data_BeCoPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96
_cell_length_b   4.96
_cell_length_c   4.96
_cell_angle_alpha   148.54
_cell_angle_beta   148.54
_cell_angle_gamma   45.09
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCoPd
_chemical_formula_sum   'Be1 Co1 Pd1'
_cell_volume   33.23
_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  0.0  0.07  1.0
  Co  Co1  1  0.0  0.0  0.27  1.0
  Pd  Pd2  1  0.0  0.0  0.99  1.0

data_BeCoPd
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.81
_cell_length_b   3.81
_cell_length_c   4.96
_cell_angle_alpha   90.0
_cell_angle_beta   112.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BeCoPd
_chemical_formula_sum   'Be2 Co2 Pd2'
_cell_volume   66.46
_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
  Be  Be0  2  0.0  0.0  0.93  1.0
  Co  Co1  2  0.0  0.0  0.73  1.0
  Pd  Pd2  2  0.0  0.0  0.01  1.0

Be Co Pd
Be Co Pd 0 2 o o - 0 1 o o o 