data_BeCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   5.22
_cell_angle_alpha   107.23
_cell_angle_beta   107.23
_cell_angle_gamma   34.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCo
_chemical_formula_sum   'Be3 Co3'
_cell_volume   54.13
_cell_formula_units_Z   3
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  0.16  0.0  0.97  1.0
  Be  Be1  1  0.92  0.0  0.59  1.0
  Be  Be2  1  0.61  0.0  0.1  1.0
  Co  Co3  1  0.13  0.0  0.32  1.0
  Co  Co4  1  0.25  0.0  0.69  1.0
  Co  Co5  1  0.46  0.0  0.38  1.0

data_BeCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.61
_cell_length_b   4.38
_cell_length_c   5.22
_cell_angle_alpha   107.23
_cell_angle_beta   90.0
_cell_angle_gamma   107.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCo
_chemical_formula_sum   'Be3 Co3'
_cell_volume   54.13
_cell_formula_units_Z   3
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  0.08  0.41  1.0
  Be  Be1  1  0.0  0.39  0.9  1.0
  Be  Be2  1  0.0  0.84  0.03  1.0
  Co  Co3  1  0.0  0.54  0.62  1.0
  Co  Co4  1  0.0  0.75  0.31  1.0
  Co  Co5  1  0.0  0.87  0.68  1.0

Be Be Be Co Co Co