# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.36399000
_cell_length_b   6.42521404
_cell_length_c   6.95583065
_cell_angle_alpha   84.61277894
_cell_angle_beta   67.21834103
_cell_angle_gamma   81.92777339
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li2 Fe2 P4 O14'
_cell_volume   259.39358051
_cell_formula_units_Z   2
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  0.70671200  0.00328700  0.83537100  1
  Li  Li1  1  0.29328800  0.99671300  0.16462900  1
  Fe  Fe2  1  0.09880400  0.64900500  0.77575800  1
  Fe  Fe3  1  0.90119600  0.35099500  0.22424200  1
  P  P4  1  0.34326500  0.38786600  0.35794700  1
  P  P5  1  0.65673500  0.61213400  0.64205300  1
  P  P6  1  0.21331200  0.13581200  0.77055700  1
  P  P7  1  0.78668800  0.86418800  0.22944300  1
  O  O8  1  0.22346400  0.59093400  0.47073600  1
  O  O9  1  0.61122800  0.94728200  0.13850100  1
  O  O10  1  0.38877200  0.05271800  0.86149900  1
  O  O11  1  0.93692500  0.03044600  0.23894900  1
  O  O12  1  0.35242900  0.20686700  0.53256100  1
  O  O13  1  0.21554300  0.30693900  0.23844700  1
  O  O14  1  0.05318900  0.33338900  0.88036500  1
  O  O15  1  0.64757100  0.79313300  0.46743900  1
  O  O16  1  0.77653600  0.40906600  0.52926400  1
  O  O17  1  0.59458100  0.40125600  0.21670100  1
  O  O18  1  0.40541900  0.59874400  0.78329900  1
  O  O19  1  0.94681100  0.66661100  0.11963500  1
  O  O20  1  0.78445700  0.69306100  0.76155300  1
  O  O21  1  0.06307500  0.96955400  0.76105100  1
