data_GaHCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74
_cell_length_b   6.74
_cell_length_c   9.89
_cell_angle_alpha   91.49
_cell_angle_beta   91.49
_cell_angle_gamma   124.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaHCl2
_chemical_formula_sum   'Ga4 H4 Cl8'
_cell_volume   367.15
_cell_formula_units_Z   4
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  Ga8  1  0.51  0.57  0.1  1.0
  Ga  Ga9  1  0.88  0.57  0.71  1.0
  Ga  Ga10  1  0.79  0.43  0.17  1.0
  Ga  Ga11  1  0.16  0.43  0.77  1.0
  H  H12  1  0.44  0.66  0.5  1.0
  H  H13  1  0.96  0.66  0.31  1.0
  H  H14  1  0.71  0.34  0.56  1.0
  H  H15  1  0.23  0.34  0.37  1.0
  Cl  Cl0  1  0.45  0.33  0.07  1.0
  Cl  Cl1  1  0.11  0.84  0.43  1.0
  Cl  Cl2  1  0.28  0.84  0.37  1.0
  Cl  Cl3  1  0.94  0.33  0.74  1.0
  Cl  Cl4  1  0.73  0.67  0.13  1.0
  Cl  Cl5  1  0.39  0.16  0.5  1.0
  Cl  Cl6  1  0.56  0.16  0.44  1.0
  Cl  Cl7  1  0.22  0.67  0.8  1.0

data_GaHCl2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.23
_cell_length_b   6.74
_cell_length_c   9.89
_cell_angle_alpha   88.51
_cell_angle_beta   86.78
_cell_angle_gamma   62.48
_symmetry_Int_Tables_number   2
_chemical_formula_structural   GaHCl2
_chemical_formula_sum   'Ga4 H4 Cl8'
_cell_volume   367.15
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.43  0.02  0.77  1.0
  Ga  Ga1  2  0.43  0.39  0.17  1.0
  H  H2  2  0.34  0.04  0.37  1.0
  H  H3  2  0.34  0.56  0.56  1.0
  Cl  Cl4  2  0.16  0.06  0.5  1.0
  Cl  Cl5  2  0.16  0.89  0.44  1.0
  Cl  Cl6  2  0.33  0.28  0.2  1.0
  Cl  Cl7  2  0.33  0.78  0.87  1.0

Ga Ga Ga Ga H H H H Cl Cl Cl Cl Cl Cl Cl Cl