data_[Mn8Cr2Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Cr  1.6600  1.4000  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.0664]
_cell_length_b [2.8486]
_cell_length_c [5.5430]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9610]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn4CrGa]
_chemical_formula_sum '[Mn8 Cr2 Ga2]'
_cell_volume [136.1789]
_cell_formula_units_Z [2]
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  4  0.1698  0.0000  0.8296  1
  Mn  Mn1  4  0.1710  0.0000  0.3419  1
  Cr  Cr2  2  0.0000  0.5000  0.5000  1
  Ga  Ga3  2  0.0000  0.5000  0.0000  1
]