data_FeAg2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   4.98
_cell_angle_alpha   100.31
_cell_angle_beta   100.31
_cell_angle_gamma   35.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeAg2Cl
_chemical_formula_sum   'Fe1 Ag2 Cl1'
_cell_volume   71.29
_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
  Fe  Fe3  1  0.34  0.0  0.45  1.0
  Ag  Ag0  1  0.04  0.0  0.31  1.0
  Ag  Ag1  1  0.63  0.0  0.58  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_FeAg2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   4.98
_cell_length_c   5.04
_cell_angle_alpha   100.31
_cell_angle_beta   107.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeAg2Cl
_chemical_formula_sum   'Fe1 Ag2 Cl1'
_cell_volume   71.29
_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
  Fe  Fe0  1  0.0  0.45  0.34  1.0
  Ag  Ag1  1  0.0  0.31  0.04  1.0
  Ag  Ag2  1  0.0  0.58  0.63  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Fe Ag Ag Cl
Fe Ag Ag Cl 0 1 o o o 0 2 o o o 1 3 o o o 