# generated using pymatgen
data_LiFePO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34450008
_cell_length_b   7.91870012
_cell_length_c   8.37002804
_cell_angle_alpha   89.99210544
_cell_angle_beta   90.00826971
_cell_angle_gamma   90.01804534
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFePO4
_chemical_formula_sum   'Li4 Fe4 P4 O16'
_cell_volume   354.23206199
_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  0.34113900  0.52066600  0.20583900  1
  Li  Li1  1  0.34104200  0.02069000  0.29416500  1
  Li  Li2  1  0.84085800  0.97922000  0.70587100  1
  Li  Li3  1  0.84097900  0.47939400  0.79415900  1
  Fe  Fe4  1  0.47580600  0.67881900  0.56025700  1
  Fe  Fe5  1  0.47582200  0.17880000  0.93949100  1
  Fe  Fe6  1  0.97583000  0.82120800  0.06047200  1
  Fe  Fe7  1  0.97565500  0.32113800  0.43969900  1
  P  P8  1  0.00349800  0.24620500  0.06517800  1
  P  P9  1  0.00348600  0.74616000  0.43487600  1
  P  P10  1  0.50349400  0.25382200  0.56513600  1
  P  P11  1  0.50370400  0.75389300  0.93485000  1
  O  O12  1  0.24633400  0.35512900  0.04933100  1
  O  O13  1  0.24639100  0.85509600  0.45069700  1
  O  O14  1  0.74624800  0.14484700  0.54934600  1
  O  O15  1  0.74646000  0.64495700  0.95071700  1
  O  O16  1  0.34381500  0.73705300  0.08948000  1
  O  O17  1  0.34363000  0.23699300  0.41047400  1
  O  O18  1  0.84370700  0.76290900  0.58953900  1
  O  O19  1  0.84365800  0.26304800  0.91052800  1
  O  O20  1  0.11623600  0.06119300  0.07891300  1
  O  O21  1  0.11621400  0.56112300  0.42111800  1
  O  O22  1  0.61629300  0.43884100  0.57885000  1
  O  O23  1  0.61616900  0.93897200  0.92094100  1
  O  O24  1  0.84279500  0.29172500  0.21023200  1
  O  O25  1  0.84269100  0.79179100  0.28980000  1
  O  O26  1  0.34264300  0.20823700  0.71015900  1
  O  O27  1  0.34286200  0.70807000  0.78988000  1
