data_[Mg8Bi4Sb4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [11.4722]
_cell_length_b [4.6775]
_cell_length_c [11.4878]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3837]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Mg2BiSbAu2]
_chemical_formula_sum '[Mg8 Bi4 Sb4 Au8]'
_cell_volume [581.5115]
_cell_formula_units_Z [4]
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
[
  Mg  Mg0  1  0.0009  0.0000  0.2516  1
  Mg  Mg1  1  0.1259  0.5000  0.6219  1
  Mg  Mg2  1  0.2502  0.0000  0.0025  1
  Mg  Mg3  1  0.3742  0.5000  0.3742  1
  Mg  Mg4  1  0.5024  0.0000  0.7503  1
  Mg  Mg5  1  0.6226  0.5000  0.1249  1
  Mg  Mg6  1  0.7467  0.0000  0.4968  1
  Mg  Mg7  1  0.8778  0.5000  0.8794  1
  Bi  Bi8  1  0.0015  0.0000  0.7528  1
  Bi  Bi9  1  0.3763  0.5000  0.8761  1
  Bi  Bi10  1  0.6230  0.5000  0.6248  1
  Bi  Bi11  1  0.8746  0.5000  0.3730  1
  Sb  Sb12  1  0.1256  0.5000  0.1265  1
  Sb  Sb13  1  0.2488  0.0000  0.4973  1
  Sb  Sb14  1  0.4980  0.0000  0.2488  1
  Sb  Sb15  1  0.7520  0.0000  0.0009  1
  Au  Au16  1  0.0014  0.0000  0.0080  1
  Au  Au17  1  0.1305  0.5000  0.3741  1
  Au  Au18  1  0.2511  0.0000  0.7426  1
  Au  Au19  1  0.3740  0.5000  0.1306  1
  Au  Au20  1  0.4926  0.0000  0.4928  1
  Au  Au21  1  0.6326  0.5000  0.8823  1
  Au  Au22  1  0.7425  0.0000  0.2426  1
  Au  Au23  1  0.8747  0.5000  0.6251  1
]