# generated using pymatgen
data_Li2FeBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80063100
_cell_length_b   5.35830500
_cell_length_c   5.81463500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeBO4
_chemical_formula_sum   'Li4 Fe2 B2 O8'
_cell_volume   149.57128122
_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  0.99338900  0.33638500  0.75258700  1
  Li  Li1  1  0.49338900  0.66361500  0.74741300  1
  Li  Li2  1  0.99338900  0.33638500  0.24741300  1
  Li  Li3  1  0.49338900  0.66361500  0.25258700  1
  Fe  Fe4  1  0.99611400  0.85811800  0.50000000  1
  Fe  Fe5  1  0.49611400  0.14188200  0.00000000  1
  B  B6  1  0.50240100  0.17224000  0.50000000  1
  B  B7  1  0.00240100  0.82776000  0.00000000  1
  O  O8  1  0.81234000  0.16823600  0.50000000  1
  O  O9  1  0.39330500  0.90836200  0.50000000  1
  O  O10  1  0.90452800  0.69379300  0.78713000  1
  O  O11  1  0.40452800  0.30620700  0.71287000  1
  O  O12  1  0.89330500  0.09163800  0.00000000  1
  O  O13  1  0.31234000  0.83176400  0.00000000  1
  O  O14  1  0.40452800  0.30620700  0.28713000  1
  O  O15  1  0.90452800  0.69379300  0.21287000  1
