# generated using pymatgen
data_Li2Fe2P4H3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94432600
_cell_length_b   7.56725928
_cell_length_c   8.15759087
_cell_angle_alpha   90.44871715
_cell_angle_beta   91.14049270
_cell_angle_gamma   103.68890532
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe2P4H3O16
_chemical_formula_sum   'Li2 Fe2 P4 H3 O16'
_cell_volume   296.46309788
_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  0.38870000  0.84680200  0.12881000  1
  Li  Li1  1  0.59873200  0.15323800  0.87381300  1
  Fe  Fe2  1  0.49800600  0.99895200  0.50174800  1
  Fe  Fe3  1  0.00227000  0.50036500  0.00007100  1
  P  P4  1  0.11052400  0.25165600  0.66382900  1
  P  P5  1  0.37274100  0.23615000  0.15585000  1
  P  P6  1  0.62488700  0.75723300  0.84140800  1
  P  P7  1  0.88479000  0.75051700  0.33656300  1
  H  H8  1  0.45251800  0.47966700  0.60487300  1
  H  H9  1  0.54998500  0.51474000  0.38128200  1
  H  H10  1  0.95669500  0.97879800  0.98576900  1
  O  O11  1  0.98898000  0.70043400  0.16851600  1
  O  O12  1  0.12989800  0.84330000  0.44520700  1
  O  O13  1  0.17912100  0.36806800  0.16738900  1
  O  O14  1  0.25330200  0.43726800  0.57768600  1
  O  O15  1  0.36885300  0.66894000  0.94364900  1
  O  O16  1  0.54687300  0.81578800  0.67221400  1
  O  O17  1  0.25204900  0.05892900  0.05618300  1
  O  O18  1  0.33236200  0.13892400  0.68388600  1
  O  O19  1  0.66319400  0.86321100  0.31613900  1
  O  O20  1  0.75317400  0.94098200  0.94347900  1
  O  O21  1  0.44955500  0.18691400  0.33088900  1
  O  O22  1  0.63403200  0.33533100  0.06014100  1
  O  O23  1  0.74024900  0.56496500  0.42349900  1
  O  O24  1  0.82537200  0.63219900  0.83175500  1
  O  O25  1  0.86485600  0.15836900  0.55551800  1
  O  O26  1  0.00444400  0.30024700  0.83180700  1
