data_Li2GaCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   5.07
_cell_angle_alpha   147.64
_cell_angle_beta   132.51
_cell_angle_gamma   58.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2GaCo
_chemical_formula_sum   'Li2 Ga1 Co1'
_cell_volume   51.07
_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
  Li  Li2  1  0.41  0.0  0.15  1.0
  Li  Li3  1  0.0  0.04  0.28  1.0
  Ga  Ga1  1  0.0  0.0  0.42  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0

data_Li2GaCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.83
_cell_length_b   4.08
_cell_length_c   5.07
_cell_angle_alpha   113.74
_cell_angle_beta   106.18
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2GaCo
_chemical_formula_sum   'Li2 Ga1 Co1'
_cell_volume   51.07
_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
  Li  Li0  1  0.0  0.15  0.73  1.0
  Li  Li1  1  0.96  0.23  0.23  1.0
  Ga  Ga2  1  0.0  0.42  0.42  1.0
  Co  Co3  1  0.0  0.0  0.0  1.0

Li Li Ga Co
Li Li Ga Co 0 3 o o o 1 2 o o o 1 3 o o o 