# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.25571300
_cell_length_b   5.08362400
_cell_length_c   9.75207678
_cell_angle_alpha   60.63549352
_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   572.72990707
_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  0.37846800  0.02046700  0.35199700  1
  Li  Li1  1  0.87846800  0.97953300  0.14800300  1
  Li  Li2  1  0.12153200  0.02046700  0.85199700  1
  Li  Li3  1  0.62153200  0.97953300  0.64800300  1
  Fe  Fe4  1  0.32597200  0.96637800  0.73448600  1
  Fe  Fe5  1  0.17402800  0.96637800  0.23448500  1
  Fe  Fe6  1  0.67402800  0.03362200  0.26551400  1
  Fe  Fe7  1  0.82597200  0.03362200  0.76551400  1
  P  P8  1  0.03143100  0.47600000  0.22369400  1
  P  P9  1  0.46856900  0.47600000  0.72369400  1
  P  P10  1  0.53143100  0.52400000  0.27630600  1
  P  P11  1  0.32214500  0.27841200  0.95731900  1
  P  P12  1  0.17785500  0.27841200  0.45731900  1
  P  P13  1  0.96856900  0.52400000  0.77630600  1
  P  P14  1  0.82214500  0.72158800  0.54268100  1
  P  P15  1  0.67785500  0.72158800  0.04268100  1
  O  O16  1  0.28561600  0.59371400  0.91906800  1
  O  O17  1  0.69106900  0.94003000  0.86572900  1
  O  O18  1  0.44920900  0.21882500  0.68350900  1
  O  O19  1  0.05964800  0.31319400  0.41464100  1
  O  O20  1  0.05079100  0.21882500  0.18350900  1
  O  O21  1  0.11035900  0.73584900  0.13957500  1
  O  O22  1  0.94920900  0.78117500  0.81649100  1
  O  O23  1  0.78561600  0.40628600  0.58093200  1
  O  O24  1  0.80893100  0.94003000  0.36572900  1
  O  O25  1  0.07451200  0.41693400  0.79531800  1
  O  O26  1  0.27121600  0.15614500  0.85902100  1
  O  O27  1  0.22878400  0.15614500  0.35902100  1
  O  O28  1  0.42548800  0.41693400  0.29531800  1
  O  O29  1  0.71438400  0.40628600  0.08093200  1
  O  O30  1  0.61035900  0.26415100  0.36042500  1
  O  O31  1  0.94035200  0.68680600  0.58535900  1
  O  O32  1  0.44035200  0.31319400  0.91464100  1
  O  O33  1  0.72878400  0.84385500  0.14097900  1
  O  O34  1  0.21438400  0.59371400  0.41906800  1
  O  O35  1  0.92548800  0.58306600  0.20468200  1
  O  O36  1  0.19106900  0.05997000  0.63427100  1
  O  O37  1  0.55079100  0.78117500  0.31649100  1
  O  O38  1  0.77121600  0.84385500  0.64097900  1
  O  O39  1  0.57451200  0.58306600  0.70468200  1
  O  O40  1  0.38964100  0.73584900  0.63957500  1
  O  O41  1  0.30893100  0.05997000  0.13427100  1
  O  O42  1  0.55964800  0.68680600  0.08535900  1
  O  O43  1  0.88964100  0.26415100  0.86042500  1
