data_AgBCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.67
_cell_length_b   6.67
_cell_length_c   6.67
_cell_angle_alpha   33.66
_cell_angle_beta   33.66
_cell_angle_gamma   33.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgBCl2
_chemical_formula_sum   'Ag1 B1 Cl2'
_cell_volume   81.27
_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
  Ag  Ag0  1  0.0  0.0  0.43  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  Cl  Cl2  1  0.0  0.0  0.79  1.0
  Cl  Cl3  1  0.0  0.0  0.07  1.0

data_AgBCl2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.69
_cell_length_b   3.86
_cell_length_c   6.67
_cell_angle_alpha   90.0
_cell_angle_beta   109.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AgBCl2
_chemical_formula_sum   'Ag2 B2 Cl4'
_cell_volume   162.54
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ag  Ag0  2  0.0  0.0  0.57  1.0
  B  B1  2  0.0  0.0  0.0  1.0
  Cl  Cl2  2  0.0  0.0  0.21  1.0
  Cl  Cl3  2  0.0  0.0  0.93  1.0

Ag B Cl Cl
Ag B Cl Cl 0 3 o o o 0 2 o o o 1 3 o o o 1 2 o o - 