data_[Lu6Mn8Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Mn  1.5500  1.4000  0.6483
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.0073]
_cell_length_b [7.1065]
_cell_length_c [13.4346]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Lu3(MnGe)4]
_chemical_formula_sum '[Lu6 Mn8 Ge8]'
_cell_volume [382.5903]
_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
[
  Lu  Lu0  4  0.0000  0.0000  0.1235  1.0
  Lu  Lu1  2  0.0000  0.5000  0.0000  1.0
  Mn  Mn2  8  0.0000  0.1914  0.3210  1.0
  Ge  Ge3  4  0.0000  0.2995  0.5000  1.0
  Ge  Ge4  4  0.0000  0.5000  0.2225  1.0
]