data_ZrAg2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76
_cell_length_b   5.76
_cell_length_c   3.05
_cell_angle_alpha   90.54
_cell_angle_beta   90.54
_cell_angle_gamma   125.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAg2Cl
_chemical_formula_sum   'Zr1 Ag2 Cl1'
_cell_volume   82.16
_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
  Zr  Zr3  1  0.63  0.0  0.0  1.0
  Ag  Ag0  1  0.28  0.44  0.52  1.0
  Ag  Ag1  1  0.28  0.56  0.52  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_ZrAg2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   5.26
_cell_length_c   5.76
_cell_angle_alpha   62.86
_cell_angle_beta   89.46
_cell_angle_gamma   88.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAg2Cl
_chemical_formula_sum   'Zr1 Ag2 Cl1'
_cell_volume   82.16
_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
  Zr  Zr0  1  0.0  0.0  0.63  1.0
  Ag  Ag1  1  0.48  0.44  0.85  1.0
  Ag  Ag2  1  0.48  0.56  0.72  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Zr Ag Ag Cl