data_[Na1Mn1Sn1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P312]
_cell_length_a [6.6508]
_cell_length_b [6.6508]
_cell_length_c [6.0202]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [149]
_chemical_formula_structural [NaMnSnCl6]
_chemical_formula_sum '[Na1 Mn1 Sn1 Cl6]'
_cell_volume [230.6161]
_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
[
  Na  Na0  1  0.6667  0.3333  0.5000  1.0
  Mn  Mn1  1  0.0000  0.0000  0.5000  1.0
  Sn  Sn2  1  0.3333  0.6667  0.0000  1.0
  Cl  Cl3  6  0.0078  0.3018  0.7349  1.0
]