# generated using pymatgen
data_LiFe2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68198800
_cell_length_b   8.64506400
_cell_length_c   12.30022900
_cell_angle_alpha   89.85946012
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2(PO4)3
_chemical_formula_sum   'Li4 Fe8 P12 O48'
_cell_volume   923.20741628
_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  0.00000000  0.00000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe4  1  0.49804500  0.78457700  0.85408200  1
  Fe  Fe5  1  0.00166700  0.28441400  0.35829000  1
  Fe  Fe6  1  0.99833300  0.28441400  0.85829000  1
  Fe  Fe7  1  0.00166700  0.71558600  0.14171000  1
  Fe  Fe8  1  0.50195500  0.21542300  0.14591800  1
  Fe  Fe9  1  0.49804500  0.21542300  0.64591800  1
  Fe  Fe10  1  0.50195500  0.78457700  0.35408200  1
  Fe  Fe11  1  0.99833300  0.71558600  0.64171000  1
  P  P12  1  0.20369800  0.00000000  0.75000000  1
  P  P13  1  0.79630200  0.00000000  0.25000000  1
  P  P14  1  0.85476000  0.35210600  0.60360900  1
  P  P15  1  0.29148100  0.50000000  0.75000000  1
  P  P16  1  0.64271000  0.84855600  0.60532300  1
  P  P17  1  0.35729000  0.84855600  0.10532300  1
  P  P18  1  0.14524000  0.35210600  0.10360900  1
  P  P19  1  0.14524000  0.64789400  0.39639100  1
  P  P20  1  0.70851900  0.50000000  0.25000000  1
  P  P21  1  0.35729000  0.15144400  0.39467700  1
  P  P22  1  0.64271000  0.15144400  0.89467700  1
  P  P23  1  0.85476000  0.64789400  0.89639100  1
  O  O24  1  0.82067600  0.85531100  0.58973800  1
  O  O25  1  0.30231700  0.12453000  0.69443600  1
  O  O26  1  0.80805200  0.61802700  0.18807100  1
  O  O27  1  0.09406800  0.71614100  0.28701900  1
  O  O28  1  0.06979600  0.24904800  0.01474400  1
  O  O29  1  0.17932400  0.14468900  0.41026200  1
  O  O30  1  0.39730200  0.57257300  0.83810900  1
  O  O31  1  0.42314200  0.25098900  0.48929700  1
  O  O32  1  0.17932400  0.85531100  0.08973800  1
  O  O33  1  0.30231700  0.87547000  0.80556400  1
  O  O34  1  0.90144700  0.07040600  0.33971400  1
  O  O35  1  0.58451000  0.01575700  0.60363800  1
  O  O36  1  0.67712000  0.65513400  0.91360000  1
  O  O37  1  0.09855300  0.07040600  0.83971400  1
  O  O38  1  0.41549000  0.01575700  0.10363800  1
  O  O39  1  0.82067600  0.14468900  0.91026200  1
  O  O40  1  0.32288000  0.65513400  0.41360000  1
  O  O41  1  0.90593200  0.28385900  0.71298100  1
  O  O42  1  0.58451000  0.98424300  0.89636200  1
  O  O43  1  0.41549000  0.98424300  0.39636200  1
  O  O44  1  0.40569800  0.76408400  0.21016100  1
  O  O45  1  0.10302300  0.47591000  0.40716400  1
  O  O46  1  0.67712000  0.34486600  0.58640000  1
  O  O47  1  0.89697700  0.52409000  0.59283600  1
  O  O48  1  0.60269800  0.57257300  0.33810900  1
  O  O49  1  0.57685800  0.74901100  0.51070300  1
  O  O50  1  0.06979600  0.75095200  0.48525600  1
  O  O51  1  0.93020400  0.24904800  0.51474400  1
  O  O52  1  0.09406800  0.28385900  0.21298100  1
  O  O53  1  0.32288000  0.34486600  0.08640000  1
  O  O54  1  0.69768300  0.87547000  0.30556400  1
  O  O55  1  0.40569800  0.23591600  0.28983900  1
  O  O56  1  0.59430200  0.23591600  0.78983900  1
  O  O57  1  0.09855300  0.92959400  0.66028600  1
  O  O58  1  0.42314200  0.74901100  0.01070300  1
  O  O59  1  0.10302300  0.52409000  0.09283600  1
  O  O60  1  0.93020400  0.75095200  0.98525600  1
  O  O61  1  0.90593200  0.71614100  0.78701900  1
  O  O62  1  0.89697700  0.47591000  0.90716400  1
  O  O63  1  0.57685800  0.25098900  0.98929700  1
  O  O64  1  0.60269800  0.42742700  0.16189100  1
  O  O65  1  0.39730200  0.42742700  0.66189100  1
  O  O66  1  0.59430200  0.76408400  0.71016100  1
  O  O67  1  0.69768300  0.12453000  0.19443600  1
  O  O68  1  0.80805200  0.38197300  0.31192900  1
  O  O69  1  0.19194800  0.61802700  0.68807100  1
  O  O70  1  0.19194800  0.38197300  0.81192900  1
  O  O71  1  0.90144700  0.92959400  0.16028600  1
