data_Ga3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65
_cell_length_b   5.65
_cell_length_c   5.65
_cell_angle_alpha   116.55
_cell_angle_beta   116.55
_cell_angle_gamma   116.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga3Cl
_chemical_formula_sum   'Ga3 Cl1'
_cell_volume   85.01
_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  Ga1  1  0.6  0.61  0.06  1.0
  Ga  Ga2  1  0.4  0.61  0.06  1.0
  Ga  Ga3  1  0.0  0.77  0.06  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_Ga3Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.19
_cell_length_b   5.65
_cell_length_c   5.65
_cell_angle_alpha   116.55
_cell_angle_beta   100.84
_cell_angle_gamma   100.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga3Cl
_chemical_formula_sum   'Ga3 Cl1'
_cell_volume   85.01
_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  0.06  0.06  0.29  1.0
  Ga  Ga1  1  0.06  0.66  0.45  1.0
  Ga  Ga2  1  0.06  0.47  0.45  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Ga Ga Ga Cl
Ga Ga Ga Cl 0 1 o o o 2 3 o + o 