# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.27873600
_cell_length_b   6.70797660
_cell_length_c   7.08641448
_cell_angle_alpha   75.44267553
_cell_angle_beta   65.08852982
_cell_angle_gamma   81.03527078
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li2 Fe2 P4 O14'
_cell_volume   261.57906280
_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  0.93772000  0.32712900  0.18600900  1
  Li  Li1  1  0.06228000  0.67287100  0.81399100  1
  Fe  Fe2  1  0.74216600  0.18789800  0.90110500  1
  Fe  Fe3  1  0.25783400  0.81210200  0.09889500  1
  P  P4  1  0.22573100  0.17712800  0.75849500  1
  P  P5  1  0.36492700  0.36636100  0.30056300  1
  P  P6  1  0.63507300  0.63363900  0.69943700  1
  P  P7  1  0.77426900  0.82287200  0.24150500  1
  O  O8  1  0.94585200  0.97296900  0.23244400  1
  O  O9  1  0.38534700  0.06890500  0.87558000  1
  O  O10  1  0.40229400  0.25676700  0.51992800  1
  O  O11  1  0.18704800  0.25882000  0.28077700  1
  O  O12  1  0.06327700  0.35396800  0.85471300  1
  O  O13  1  0.62040800  0.34547100  0.13274800  1
  O  O14  1  0.69901300  0.40328700  0.68320000  1
  O  O15  1  0.30098700  0.59671300  0.31680000  1
  O  O16  1  0.37959200  0.65452900  0.86725200  1
  O  O17  1  0.93672300  0.64603200  0.14528700  1
  O  O18  1  0.81295200  0.74118000  0.71922300  1
  O  O19  1  0.59770600  0.74323300  0.48007200  1
  O  O20  1  0.61465300  0.93109500  0.12442000  1
  O  O21  1  0.05414800  0.02703100  0.76755600  1
