data_Mn2Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88
_cell_length_b   6.88
_cell_length_c   2.62
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Ga
_chemical_formula_sum   'Mn6 Ga3'
_cell_volume   107.4
_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
  Mn  Mn3  1  0.11  0.0  0.31  1.0
  Mn  Mn4  1  0.95  0.82  0.31  1.0
  Mn  Mn5  1  0.39  0.14  0.31  1.0
  Mn  Mn6  1  0.39  0.0  0.0  1.0
  Mn  Mn7  1  0.81  0.8  0.0  1.0
  Mn  Mn8  1  0.25  0.16  0.0  1.0
  Ga  Ga0  1  0.0  0.97  0.31  1.0
  Ga  Ga1  1  0.44  0.99  0.31  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0

data_Mn2Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.62
_cell_length_b   6.88
_cell_length_c   6.88
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Ga
_chemical_formula_sum   'Mn6 Ga3'
_cell_volume   107.4
_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
  Mn  Mn0  1  0.0  0.25  0.16  1.0
  Mn  Mn1  1  0.0  0.81  0.8  1.0
  Mn  Mn2  1  0.0  0.39  0.0  1.0
  Mn  Mn3  1  0.31  0.11  0.0  1.0
  Mn  Mn4  1  0.31  0.39  0.14  1.0
  Mn  Mn5  1  0.31  0.95  0.82  1.0
  Ga  Ga6  1  0.0  0.0  0.0  1.0
  Ga  Ga7  1  0.31  0.0  0.97  1.0
  Ga  Ga8  1  0.31  0.44  0.99  1.0

Mn Mn Mn Mn Mn Mn Ga Ga Ga