[CIF]
data_Be2NiB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.61987875
_cell_length_b   2.61987875
_cell_length_c   4.59828356
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2NiB
_chemical_formula_sum   'Be2 Ni1 B1'
_cell_volume   31.56153622
_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  3.49293105  1
  Be  Be1  1  1.30993937  1.30993937  4.53100010  1
  Be  Be2  1  0.00000000  0.00000000  1.07885154  1
  Ni  Ni3  1  1.30993937  1.30993937  2.39292616  1
[/CIF]
