# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.38501700
_cell_length_b   6.70051500
_cell_length_c   9.19989195
_cell_angle_alpha   76.32627001
_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   502.23631646
_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  0.07731900  0.73496500  0.24887400  1
  Li  Li1  1  0.92268100  0.26503500  0.75112600  1
  Li  Li2  1  0.57731900  0.26503500  0.75112600  1
  Li  Li3  1  0.42268100  0.73496500  0.24887400  1
  Fe  Fe4  1  0.44243500  0.75116500  0.75022000  1
  Fe  Fe5  1  0.05756500  0.75116500  0.75022000  1
  Fe  Fe6  1  0.94243500  0.24883500  0.24978000  1
  Fe  Fe7  1  0.55756500  0.24883500  0.24978000  1
  P  P8  1  0.75000000  0.50093800  0.44401300  1
  P  P9  1  0.25000000  0.49906200  0.55598700  1
  P  P10  1  0.75000000  0.92442600  0.52630000  1
  P  P11  1  0.75000000  0.57512000  0.97199700  1
  P  P12  1  0.75000000  0.00310300  0.05259100  1
  P  P13  1  0.25000000  0.42488000  0.02800300  1
  P  P14  1  0.25000000  0.99689700  0.94740900  1
  P  P15  1  0.25000000  0.07557400  0.47370000  1
  O  O16  1  0.25000000  0.25721900  0.55719300  1
  O  O17  1  0.25000000  0.23785500  0.94986800  1
  O  O18  1  0.09678400  0.97918700  0.85587900  1
  O  O19  1  0.40321600  0.97918700  0.85587900  1
  O  O20  1  0.59678400  0.02081300  0.14412100  1
  O  O21  1  0.90321600  0.02081300  0.14412100  1
  O  O22  1  0.75000000  0.76214500  0.05013200  1
  O  O23  1  0.75000000  0.38763400  0.10729300  1
  O  O24  1  0.09985400  0.42217200  0.12234000  1
  O  O25  1  0.40014600  0.42217200  0.12234000  1
  O  O26  1  0.25000000  0.86861800  0.10589200  1
  O  O27  1  0.09989500  0.08242900  0.37917400  1
  O  O28  1  0.40010500  0.08242900  0.37917400  1
  O  O29  1  0.75000000  0.11511800  0.39311400  1
  O  O30  1  0.59652500  0.48141900  0.35340200  1
  O  O31  1  0.90014600  0.57782800  0.87766000  1
  O  O32  1  0.25000000  0.62347800  0.39639900  1
  O  O33  1  0.75000000  0.74278100  0.44280700  1
  O  O34  1  0.90347500  0.48141900  0.35340200  1
  O  O35  1  0.75000000  0.37652200  0.60360100  1
  O  O36  1  0.09652500  0.51858100  0.64659800  1
  O  O37  1  0.40347500  0.51858100  0.64659800  1
  O  O38  1  0.25000000  0.88488200  0.60688600  1
  O  O39  1  0.59989500  0.91757100  0.62082600  1
  O  O40  1  0.90010500  0.91757100  0.62082600  1
  O  O41  1  0.75000000  0.13138200  0.89410800  1
  O  O42  1  0.59985400  0.57782800  0.87766000  1
  O  O43  1  0.25000000  0.61236600  0.89270700  1
