[CIF]
data_Be2FeB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.51357970
_cell_length_b   3.51357970
_cell_length_c   3.51357970
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2FeB
_chemical_formula_sum   'Be2 Fe1 B1'
_cell_volume   30.67145855
_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
  B  B0  1  0.00000000  0.00000000  0.00000000  1
  Be  Be1  1  3.72671405  3.72671405  3.72671405  1
  Be  Be2  1  1.24223802  1.24223802  1.24223802  1
  Fe  Fe3  1  2.48447603  2.48447603  2.48447603  1
[/CIF]
