data_[Mn4Ga2Re2Se2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ga  1.8100  1.3000  0.7600
  Re  1.9000  1.3500  0.7125
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.1540]
_cell_length_b [3.1540]
_cell_length_c [14.9268]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Mn2GaReSe]
_chemical_formula_sum '[Mn4 Ga2 Re2 Se2]'
_cell_volume [148.4841]
_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  2  0.0000  0.0000  0.3290  1
  Mn  Mn1  2  0.0000  0.0000  0.7324  1
  Ga  Ga2  2  0.0000  0.0000  0.5160  1
  Re  Re3  2  0.0000  0.0000  0.9116  1
  Se  Se4  2  0.0000  0.0000  0.1647  1
]