# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31285718
_cell_length_b   6.31285718
_cell_length_c   13.41794947
_cell_angle_alpha   74.16224890
_cell_angle_beta   74.16224890
_cell_angle_gamma   80.32612810
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li4 Fe4 P8 O28'
_cell_volume   492.37107756
_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  0.76732200  0.01947100  0.62902500  1
  Li  Li1  1  0.01947100  0.76732200  0.12902500  1
  Li  Li2  1  0.23267800  0.98052900  0.37097500  1
  Li  Li3  1  0.98052900  0.23267800  0.87097500  1
  Fe  Fe4  1  0.59742300  0.12384200  0.14189100  1
  Fe  Fe5  1  0.87615800  0.40257700  0.35810900  1
  Fe  Fe6  1  0.40257700  0.87615800  0.85810900  1
  Fe  Fe7  1  0.12384200  0.59742300  0.64189100  1
  P  P8  1  0.24631700  0.09475200  0.63600300  1
  P  P9  1  0.33306100  0.42042200  0.42636600  1
  P  P10  1  0.57957800  0.66693900  0.07363400  1
  P  P11  1  0.09475200  0.24631700  0.13600300  1
  P  P12  1  0.66693900  0.57957800  0.57363400  1
  P  P13  1  0.90524800  0.75368300  0.86399700  1
  P  P14  1  0.75368300  0.90524800  0.36399700  1
  P  P15  1  0.42042200  0.33306100  0.92636600  1
  O  O16  1  0.53325300  0.43954800  0.14530100  1
  O  O17  1  0.98420100  0.42577300  0.19598600  1
  O  O18  1  0.19011400  0.33064700  0.37440900  1
  O  O19  1  0.61207600  0.78781800  0.47858600  1
  O  O20  1  0.21516700  0.61411100  0.47660600  1
  O  O21  1  0.61411100  0.21516700  0.97660600  1
  O  O22  1  0.72834700  0.91413100  0.81521300  1
  O  O23  1  0.38588900  0.78483300  0.02339400  1
  O  O24  1  0.46674700  0.56045200  0.85469900  1
  O  O25  1  0.01579900  0.57422700  0.80401400  1
  O  O26  1  0.11235700  0.93255800  0.61695300  1
  O  O27  1  0.66935300  0.80988600  0.12559100  1
  O  O28  1  0.21218200  0.38792400  0.02141400  1
  O  O29  1  0.33064700  0.19011400  0.87440900  1
  O  O30  1  0.56045200  0.46674700  0.35469900  1
  O  O31  1  0.38792400  0.21218200  0.52141400  1
  O  O32  1  0.78781800  0.61207600  0.97858600  1
  O  O33  1  0.43954800  0.53325300  0.64530100  1
  O  O34  1  0.57422700  0.01579900  0.30401400  1
  O  O35  1  0.93255800  0.11235700  0.11695300  1
  O  O36  1  0.80988600  0.66935300  0.62559100  1
  O  O37  1  0.27165300  0.08586900  0.18478700  1
  O  O38  1  0.88764300  0.06744200  0.38304700  1
  O  O39  1  0.42577300  0.98420100  0.69598600  1
  O  O40  1  0.06744200  0.88764300  0.88304700  1
  O  O41  1  0.78483300  0.38588900  0.52339400  1
  O  O42  1  0.91413100  0.72834700  0.31521300  1
  O  O43  1  0.08586900  0.27165300  0.68478700  1
