data_[Sr3Li6V3Cl18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  V  1.6300  1.3500  0.7775
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [6.6211]
_cell_length_b [6.6211]
_cell_length_c [18.2466]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [SrLi2VCl6]
_chemical_formula_sum '[Sr3 Li6 V3 Cl18]'
_cell_volume [692.7523]
_cell_formula_units_Z [3]
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
[
  Sr  Sr0  3  0.0000  0.0000  0.8124  1.0
  Li  Li1  3  0.0000  0.0000  0.0112  1.0
  Li  Li2  3  0.0000  0.0000  0.5263  1.0
  V  V3  3  0.0000  0.0000  0.3248  1.0
  Cl  Cl4  9  0.0078  0.3374  0.9193  1.0
  Cl  Cl5  9  0.0631  0.7088  0.0764  1.0
]