data_[Lu2In1Ga1Fe4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Fe  1.8300  1.4000  0.8525
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.9632]
_cell_length_b [4.9355]
_cell_length_c [6.8941]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Lu2InGaFe4]
_chemical_formula_sum '[Lu2 In1 Ga1 Fe4]'
_cell_volume [134.8502]
_cell_formula_units_Z [1]
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  1  0.5000  0.0000  0.2985  1
  Lu  Lu1  1  0.5000  0.5000  0.6962  1
  In  In2  1  0.0000  0.0000  0.6467  1
  Ga  Ga3  1  0.0000  0.5000  0.3375  1
  Fe  Fe4  2  0.0000  0.2506  0.0051  1
  Fe  Fe5  1  0.5000  0.0000  0.9138  1
  Fe  Fe6  1  0.5000  0.5000  0.0972  1
]