data_[Ag1Mo1Br1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Mo  2.1600  1.4500  0.7750
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.5378]
_cell_length_b [6.8032]
_cell_length_c [7.9250]
_cell_angle_alpha [71.8625]
_cell_angle_beta [67.6075]
_cell_angle_gamma [70.5927]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [AgMoBrCl6]
_chemical_formula_sum '[Ag1 Mo1 Br1 Cl6]'
_cell_volume [300.4198]
_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  0.6771  0.3926  0.7382  1
  Mo  Mo1  1  0.3441  0.4884  0.3280  1
  Br  Br2  1  0.9520  0.1410  0.9018  1
  Cl  Cl3  1  0.2973  0.4367  0.0733  1
  Cl  Cl4  1  0.3035  0.1552  0.4914  1
  Cl  Cl5  1  0.3546  0.5634  0.6088  1
  Cl  Cl6  1  0.3922  0.8263  0.1687  1
  Cl  Cl7  1  0.7302  0.3624  0.2377  1
  Cl  Cl8  1  0.9489  0.6338  0.4521  1
]