# generated using pymatgen
data_LiFePH2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10976500
_cell_length_b   8.22803700
_cell_length_c   11.04421400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFePH2O5
_chemical_formula_sum   'Li4 Fe4 P4 H8 O20'
_cell_volume   464.33559433
_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  0.19570900  0.12272400  0.11582200  1
  Li  Li1  1  0.69570900  0.62272400  0.38417800  1
  Li  Li2  1  0.19570900  0.37727600  0.61582200  1
  Li  Li3  1  0.69570900  0.87727600  0.88417800  1
  Fe  Fe4  1  0.69919400  0.31287900  0.19654900  1
  Fe  Fe5  1  0.19919400  0.81287900  0.30345100  1
  Fe  Fe6  1  0.69919400  0.18712100  0.69654900  1
  Fe  Fe7  1  0.19919400  0.68712100  0.80345100  1
  P  P8  1  0.68923600  0.91282800  0.16738800  1
  P  P9  1  0.18923600  0.41282800  0.33261200  1
  P  P10  1  0.68923600  0.58717200  0.66738800  1
  P  P11  1  0.18923600  0.08717200  0.83261200  1
  H  H12  1  0.37573800  0.56929600  0.00731200  1
  H  H13  1  0.14308100  0.68640400  0.03819800  1
  H  H14  1  0.64308100  0.18640400  0.46180200  1
  H  H15  1  0.87573800  0.06929600  0.49268800  1
  H  H16  1  0.37573800  0.93070400  0.50731200  1
  H  H17  1  0.14308100  0.81359600  0.53819800  1
  H  H18  1  0.64308100  0.31359600  0.96180200  1
  H  H19  1  0.87573800  0.43070400  0.99268800  1
  O  O20  1  0.69357000  0.40437900  0.01459000  1
  O  O21  1  0.62603200  0.82456900  0.04993500  1
  O  O22  1  0.56053500  0.08561100  0.17029800  1
  O  O23  1  0.99295100  0.93597000  0.18399300  1
  O  O24  1  0.09022400  0.31633400  0.21853900  1
  O  O25  1  0.59022400  0.81633400  0.28146100  1
  O  O26  1  0.49295100  0.43597000  0.31600700  1
  O  O27  1  0.06053500  0.58561100  0.32970200  1
  O  O28  1  0.12603200  0.32456900  0.45006500  1
  O  O29  1  0.19357000  0.90437900  0.48541000  1
  O  O30  1  0.69357000  0.09562100  0.51459000  1
  O  O31  1  0.62603200  0.67543100  0.54993500  1
  O  O32  1  0.56053500  0.41438900  0.67029800  1
  O  O33  1  0.99295100  0.56403000  0.68399300  1
  O  O34  1  0.09022400  0.18366600  0.71853900  1
  O  O35  1  0.59022400  0.68366600  0.78146100  1
  O  O36  1  0.49295100  0.06403000  0.81600700  1
  O  O37  1  0.06053500  0.91438900  0.82970200  1
  O  O38  1  0.12603200  0.17543100  0.95006500  1
  O  O39  1  0.19357000  0.59562100  0.98541000  1
