  0.77066700  0.96005400  0.60065100  1
  Li  Li1  1  0.51583900  0.17584700  0.47070800  1
  Li  Li2  1  0.03994600  0.22933300  0.39934900  1
  Li  Li3  1  0.82415300  0.48416100  0.52929200  1
  Li  Li4  1  0.03201000  0.48468300  0.25683300  1
  Li  Li5  1  0.51531700  0.96799000  0.74316700  1
  Li  Li6  1  0.73166400  0.65726000  0.26716600  1
  Li  Li7  1  0.34274000  0.26833600  0.73283400  1
  Li  Li8  1  0.16245500  0.50046200  0.99257600  1
  Li  Li9  1  0.99995400  0.75477500  0.09706200  1
  Li  Li10  1  0.49953800  0.83754500  0.00742400  1
  Li  Li11  1  0.24522500  0.00004600  0.90293800  1
  Fe  Fe12  1  0.74987900  0.02816900  0.22105800  1
  Fe  Fe13  1  0.02093800  0.74484200  0.72349600  1
  Fe  Fe14  1  0.47033800  0.52966200  0.50000000  1
  Fe  Fe15  1  0.24772500  0.75227500  0.50000000  1
  Fe  Fe16  1  0.74920000  0.25080000  0.00000000  1
  Fe  Fe17  1  0.97183100  0.25012100  0.77894200  1
  Fe  Fe18  1  0.52674500  0.47325500  0.00000000  1
  Fe  Fe19  1  0.25515800  0.97906200  0.27650400  1
  P  P20  1  0.17245400  0.04990800  0.59903700  1
  P  P21  1  0.65192600  0.32667800  0.69817300  1
  P  P22  1  0.15151700  0.45041900  0.57759500  1
  P  P23  1  0.67332200  0.34807400  0.30182700  1
  P  P24  1  0.04960600  0.17903900  0.09705100  1
  P  P25  1  0.45095000  0.15334300  0.07312500  1
  P  P26  1  0.54958100  0.84848300  0.42240500  1
  P  P27  1  0.95009200  0.82754600  0.40096300  1
  P  P28  1  0.32017900  0.66027700  0.19941300  1
  P  P29  1  0.84665700  0.54905000  0.92687500  1
  P  P30  1  0.33972300  0.67982100  0.80058700  1
  P  P31  1  0.82096100  0.95039400  0.90294900  1
  O  O32  1  0.28869600  0.09464800  0.68113400  1
  O  O33  1  0.02999700  0.11764800  0.64305200  1
  O  O34  1  0.56681700  0.21247400  0.65383400  1
  O  O35  1  0.80940000  0.31005400  0.66175200  1
  O  O36  1  0.18914400  0.08732400  0.44187900  1
  O  O37  1  0.10947300  0.38260100  0.72097000  1
  O  O38  1  0.60946500  0.46887600  0.62827800  1
  O  O39  1  0.68994600  0.19060000  0.33824800  1
  O  O40  1  0.30924100  0.41487300  0.56277700  1
  O  O41  1  0.11826700  0.03848100  0.14668700  1
  O  O42  1  0.38991300  0.10817200  0.21768000  1
  O  O43  1  0.06656300  0.40519200  0.46377900  1
  O  O44  1  0.53112400  0.39053500  0.37172200  1
  O  O45  1  0.37496100  0.67319700  0.64062400  1
  O  O46  1  0.12084800  0.61089500  0.58086800  1
  O  O47  1  0.61267700  0.12279700  0.08024100  1
  O  O48  1  0.88863800  0.16701700  0.12635000  1
  O  O49  1  0.78752600  0.43318300  0.34616600  1
  O  O50  1  0.08773300  0.29985600  0.17561400  1
  O  O51  1  0.40860300  0.06523400  0.96052200  1
  O  O52  1  0.66518100  0.37585800  0.14210400  1
  O  O53  1  0.83298300  0.11136200  0.87365000  1
  O  O54  1  0.58512700  0.69075900  0.43722300  1
  O  O55  1  0.91267600  0.81085600  0.55812100  1
  O  O56  1  0.08821800  0.18961100  0.93967300  1
  O  O57  1  0.41587000  0.30824600  0.04491500  1
  O  O58  1  0.16602900  0.88994600  0.62853500  1
  O  O59  1  0.32680300  0.62503900  0.35937600  1
  O  O60  1  0.59480800  0.93343700  0.53622100  1
  O  O61  1  0.90535200  0.71130400  0.31886600  1
  O  O62  1  0.19228300  0.59868500  0.15175800  1
  O  O63  1  0.38910500  0.87915200  0.41913200  1
  O  O64  1  0.11005400  0.83397100  0.37146500  1
  O  O65  1  0.87720300  0.38732300  0.91975900  1
  O  O66  1  0.62414200  0.33481900  0.85789600  1
  O  O67  1  0.45931700  0.60624500  0.13222900  1
  O  O68  1  0.93476600  0.59139700  0.03947800  1
  O  O69  1  0.88235200  0.97000300  0.35694800  1
  O  O70  1  0.61739900  0.89052700  0.27903000  1
  O  O71  1  0.69175400  0.58413000  0.95508500  1
  O  O72  1  0.31733400  0.81829500  0.16459200  1
  O  O73  1  0.39375500  0.54068300  0.86777100  1
  O  O74  1  0.89182800  0.61008700  0.78232000  1
  O  O75  1  0.81038900  0.91178200  0.06032700  1
  O  O76  1  0.18170500  0.68266600  0.83540800  1
  O  O77  1  0.40131500  0.80771700  0.84824200  1
  O  O78  1  0.96151900  0.88173300  0.85331300  1
  O  O79  1  0.70014400  0.91226700  0.82438600  1
