data_MgGa2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35
_cell_length_b   4.9
_cell_length_c   9.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgGa2
_chemical_formula_sum   'Mg4 Ga8'
_cell_volume   288.74
_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
  Mg  Mg8  1  0.27  0.23  0.24  1.0
  Mg  Mg9  1  0.91  0.68  0.61  1.0
  Mg  Mg10  1  0.45  0.23  0.66  1.0
  Mg  Mg11  1  0.09  0.68  0.03  1.0
  Ga  Ga0  1  0.44  0.23  0.58  1.0
  Ga  Ga1  1  0.09  0.68  0.22  1.0
  Ga  Ga2  1  0.26  0.23  0.05  1.0
  Ga  Ga3  1  0.91  0.68  0.69  1.0
  Ga  Ga4  1  0.29  0.23  0.7  1.0
  Ga  Ga5  1  0.24  0.68  0.06  1.0
  Ga  Ga6  1  0.11  0.23  0.21  1.0
  Ga  Ga7  1  0.07  0.68  0.57  1.0

data_MgGa2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.9
_cell_length_b   6.35
_cell_length_c   9.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   MgGa2
_chemical_formula_sum   'Mg4 Ga8'
_cell_volume   288.74
_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
  Mg  Mg0  2  0.27  0.59  0.61  1.0
  Mg  Mg1  2  0.27  0.77  0.03  1.0
  Ga  Ga2  2  0.27  0.43  0.57  1.0
  Ga  Ga3  2  0.27  0.59  0.42  1.0
  Ga  Ga4  2  0.27  0.61  0.06  1.0
  Ga  Ga5  2  0.27  0.76  0.95  1.0

Mg Mg Mg Mg Ga Ga Ga Ga Ga Ga Ga Ga