data_Be2InSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.27
_cell_length_b   6.27
_cell_length_c   6.27
_cell_angle_alpha   146.3
_cell_angle_beta   145.71
_cell_angle_gamma   48.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2InSb
_chemical_formula_sum   'Be2 In1 Sb1'
_cell_volume   76.8
_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  0.41  1.0
  Be  Be1  1  0.82  0.0  0.65  1.0
  In  In2  1  0.0  0.0  0.88  1.0
  Sb  Sb3  1  0.0  0.85  0.9  1.0

data_Be2InSb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.64
_cell_length_b   3.7
_cell_length_c   6.27
_cell_angle_alpha   107.15
_cell_angle_beta   106.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2InSb
_chemical_formula_sum   'Be2 In1 Sb1'
_cell_volume   76.8
_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  0.41  0.41  1.0
  Be  Be1  1  0.0  0.65  0.84  1.0
  In  In2  1  0.0  0.88  0.88  1.0
  Sb  Sb3  1  0.15  0.05  0.05  1.0

Be Be In Sb
Be Be In Sb 0 1 - o o 0 3 o - - 0 2 o o o 1 2 + o o 2 3 o - o 