# generated using pymatgen
data_Li3Fe2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75202000
_cell_length_b   8.76283200
_cell_length_c   12.16237000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2(PO4)3
_chemical_formula_sum   'Li12 Fe8 P12 O48'
_cell_volume   932.76232917
_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  0.53263600  0.98142700  0.81940100  1
  Li  Li1  1  0.53263600  0.01857300  0.18059900  1
  Li  Li2  1  0.46736400  0.51857300  0.31940100  1
  Li  Li3  1  0.46736400  0.48142700  0.68059900  1
  Li  Li4  1  0.19625800  0.32349300  0.78651300  1
  Li  Li5  1  0.19625800  0.67650700  0.21348700  1
  Li  Li6  1  0.05227800  0.01477200  0.31593700  1
  Li  Li7  1  0.05227800  0.98522800  0.68406300  1
  Li  Li8  1  0.94772200  0.48522800  0.81593700  1
  Li  Li9  1  0.94772200  0.51477200  0.18406300  1
  Li  Li10  1  0.80374200  0.82349300  0.71348700  1
  Li  Li11  1  0.80374200  0.17650700  0.28651300  1
  Fe  Fe12  1  0.49443800  0.79364700  0.61159900  1
  Fe  Fe13  1  0.49443800  0.20635300  0.38840100  1
  Fe  Fe14  1  0.50556200  0.29364700  0.88840100  1
  Fe  Fe15  1  0.50556200  0.70635300  0.11159900  1
  Fe  Fe16  1  0.01014000  0.79550400  0.89345000  1
  Fe  Fe17  1  0.01014000  0.20449600  0.10655000  1
  Fe  Fe18  1  0.98986000  0.29550400  0.60655000  1
  Fe  Fe19  1  0.98986000  0.70449600  0.39345000  1
  P  P20  1  0.70198400  0.50000000  0.50000000  1
  P  P21  1  0.64442700  0.64780900  0.85251400  1
  P  P22  1  0.64442700  0.35219100  0.14748600  1
  P  P23  1  0.35557300  0.14780900  0.64748600  1
  P  P24  1  0.35557300  0.85219100  0.35251400  1
  P  P25  1  0.29801600  0.00000000  0.00000000  1
  P  P26  1  0.20267100  0.50000000  0.00000000  1
  P  P27  1  0.14451700  0.64556700  0.64891500  1
  P  P28  1  0.14451700  0.35443300  0.35108500  1
  P  P29  1  0.85548300  0.85443300  0.14891500  1
  P  P30  1  0.85548300  0.14556700  0.85108500  1
  P  P31  1  0.79732900  0.00000000  0.50000000  1
  O  O32  1  0.70193100  0.10633600  0.42553100  1
  O  O33  1  0.70193100  0.89366400  0.57446900  1
  O  O34  1  0.67978800  0.15430800  0.83623500  1
  O  O35  1  0.67978800  0.84569200  0.16376500  1
  O  O36  1  0.59844200  0.31950000  0.02939900  1
  O  O37  1  0.59844200  0.68050000  0.97060100  1
  O  O38  1  0.59741000  0.40715200  0.42178600  1
  O  O39  1  0.59741000  0.59284800  0.57821400  1
  O  O40  1  0.58654300  0.48835200  0.81743400  1
  O  O41  1  0.58654300  0.51164800  0.18256600  1
  O  O42  1  0.58236400  0.77464600  0.77352000  1
  O  O43  1  0.58236400  0.22535400  0.22648000  1
  O  O44  1  0.41763600  0.27464600  0.72648000  1
  O  O45  1  0.41763600  0.72535400  0.27352000  1
  O  O46  1  0.41345700  0.01164800  0.31743400  1
  O  O47  1  0.41345700  0.98835200  0.68256600  1
  O  O48  1  0.40259000  0.09284800  0.92178600  1
  O  O49  1  0.40259000  0.90715200  0.07821400  1
  O  O50  1  0.40155800  0.18050000  0.52939900  1
  O  O51  1  0.40155800  0.81950000  0.47060100  1
  O  O52  1  0.32021200  0.34569200  0.33623500  1
  O  O53  1  0.32021200  0.65430800  0.66376500  1
  O  O54  1  0.29806900  0.39366400  0.92553100  1
  O  O55  1  0.29806900  0.60633600  0.07446900  1
  O  O56  1  0.19979500  0.10455100  0.07284700  1
  O  O57  1  0.19979500  0.89544900  0.92715300  1
  O  O58  1  0.17939300  0.15729500  0.66390400  1
  O  O59  1  0.17939300  0.84270500  0.33609600  1
  O  O60  1  0.09768900  0.67182900  0.52933800  1
  O  O61  1  0.09768900  0.32817100  0.47066200  1
  O  O62  1  0.09510100  0.58898900  0.92102500  1
  O  O63  1  0.09510100  0.41101100  0.07897500  1
  O  O64  1  0.09342800  0.51746800  0.31245700  1
  O  O65  1  0.09342800  0.48253200  0.68754300  1
  O  O66  1  0.06254800  0.76887800  0.72043200  1
  O  O67  1  0.06254800  0.23112200  0.27956800  1
  O  O68  1  0.93745200  0.26887800  0.77956800  1
  O  O69  1  0.93745200  0.73112200  0.22043200  1
  O  O70  1  0.90657200  0.98253200  0.81245700  1
  O  O71  1  0.90657200  0.01746800  0.18754300  1
  O  O72  1  0.90489900  0.08898900  0.57897500  1
  O  O73  1  0.90489900  0.91101100  0.42102500  1
  O  O74  1  0.90231100  0.17182900  0.97066200  1
  O  O75  1  0.90231100  0.82817100  0.02933800  1
  O  O76  1  0.82060700  0.34270500  0.16390400  1
  O  O77  1  0.82060700  0.65729500  0.83609600  1
  O  O78  1  0.80020500  0.39544900  0.57284700  1
  O  O79  1  0.80020500  0.60455100  0.42715300  1
