data_LiBeNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47
_cell_length_b   4.47
_cell_length_c   3.91
_cell_angle_alpha   109.1
_cell_angle_beta   109.1
_cell_angle_gamma   33.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBeNi2
_chemical_formula_sum   'Li1 Be1 Ni2'
_cell_volume   40.18
_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  Li1  1  0.16  0.0  0.84  1.0
  Be  Be0  1  0.65  0.0  0.99  1.0
  Ni  Ni2  1  0.48  0.0  0.08  1.0
  Ni  Ni3  1  0.1  0.0  0.61  1.0

data_LiBeNi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.55
_cell_length_b   3.91
_cell_length_c   4.47
_cell_angle_alpha   109.1
_cell_angle_beta   106.61
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBeNi2
_chemical_formula_sum   'Li1 Be1 Ni2'
_cell_volume   40.18
_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  0.0  0.84  0.16  1.0
  Be  Be1  1  0.0  0.99  0.65  1.0
  Ni  Ni2  1  0.0  0.08  0.48  1.0
  Ni  Ni3  1  0.0  0.61  0.1  1.0

Li Be Ni Ni