data_[Ga4Cl1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.0515]
_cell_length_b [5.4043]
_cell_length_c [19.5953]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [105.0426]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ga4Cl]
_chemical_formula_sum '[Ga4 Cl1]'
_cell_volume [312.0778]
_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
[
  Ga  Ga0  1  0.3342  0.1776  0.3932  1
  Ga  Ga1  1  0.4025  0.3257  0.6278  1
  Ga  Ga2  1  0.6190  0.7122  0.4113  1
  Ga  Ga3  1  0.8388  0.1859  0.5140  1
  Cl  Cl4  1  0.6249  0.7307  0.5537  1
]