# generated using pymatgen
data_LiFe2P2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34389700
_cell_length_b   7.68106700
_cell_length_c   14.04571600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2P2O9
_chemical_formula_sum   'Li4 Fe8 P8 O36'
_cell_volume   684.41821515
_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  0.75000000  0.95378200  0.76969200  1
  Li  Li1  1  0.75000000  0.54621800  0.26969200  1
  Li  Li2  1  0.25000000  0.45378200  0.73030800  1
  Li  Li3  1  0.25000000  0.04621800  0.23030800  1
  Fe  Fe4  1  0.75000000  0.35104500  0.88116800  1
  Fe  Fe5  1  0.25000000  0.64895500  0.11883200  1
  Fe  Fe6  1  0.25000000  0.85104500  0.61883200  1
  Fe  Fe7  1  0.75000000  0.14895500  0.38116800  1
  Fe  Fe8  1  0.50000000  0.00000000  0.00000000  1
  Fe  Fe9  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe10  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe11  1  0.00000000  0.00000000  0.00000000  1
  P  P12  1  0.25000000  0.35338300  0.93476400  1
  P  P13  1  0.75000000  0.64661700  0.06523600  1
  P  P14  1  0.75000000  0.85338300  0.56523600  1
  P  P15  1  0.25000000  0.14661700  0.43476400  1
  P  P16  1  0.75000000  0.38946200  0.69299700  1
  P  P17  1  0.75000000  0.11053800  0.19299700  1
  P  P18  1  0.25000000  0.88946200  0.80700300  1
  P  P19  1  0.25000000  0.61053800  0.30700300  1
  O  O20  1  0.04588400  0.58753900  0.36582500  1
  O  O21  1  0.54588400  0.41246100  0.63417500  1
  O  O22  1  0.95411600  0.08753900  0.13417500  1
  O  O23  1  0.45411600  0.91246100  0.86582500  1
  O  O24  1  0.95411600  0.41246100  0.63417500  1
  O  O25  1  0.45411600  0.58753900  0.36582500  1
  O  O26  1  0.04588400  0.91246100  0.86582500  1
  O  O27  1  0.54588400  0.08753900  0.13417500  1
  O  O28  1  0.25000000  0.33040600  0.48540800  1
  O  O29  1  0.75000000  0.66959400  0.51459200  1
  O  O30  1  0.75000000  0.83040600  0.01459200  1
  O  O31  1  0.25000000  0.16959400  0.98540800  1
  O  O32  1  0.75000000  0.14240900  0.95309600  1
  O  O33  1  0.25000000  0.85759100  0.04690400  1
  O  O34  1  0.25000000  0.64240900  0.54690400  1
  O  O35  1  0.75000000  0.35759100  0.45309600  1
  O  O36  1  0.75000000  0.21528100  0.74957900  1
  O  O37  1  0.25000000  0.78471900  0.25042100  1
  O  O38  1  0.25000000  0.71528100  0.75042100  1
  O  O39  1  0.75000000  0.28471900  0.24957900  1
  O  O40  1  0.43931900  0.13854500  0.36629900  1
  O  O41  1  0.93931900  0.86145500  0.63370100  1
  O  O42  1  0.56068100  0.63854500  0.13370100  1
  O  O43  1  0.06068100  0.36145500  0.86629900  1
  O  O44  1  0.56068100  0.86145500  0.63370100  1
  O  O45  1  0.06068100  0.13854500  0.36629900  1
  O  O46  1  0.43931900  0.36145500  0.86629900  1
  O  O47  1  0.93931900  0.63854500  0.13370100  1
  O  O48  1  0.75000000  0.50531800  0.99020700  1
  O  O49  1  0.25000000  0.02398100  0.72243000  1
  O  O50  1  0.25000000  0.47601900  0.22243000  1
  O  O51  1  0.75000000  0.52398100  0.77757000  1
  O  O52  1  0.75000000  0.99468200  0.49020700  1
  O  O53  1  0.25000000  0.00531800  0.50979300  1
  O  O54  1  0.25000000  0.49468200  0.00979300  1
  O  O55  1  0.75000000  0.97601900  0.27757000  1
