# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.19619600
_cell_length_b   7.51117500
_cell_length_c   12.57885312
_cell_angle_alpha   62.78770669
_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   520.63252051
_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  0.11639500  0.32547200  0.04739400  1
  Li  Li1  1  0.61639500  0.67452800  0.45260600  1
  Li  Li2  1  0.38360500  0.32547200  0.54739400  1
  Li  Li3  1  0.88360500  0.67452800  0.95260600  1
  Fe  Fe4  1  0.37717600  0.20743200  0.26769700  1
  Fe  Fe5  1  0.12282400  0.20743200  0.76769700  1
  Fe  Fe6  1  0.87717600  0.79256800  0.23230300  1
  Fe  Fe7  1  0.62282400  0.79256800  0.73230300  1
  P  P8  1  0.11214000  0.68875900  0.71629600  1
  P  P9  1  0.64854100  0.22287200  0.04012000  1
  P  P10  1  0.14854100  0.77712800  0.45988000  1
  P  P11  1  0.61214000  0.31124100  0.78370400  1
  P  P12  1  0.38786000  0.68875900  0.21629600  1
  P  P13  1  0.85145900  0.22287200  0.54012000  1
  P  P14  1  0.35145900  0.77712800  0.95988000  1
  P  P15  1  0.88786000  0.31124100  0.28370400  1
  O  O16  1  0.78986300  0.40242000  0.01083700  1
  O  O17  1  0.68319500  0.19076000  0.29571200  1
  O  O18  1  0.03341100  0.75837700  0.58094500  1
  O  O19  1  0.06578500  0.24554600  0.22363500  1
  O  O20  1  0.29325700  0.96573100  0.40933500  1
  O  O21  1  0.64057100  0.53841500  0.72081300  1
  O  O22  1  0.44025100  0.20574800  0.11340100  1
  O  O23  1  0.14057100  0.46158500  0.77918700  1
  O  O24  1  0.53341100  0.24162300  0.91905500  1
  O  O25  1  0.94025100  0.79425200  0.38659900  1
  O  O26  1  0.79325700  0.03426900  0.09066500  1
  O  O27  1  0.71013700  0.40242000  0.51083700  1
  O  O28  1  0.56578500  0.75445400  0.27636500  1
  O  O29  1  0.81680500  0.19076000  0.79571200  1
  O  O30  1  0.18319500  0.80924000  0.20428800  1
  O  O31  1  0.43421500  0.24554600  0.72363500  1
  O  O32  1  0.28986300  0.59758000  0.48916300  1
  O  O33  1  0.20674300  0.96573100  0.90933500  1
  O  O34  1  0.05974900  0.20574800  0.61340100  1
  O  O35  1  0.46658900  0.75837700  0.08094500  1
  O  O36  1  0.85942900  0.53841500  0.22081300  1
  O  O37  1  0.55974900  0.79425200  0.88659900  1
  O  O38  1  0.35942900  0.46158500  0.27918700  1
  O  O39  1  0.70674300  0.03426900  0.59066500  1
  O  O40  1  0.93421500  0.75445400  0.77636500  1
  O  O41  1  0.96658900  0.24162300  0.41905500  1
  O  O42  1  0.31680500  0.80924000  0.70428800  1
  O  O43  1  0.21013700  0.59758000  0.98916300  1
