# generated using pymatgen
data_Li2Fe3(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61247900
_cell_length_b   6.91442142
_cell_length_c   7.42129878
_cell_angle_alpha   75.21132671
_cell_angle_beta   81.97890388
_cell_angle_gamma   67.99681702
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe3(P2O7)2
_chemical_formula_sum   'Li2 Fe3 P4 O14'
_cell_volume   257.86650889
_cell_formula_units_Z   1
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  0.62818000  0.01449600  0.68888100  1
  Li  Li1  1  0.37182000  0.98550400  0.31111900  1
  Fe  Fe2  1  0.19044100  0.51763300  0.30964900  1
  Fe  Fe3  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe4  1  0.80955900  0.48236700  0.69035100  1
  P  P5  1  0.80124400  0.26001700  0.34690400  1
  P  P6  1  0.19875600  0.73998300  0.65309600  1
  P  P7  1  0.65063100  0.68281600  0.06963600  1
  P  P8  1  0.34936900  0.31718400  0.93036400  1
  O  O9  1  0.73915900  0.43040700  0.14620800  1
  O  O10  1  0.06540300  0.64802800  0.54449700  1
  O  O11  1  0.36735900  0.77331200  0.14298500  1
  O  O12  1  0.31952700  0.28857900  0.14160200  1
  O  O13  1  0.54837100  0.24826600  0.44764600  1
  O  O14  1  0.63264100  0.22668800  0.85701500  1
  O  O15  1  0.45162900  0.75173400  0.55235400  1
  O  O16  1  0.68047300  0.71142100  0.85839800  1
  O  O17  1  0.01993700  0.93962800  0.71782600  1
  O  O18  1  0.17283000  0.23273100  0.85445300  1
  O  O19  1  0.98006300  0.06037200  0.28217400  1
  O  O20  1  0.82717000  0.76726900  0.14554700  1
  O  O21  1  0.93459700  0.35197200  0.45550300  1
  O  O22  1  0.26084100  0.56959300  0.85379200  1
