data_[Mn2Re2Tc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Re  1.9000  1.3500  0.7125
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.9043]
_cell_length_b [2.7194]
_cell_length_c [4.6951]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0239]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MnReTc2]
_chemical_formula_sum '[Mn2 Re2 Tc4]'
_cell_volume [111.9539]
_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  0.5000  0.0000  1
  Tc  Tc1  4  0.2458  0.0000  0.2406  1
  Re  Re2  2  0.0000  0.0000  0.5000  1
]