# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.24163800
_cell_length_b   7.18218900
_cell_length_c   9.71731551
_cell_angle_alpha   68.99068040
_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   536.95919369
_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  0.88604200  0.67050200  0.75035200  1
  Li  Li1  1  0.11395800  0.32949800  0.24964800  1
  Li  Li2  1  0.38604200  0.32949800  0.74964800  1
  Li  Li3  1  0.61395800  0.67050200  0.25035200  1
  Fe  Fe4  1  0.49860800  0.26439100  0.24878700  1
  Fe  Fe5  1  0.00139200  0.26439100  0.74878700  1
  Fe  Fe6  1  0.99860800  0.73560900  0.25121300  1
  Fe  Fe7  1  0.50139200  0.73560900  0.75121300  1
  P  P8  1  0.69269400  0.31481100  0.94368400  1
  P  P9  1  0.30730600  0.68518900  0.05631600  1
  P  P10  1  0.80730600  0.31481100  0.44368400  1
  P  P11  1  0.26912200  0.09185800  0.55182600  1
  P  P12  1  0.76912200  0.90814200  0.94817400  1
  P  P13  1  0.73087800  0.90814200  0.44817400  1
  P  P14  1  0.19269400  0.68518900  0.55631600  1
  P  P15  1  0.23087800  0.09185800  0.05182600  1
  O  O16  1  0.34346800  0.90424100  0.06092600  1
  O  O17  1  0.84346800  0.09575900  0.43907400  1
  O  O18  1  0.33445900  0.21626100  0.11586900  1
  O  O19  1  0.07675600  0.01473700  0.14253400  1
  O  O20  1  0.92324400  0.98526300  0.85746600  1
  O  O21  1  0.66554100  0.78373900  0.88413100  1
  O  O22  1  0.15653200  0.90424100  0.56092600  1
  O  O23  1  0.57675600  0.98526300  0.35746600  1
  O  O24  1  0.31984200  0.69596900  0.89750300  1
  O  O25  1  0.69887400  0.78962400  0.61188800  1
  O  O26  1  0.83445900  0.78373900  0.38413100  1
  O  O27  1  0.13659200  0.62278100  0.12092000  1
  O  O28  1  0.36340800  0.62278100  0.62092000  1
  O  O29  1  0.18015800  0.69596900  0.39750300  1
  O  O30  1  0.80112600  0.78962400  0.11188800  1
  O  O31  1  0.68015800  0.30403100  0.10249700  1
  O  O32  1  0.05956700  0.56105000  0.65939000  1
  O  O33  1  0.86340800  0.37721900  0.87908000  1
  O  O34  1  0.42324400  0.01473700  0.64253400  1
  O  O35  1  0.94043300  0.43895000  0.34061000  1
  O  O36  1  0.44043300  0.56105000  0.15939000  1
  O  O37  1  0.19887400  0.21037600  0.88811200  1
  O  O38  1  0.81984200  0.30403100  0.60249700  1
  O  O39  1  0.63659200  0.37721900  0.37908000  1
  O  O40  1  0.65653200  0.09575900  0.93907400  1
  O  O41  1  0.16554100  0.21626100  0.61586900  1
  O  O42  1  0.30112600  0.21037600  0.38811200  1
  O  O43  1  0.55956700  0.43895000  0.84061000  1
