data_BiAs2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92
_cell_length_b   3.84
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   106.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiAs2Pd
_chemical_formula_sum   'Bi1 As2 Pd1'
_cell_volume   89.69
_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
  Bi  Bi2  1  0.15  0.92  0.65  1.0
  As  As0  1  0.82  0.92  0.52  1.0
  As  As1  1  0.56  0.0  0.31  1.0
  Pd  Pd3  1  0.95  0.0  0.42  1.0

data_BiAs2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.84
_cell_length_b   3.92
_cell_length_c   6.21
_cell_angle_alpha   106.15
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiAs2Pd
_chemical_formula_sum   'Bi1 As2 Pd1'
_cell_volume   89.69
_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
  Bi  Bi0  1  0.08  0.85  0.35  1.0
  As  As1  1  0.0  0.44  0.69  1.0
  As  As2  1  0.08  0.18  0.48  1.0
  Pd  Pd3  1  0.0  0.05  0.58  1.0

Bi As As Pd