data_BeTeCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   3.98
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   106.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeTeCl2
_chemical_formula_sum   'Be1 Te1 Cl2'
_cell_volume   98.01
_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  0.4  0.0  0.91  1.0
  Te  Te3  1  0.12  0.99  0.21  1.0
  Cl  Cl1  1  0.28  0.99  0.56  1.0
  Cl  Cl2  1  0.91  0.0  0.42  1.0

data_BeTeCl2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.56
_cell_length_b   3.98
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   106.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   BeTeCl2
_chemical_formula_sum   'Be1 Te1 Cl2'
_cell_volume   98.01
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.4  0.0  0.91  1.0
  Te  Te1  1  0.12  0.0  0.21  1.0
  Cl  Cl2  1  0.28  0.0  0.56  1.0
  Cl  Cl3  1  0.91  0.0  0.42  1.0

Be Te Cl Cl