# generated using pymatgen
data_Li2FeBAsO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.64137800
_cell_length_b   5.18229500
_cell_length_c   8.72996185
_cell_angle_alpha   86.83656443
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeBAsO7
_chemical_formula_sum   'Li4 Fe2 B2 As2 O14'
_cell_volume   300.00630849
_cell_formula_units_Z   2
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  0.02198300  0.78258400  0.79699800  1
  Li  Li1  1  0.47801700  0.78258400  0.79699800  1
  Li  Li2  1  0.52198300  0.21741600  0.20300200  1
  Li  Li3  1  0.97801700  0.21741600  0.20300200  1
  Fe  Fe4  1  0.25000000  0.21595100  0.66509400  1
  Fe  Fe5  1  0.75000000  0.78404900  0.33490600  1
  B  B6  1  0.25000000  0.26623800  0.94538700  1
  B  B7  1  0.75000000  0.73376200  0.05461300  1
  As  As8  1  0.75000000  0.27466100  0.57709900  1
  As  As9  1  0.25000000  0.72533900  0.42290100  1
  O  O10  1  0.75000000  0.71541500  0.90089700  1
  O  O11  1  0.25000000  0.02820800  0.87948600  1
  O  O12  1  0.25000000  0.47221800  0.83719800  1
  O  O13  1  0.95190800  0.17962000  0.68661300  1
  O  O14  1  0.54809200  0.17962000  0.68661300  1
  O  O15  1  0.25000000  0.85001800  0.60240100  1
  O  O16  1  0.75000000  0.60640500  0.53706900  1
  O  O17  1  0.25000000  0.39359500  0.46293100  1
  O  O18  1  0.75000000  0.14998200  0.39759900  1
  O  O19  1  0.45190800  0.82038000  0.31338700  1
  O  O20  1  0.04809200  0.82038000  0.31338700  1
  O  O21  1  0.75000000  0.52778200  0.16280200  1
  O  O22  1  0.75000000  0.97179200  0.12051400  1
  O  O23  1  0.25000000  0.28458500  0.09910300  1
