# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45643900
_cell_length_b   9.36849740
_cell_length_c   10.52043203
_cell_angle_alpha   114.54265630
_cell_angle_beta   85.90295394
_cell_angle_gamma   107.10015342
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li4 Fe4 P8 O28'
_cell_volume   552.32676228
_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  0.08130800  0.06825400  0.05847100  1
  Li  Li1  1  0.65162000  0.05871500  0.59630100  1
  Li  Li2  1  0.96045400  0.84750900  0.52049800  1
  Li  Li3  1  0.56181700  0.51132800  0.97489400  1
  Fe  Fe4  1  0.72533300  0.09251200  0.22945300  1
  Fe  Fe5  1  0.63486500  0.49458600  0.24550700  1
  Fe  Fe6  1  0.34896600  0.49265900  0.73851000  1
  Fe  Fe7  1  0.27951000  0.89872700  0.78449400  1
  P  P8  1  0.41627900  0.69444200  0.53581200  1
  P  P9  1  0.58397300  0.30663100  0.46244100  1
  P  P10  1  0.92628600  0.80636400  0.20777500  1
  P  P11  1  0.69742000  0.19094200  0.95662500  1
  P  P12  1  0.11811300  0.44252900  0.29188300  1
  P  P13  1  0.31340000  0.79699200  0.04524700  1
  P  P14  1  0.88090900  0.55756500  0.70121700  1
  P  P15  1  0.07766200  0.17635800  0.79715200  1
  O  O16  1  0.61595900  0.67194800  0.45101000  1
  O  O17  1  0.94649600  0.51529500  0.27144800  1
  O  O18  1  0.92763500  0.27493300  0.90945400  1
  O  O19  1  0.95069900  0.07038200  0.65781100  1
  O  O20  1  0.01534600  0.87343500  0.35416100  1
  O  O21  1  0.08504800  0.71833000  0.09416300  1
  O  O22  1  0.04345000  0.47747300  0.72229400  1
  O  O23  1  0.02381600  0.26376500  0.27166000  1
  O  O24  1  0.26701900  0.89555900  0.96845900  1
  O  O25  1  0.20716000  0.54673600  0.45510500  1
  O  O26  1  0.36769200  0.85863700  0.57066100  1
  O  O27  1  0.45781500  0.91437900  0.17740700  1
  O  O28  1  0.31930100  0.46565000  0.20831700  1
  O  O29  1  0.13324000  0.07198700  0.86489100  1
  O  O30  1  0.39246200  0.65287400  0.94830000  1
  O  O31  1  0.74217900  0.10451500  0.04272000  1
  O  O32  1  0.28338300  0.31179200  0.80125700  1
  O  O33  1  0.38867100  0.33690800  0.54688600  1
  O  O34  1  0.42831000  0.69023500  0.68154500  1
  O  O35  1  0.71178400  0.66427700  0.16908800  1
  O  O36  1  0.57006900  0.29946200  0.31299300  1
  O  O37  1  0.60328400  0.33278600  0.03930600  1
  O  O38  1  0.90309500  0.93944900  0.16264000  1
  O  O39  1  0.68412300  0.53569400  0.78872400  1
  O  O40  1  0.56517000  0.06990300  0.81854700  1
  O  O41  1  0.64449900  0.15105700  0.44211800  1
  O  O42  1  0.79090000  0.46136600  0.53929000  1
  O  O43  1  0.98956800  0.73272900  0.71333900  1
