# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.56810704
_cell_length_b   7.56810704
_cell_length_c   11.18564964
_cell_angle_alpha   89.21901419
_cell_angle_beta   89.21901419
_cell_angle_gamma   116.69288650
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li8 Fe4 P8 O28'
_cell_volume   572.20066464
_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  0.70552200  0.27356100  0.50232400  1
  Li  Li1  1  0.72643900  0.29447800  0.99767600  1
  Li  Li2  1  0.72026300  0.27973700  0.75000000  1
  Li  Li3  1  0.27973700  0.72026300  0.25000000  1
  Li  Li4  1  0.29447800  0.72643900  0.49767600  1
  Li  Li5  1  0.27356100  0.70552200  0.00232400  1
  Li  Li6  1  0.71022900  0.28977100  0.25000000  1
  Li  Li7  1  0.28977100  0.71022900  0.75000000  1
  Fe  Fe8  1  0.30546900  0.30867400  0.61689800  1
  Fe  Fe9  1  0.69453100  0.69132600  0.38310200  1
  Fe  Fe10  1  0.30867400  0.30546900  0.11689800  1
  Fe  Fe11  1  0.69132600  0.69453100  0.88310200  1
  P  P12  1  0.90814900  0.67633600  0.63237400  1
  P  P13  1  0.09185100  0.32366400  0.36762600  1
  P  P14  1  0.91548300  0.70459800  0.12825300  1
  P  P15  1  0.29540200  0.08451700  0.37174700  1
  P  P16  1  0.70459800  0.91548300  0.62825300  1
  P  P17  1  0.32366400  0.09185100  0.86762600  1
  P  P18  1  0.08451700  0.29540200  0.87174700  1
  P  P19  1  0.67633600  0.90814900  0.13237400  1
  O  O20  1  0.12078100  0.71464400  0.62510300  1
  O  O21  1  0.57664200  0.80473100  0.25231800  1
  O  O22  1  0.08988400  0.10612100  0.37355900  1
  O  O23  1  0.87921900  0.28535600  0.37489700  1
  O  O24  1  0.80277800  0.58906500  0.24273500  1
  O  O25  1  0.78077900  0.56315200  0.52542800  1
  O  O26  1  0.23465800  0.86597600  0.37382400  1
  O  O27  1  0.40961400  0.18753800  0.48471100  1
  O  O28  1  0.91011600  0.89387900  0.62644100  1
  O  O29  1  0.86597600  0.23465800  0.87382400  1
  O  O30  1  0.21922100  0.43684800  0.47457200  1
  O  O31  1  0.19526900  0.42335800  0.24768200  1
  O  O32  1  0.10612100  0.08988400  0.87355900  1
  O  O33  1  0.81246200  0.59038600  0.01528900  1
  O  O34  1  0.43684800  0.21922100  0.97457200  1
  O  O35  1  0.56315200  0.78077900  0.02542800  1
  O  O36  1  0.18753800  0.40961400  0.98471100  1
  O  O37  1  0.76534200  0.13402400  0.62617600  1
  O  O38  1  0.42335800  0.19526900  0.74768200  1
  O  O39  1  0.19722200  0.41093500  0.75726500  1
  O  O40  1  0.89387900  0.91011600  0.12644100  1
  O  O41  1  0.41093500  0.19722200  0.25726500  1
  O  O42  1  0.13402400  0.76534200  0.12617600  1
  O  O43  1  0.71464400  0.12078100  0.12510300  1
  O  O44  1  0.58906500  0.80277800  0.74273500  1
  O  O45  1  0.59038600  0.81246200  0.51528900  1
  O  O46  1  0.28535600  0.87921900  0.87489700  1
  O  O47  1  0.80473100  0.57664200  0.75231800  1
