data_BeIn2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.67
_cell_length_c   5.67
_cell_angle_alpha   32.44
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeIn2Cl
_chemical_formula_sum   'Be1 In2 Cl1'
_cell_volume   87.39
_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
  In  In2  1  0.53  0.0  0.0  1.0
  In  In3  1  0.0  0.0  0.2  1.0
  Cl  Cl1  1  0.53  0.0  0.72  1.0

data_BeIn2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   5.07
_cell_length_c   5.67
_cell_angle_alpha   90.0
_cell_angle_beta   106.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeIn2Cl
_chemical_formula_sum   'Be1 In2 Cl1'
_cell_volume   87.39
_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  0.59  0.0  0.59  1.0
  In  In1  1  0.8  0.0  0.8  1.0
  In  In2  1  1.0  0.53  1.0  1.0
  Cl  Cl3  1  0.28  0.53  0.28  1.0

Be In In Cl