data_Be2InRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   4.82
_cell_angle_alpha   136.67
_cell_angle_beta   136.67
_cell_angle_gamma   62.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2InRu
_chemical_formula_sum   'Be2 In1 Ru1'
_cell_volume   51.95
_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
  Be  Be0  1  0.0  0.78  0.05  1.0
  Be  Be1  1  0.0  0.0  0.0  1.0
  In  In2  1  0.78  0.0  0.05  1.0
  Ru  Ru3  1  0.0  0.0  0.11  1.0

data_Be2InRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.56
_cell_length_b   3.56
_cell_length_c   4.82
_cell_angle_alpha   111.67
_cell_angle_beta   111.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2InRu
_chemical_formula_sum   'Be2 In1 Ru1'
_cell_volume   51.95
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Be  Be1  1  0.28  0.05  0.28  1.0
  In  In2  1  0.05  0.28  0.28  1.0
  Ru  Ru3  1  0.11  0.11  0.11  1.0

Be Be In Ru
Be Be In Ru 0 3 o + o 1 3 o o o 2 3 + o o 