data_[Ga3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [2.9720]
_cell_length_b [4.3838]
_cell_length_c [5.2844]
_cell_angle_alpha [66.6359]
_cell_angle_beta [78.2462]
_cell_angle_gamma [74.1502]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ga]
_chemical_formula_sum '[Ga3]'
_cell_volume [60.4449]
_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
[
  Ga  Ga0  2  0.3185  0.1983  0.1645  1.0
  Ga  Ga1  1  0.5000  0.5000  0.5000  1.0
]