data_[Be2As2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  As  2.1800  1.1500  0.6600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [4.5663]
_cell_length_b [3.9972]
_cell_length_c [6.5822]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.8138]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [BeAsAu]
_chemical_formula_sum '[Be2 As2 Au2]'
_cell_volume [106.2618]
_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
[
  Be  Be0  2  0.7337  0.3034  0.5547  1.0
  As  As1  2  0.8491  0.1979  0.2567  1.0
  Au  Au2  2  0.2939  0.4979  0.1385  1.0
]