# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08939500
_cell_length_b   6.79151487
_cell_length_c   8.29820290
_cell_angle_alpha   68.60743676
_cell_angle_beta   87.24102916
_cell_angle_gamma   87.35291285
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li2 Fe2 P4 O14'
_cell_volume   266.62762130
_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  0.28005800  0.82165800  0.99693600  1
  Li  Li1  1  0.79040900  0.17924000  0.43958300  1
  Fe  Fe2  1  0.75686400  0.79333000  0.27019100  1
  Fe  Fe3  1  0.24095900  0.22686200  0.72789600  1
  P  P4  1  0.28188300  0.45645300  0.30675100  1
  P  P5  1  0.71825700  0.54553900  0.68824200  1
  P  P6  1  0.23671700  0.11343000  0.17246300  1
  P  P7  1  0.76576400  0.89091000  0.82964900  1
  O  O8  1  0.28816800  0.35150200  0.15934900  1
  O  O9  1  0.90416700  0.35543100  0.76195800  1
  O  O10  1  0.11530400  0.66014100  0.22235400  1
  O  O11  1  0.05965400  0.93314300  0.78891300  1
  O  O12  1  0.15273800  0.29764200  0.47106200  1
  O  O13  1  0.56984200  0.49728000  0.32746500  1
  O  O14  1  0.26787500  0.11872200  0.98783900  1
  O  O15  1  0.81534800  0.70875400  0.51686500  1
  O  O16  1  0.44246600  0.96700000  0.29105700  1
  O  O17  1  0.95459700  0.06424500  0.24802200  1
  O  O18  1  0.58844200  0.05387700  0.69601000  1
  O  O19  1  0.68042000  0.85678000  0.01758200  1
  O  O20  1  0.71075300  0.66047600  0.82787700  1
  O  O21  1  0.43561500  0.48055800  0.68572100  1
