data_BeSbAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67
_cell_length_b   5.67
_cell_length_c   5.68
_cell_angle_alpha   115.51
_cell_angle_beta   115.51
_cell_angle_gamma   37.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeSbAs2
_chemical_formula_sum   'Be1 Sb1 As2'
_cell_volume   98.09
_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
  Be  Be2  1  0.89  0.0  0.39  1.0
  Sb  Sb3  1  0.28  0.0  0.71  1.0
  As  As0  1  0.35  0.0  0.44  1.0
  As  As1  1  0.89  0.0  0.11  1.0

data_BeSbAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.61
_cell_length_b   5.67
_cell_length_c   5.68
_cell_angle_alpha   115.51
_cell_angle_beta   90.0
_cell_angle_gamma   108.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeSbAs2
_chemical_formula_sum   'Be1 Sb1 As2'
_cell_volume   98.09
_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
  Be  Be0  1  0.0  0.11  0.61  1.0
  Sb  Sb1  1  0.0  0.72  0.29  1.0
  As  As2  1  0.0  0.11  0.89  1.0
  As  As3  1  0.0  0.65  0.56  1.0

Be Sb As As