data_SrBiAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   6.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrBiAs2
_chemical_formula_sum   'Sr1 Bi1 As2'
_cell_volume   122.82
_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
  Sr  Sr3  1  0.0  0.0  0.82  1.0
  Bi  Bi2  1  0.17  0.17  0.08  1.0
  As  As0  1  0.17  0.17  0.88  1.0
  As  As1  1  0.0  0.0  0.57  1.0

data_SrBiAs2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.13
_cell_length_b   6.13
_cell_length_c   6.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrBiAs2
_chemical_formula_sum   'Sr2 Bi2 As4'
_cell_volume   245.65
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Sr  Sr0  2  0.0  0.0  0.82  1.0
  Bi  Bi1  2  0.17  0.0  0.08  1.0
  As  As2  2  0.0  0.0  0.57  1.0
  As  As3  2  0.17  0.0  0.88  1.0

Sr Bi As As
Sr Bi As As 0 2 o o o 0 3 o o o 1 2 o o - 