# generated using pymatgen
data_LiFe(PO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.71013900
_cell_length_b   9.51913480
_cell_length_c   9.46531404
_cell_angle_alpha   108.79654784
_cell_angle_beta   104.84349720
_cell_angle_gamma   109.24296358
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe(PO3)3
_chemical_formula_sum   'Li4 Fe4 P12 O36'
_cell_volume   714.81218747
_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  0.50401000  0.93286200  0.34794000  1
  Li  Li1  1  0.49599000  0.06713800  0.65206000  1
  Li  Li2  1  0.67599000  0.84885500  0.64431000  1
  Li  Li3  1  0.32401000  0.15114500  0.35569000  1
  Fe  Fe4  1  0.72661700  0.76685500  0.25097700  1
  Fe  Fe5  1  0.78827300  0.69993300  0.89983600  1
  Fe  Fe6  1  0.21172700  0.30006700  0.10016400  1
  Fe  Fe7  1  0.27338300  0.23314500  0.74902300  1
  P  P8  1  0.70521400  0.33606800  0.56991700  1
  P  P9  1  0.83530900  0.20919900  0.94404100  1
  P  P10  1  0.64297400  0.38779400  0.99816500  1
  P  P11  1  0.89405900  0.14969100  0.51231700  1
  P  P12  1  0.07808200  0.91252700  0.81110100  1
  P  P13  1  0.10594100  0.85030900  0.48768300  1
  P  P14  1  0.35702600  0.61220600  0.00183500  1
  P  P15  1  0.16469100  0.79080100  0.05595900  1
  P  P16  1  0.92191800  0.08747300  0.18889900  1
  P  P17  1  0.40919600  0.56869600  0.69148300  1
  P  P18  1  0.59080400  0.43130400  0.30851700  1
  P  P19  1  0.29478600  0.66393200  0.43008300  1
  O  O20  1  0.74750900  0.98656600  0.44630000  1
  O  O21  1  0.83006100  0.16327000  0.09362100  1
  O  O22  1  0.99946700  0.73018200  0.04866100  1
  O  O23  1  0.92381800  0.18329600  0.36376600  1
  O  O24  1  0.07618200  0.81670400  0.63623400  1
  O  O25  1  0.00053300  0.26981800  0.95133900  1
  O  O26  1  0.16993900  0.83673000  0.90637900  1
  O  O27  1  0.19971400  0.63100100  0.99965900  1
  O  O28  1  0.13951600  0.69713100  0.40240900  1
  O  O29  1  0.04631900  0.17675000  0.63021400  1
  O  O30  1  0.18734500  0.09732900  0.88400200  1
  O  O31  1  0.32358700  0.43548500  0.97052900  1
  O  O32  1  0.37402200  0.64290600  0.84964200  1
  O  O33  1  0.28965600  0.60339700  0.57062200  1
  O  O34  1  0.30058000  0.92790700  0.21186900  1
  O  O35  1  0.09047200  0.14025100  0.20037500  1
  O  O36  1  0.25796600  0.52307600  0.27602500  1
  O  O37  1  0.44417800  0.82425100  0.49698000  1
  O  O38  1  0.35523200  0.38515500  0.63128600  1
  O  O39  1  0.25249100  0.01343400  0.55370000  1
  O  O40  1  0.57943500  0.68098300  0.72847400  1
  O  O41  1  0.86048400  0.30286900  0.59759100  1
  O  O42  1  0.49939700  0.74992100  0.15469100  1
  O  O43  1  0.42056500  0.31901700  0.27152600  1
  O  O44  1  0.50060300  0.25007900  0.84530900  1
  O  O45  1  0.64476800  0.61484500  0.36871400  1
  O  O46  1  0.55582200  0.17574900  0.50302000  1
  O  O47  1  0.74203400  0.47692400  0.72397500  1
  O  O48  1  0.90952800  0.85974900  0.79962500  1
  O  O49  1  0.69942000  0.07209300  0.78813100  1
  O  O50  1  0.71034400  0.39660300  0.42937800  1
  O  O51  1  0.62597800  0.35709400  0.15035800  1
  O  O52  1  0.67641300  0.56451500  0.02947100  1
  O  O53  1  0.81265500  0.90267100  0.11599800  1
  O  O54  1  0.95368100  0.82325000  0.36978600  1
  O  O55  1  0.80028600  0.36899900  0.00034100  1
