# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.05071400
_cell_length_b   5.09928000
_cell_length_c   14.21988115
_cell_angle_alpha   70.40455270
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li4 Fe4 P8 O28'
_cell_volume   549.95721121
_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  0.77943700  0.04369400  0.74659100  1
  Li  Li1  1  0.27943700  0.95630600  0.75340900  1
  Li  Li2  1  0.72056300  0.04369400  0.24659100  1
  Li  Li3  1  0.22056300  0.95630600  0.25340900  1
  Fe  Fe4  1  0.84786600  0.68936000  0.11681200  1
  Fe  Fe5  1  0.34786600  0.31064000  0.38318800  1
  Fe  Fe6  1  0.65213400  0.68936000  0.61681200  1
  Fe  Fe7  1  0.15213400  0.31064000  0.88318800  1
  P  P8  1  0.70685600  0.32249000  0.47600200  1
  P  P9  1  0.46645300  0.56554400  0.17890200  1
  P  P10  1  0.96645300  0.43445600  0.32109800  1
  P  P11  1  0.20685600  0.67751000  0.02399800  1
  P  P12  1  0.79314400  0.32249000  0.97600200  1
  P  P13  1  0.03354700  0.56554400  0.67890200  1
  P  P14  1  0.53354700  0.43445600  0.82109800  1
  P  P15  1  0.29314400  0.67751000  0.52399800  1
  O  O16  1  0.54278400  0.20177200  0.77757000  1
  O  O17  1  0.86362500  0.68932700  0.25876100  1
  O  O18  1  0.32795000  0.40111900  0.50757700  1
  O  O19  1  0.09092200  0.72903200  0.10149900  1
  O  O20  1  0.14210700  0.53106200  0.33683400  1
  O  O21  1  0.89161600  0.32987900  0.43402000  1
  O  O22  1  0.21010400  0.92105000  0.92413000  1
  O  O23  1  0.39161600  0.67012100  0.06598000  1
  O  O24  1  0.71010400  0.07895000  0.57587000  1
  O  O25  1  0.64210700  0.46893800  0.16316600  1
  O  O26  1  0.59092200  0.27096800  0.39850100  1
  O  O27  1  0.36362500  0.31067300  0.24123900  1
  O  O28  1  0.82795000  0.59888100  0.99242300  1
  O  O29  1  0.04278400  0.79822800  0.72243000  1
  O  O30  1  0.95721600  0.20177200  0.27757000  1
  O  O31  1  0.17205000  0.40111900  0.00757700  1
  O  O32  1  0.63637500  0.68932700  0.75876100  1
  O  O33  1  0.40907800  0.72903200  0.60149900  1
  O  O34  1  0.35789300  0.53106200  0.83683400  1
  O  O35  1  0.28989600  0.92105000  0.42413000  1
  O  O36  1  0.60838400  0.32987900  0.93402000  1
  O  O37  1  0.78989600  0.07895000  0.07587000  1
  O  O38  1  0.10838400  0.67012100  0.56598000  1
  O  O39  1  0.85789300  0.46893800  0.66316600  1
  O  O40  1  0.90907800  0.27096800  0.89850100  1
  O  O41  1  0.67205000  0.59888100  0.49242300  1
  O  O42  1  0.13637500  0.31067300  0.74123900  1
  O  O43  1  0.45721600  0.79822800  0.22243000  1
