# generated using pymatgen
data_LiFe2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.77916800
_cell_length_b   8.81996472
_cell_length_c   12.27433079
_cell_angle_alpha   89.78281014
_cell_angle_beta   89.87829750
_cell_angle_gamma   89.94737471
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2(PO4)3
_chemical_formula_sum   'Li4 Fe8 P12 O48'
_cell_volume   950.41602624
_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  0.70915000  0.72759500  0.68589400  1
  Li  Li1  1  0.21574400  0.77811600  0.18072100  1
  Li  Li2  1  0.06610100  0.09039500  0.70858700  1
  Li  Li3  1  0.06116300  0.40881000  0.28817400  1
  Fe  Fe4  1  0.74142300  0.04482700  0.61565300  1
  Fe  Fe5  1  0.73878900  0.46665900  0.38085300  1
  Fe  Fe6  1  0.75231000  0.53351100  0.88658400  1
  Fe  Fe7  1  0.75361500  0.96020800  0.11790300  1
  Fe  Fe8  1  0.25568700  0.03477400  0.88691100  1
  Fe  Fe9  1  0.25768600  0.45610000  0.10994000  1
  Fe  Fe10  1  0.24915300  0.53797000  0.61828300  1
  Fe  Fe11  1  0.24961000  0.96626600  0.38680900  1
  P  P12  1  0.95896800  0.75160600  0.50229000  1
  P  P13  1  0.89256000  0.89561600  0.85226200  1
  P  P14  1  0.89688900  0.60843400  0.14663000  1
  P  P15  1  0.60507500  0.39671800  0.64598300  1
  P  P16  1  0.60754400  0.10700300  0.35421200  1
  P  P17  1  0.54020400  0.24846400  0.99850900  1
  P  P18  1  0.46654700  0.74728800  0.00096400  1
  P  P19  1  0.38976000  0.89364200  0.64756100  1
  P  P20  1  0.38179200  0.60310300  0.35175600  1
  P  P21  1  0.10605500  0.10764100  0.14675100  1
  P  P22  1  0.10947700  0.39052300  0.85368300  1
  P  P23  1  0.03702300  0.25053100  0.49949800  1
  O  O24  1  0.93936100  0.34699100  0.42083400  1
  O  O25  1  0.94404900  0.14521900  0.57523400  1
  O  O26  1  0.93643500  0.41286000  0.84314000  1
  O  O27  1  0.93087600  0.09432600  0.14717100  1
  O  O28  1  0.83947700  0.56235900  0.03399300  1
  O  O29  1  0.83042600  0.94054400  0.96403700  1
  O  O30  1  0.86936600  0.64428000  0.42761700  1
  O  O31  1  0.84367900  0.83802200  0.57476500  1
  O  O32  1  0.83522300  0.73496400  0.82301500  1
  O  O33  1  0.85281200  0.77283700  0.17141900  1
  O  O34  1  0.84432600  0.01055300  0.76301200  1
  O  O35  1  0.83884500  0.49407600  0.23391400  1
  O  O36  1  0.67156000  0.51238300  0.72837900  1
  O  O37  1  0.68246600  0.99920400  0.27142400  1
  O  O38  1  0.64673200  0.27336400  0.32883400  1
  O  O39  1  0.65202100  0.23311900  0.67039400  1
  O  O40  1  0.65082100  0.34091000  0.92813800  1
  O  O41  1  0.63237600  0.14114100  0.07134400  1
  O  O42  1  0.66166900  0.44548300  0.53254400  1
  O  O43  1  0.66159700  0.06306500  0.46834200  1
  O  O44  1  0.55630100  0.58985500  0.34368100  1
  O  O45  1  0.56411900  0.91017500  0.66348800  1
  O  O46  1  0.56259800  0.64160900  0.93097000  1
  O  O47  1  0.56608700  0.84250900  0.07840800  1
  O  O48  1  0.44477500  0.34984600  0.07335600  1
  O  O49  1  0.43943900  0.15587900  0.92083100  1
  O  O50  1  0.42970200  0.40658300  0.64918900  1
  O  O51  1  0.43400300  0.08716800  0.34117000  1
  O  O52  1  0.34377100  0.93132000  0.52979900  1
  O  O53  1  0.32891900  0.56684500  0.46818700  1
  O  O54  1  0.37859300  0.85565000  0.92602000  1
  O  O55  1  0.35189800  0.66143400  0.07468500  1
  O  O56  1  0.33235600  0.76722700  0.32206400  1
  O  O57  1  0.35237300  0.72526500  0.67157600  1
  O  O58  1  0.29659300  0.99880800  0.72402100  1
  O  O59  1  0.30199100  0.49190600  0.27281700  1
  O  O60  1  0.18038000  0.50136400  0.77105800  1
  O  O61  1  0.17012400  0.99083200  0.22979600  1
  O  O62  1  0.14440200  0.22249100  0.82599700  1
  O  O63  1  0.14668100  0.27350400  0.17458100  1
  O  O64  1  0.13137700  0.35273800  0.57465100  1
  O  O65  1  0.14696800  0.16023900  0.42674500  1
  O  O66  1  0.16780300  0.43105700  0.96678100  1
  O  O67  1  0.16961600  0.06089200  0.03554500  1
  O  O68  1  0.07365500  0.59729000  0.15316200  1
  O  O69  1  0.06854900  0.90240100  0.85578400  1
  O  O70  1  0.06005000  0.65763100  0.58002300  1
  O  O71  1  0.05766900  0.85598100  0.43162400  1
