data_BeCo5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97
_cell_length_b   6.41
_cell_length_c   6.41
_cell_angle_alpha   22.38
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCo5
_chemical_formula_sum   'Be1 Co5'
_cell_volume   62.01
_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  0.01  1.0
  Co  Co1  1  0.0  0.0  0.34  1.0
  Co  Co2  1  0.0  0.0  0.22  1.0
  Co  Co3  1  0.98  0.0  0.95  1.0
  Co  Co4  1  0.98  0.0  0.79  1.0
  Co  Co5  1  0.98  0.0  0.21  1.0

data_BeCo5
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.49
_cell_length_b   3.97
_cell_length_c   6.41
_cell_angle_alpha   90.0
_cell_angle_beta   101.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCo5
_chemical_formula_sum   'Be1 Co5'
_cell_volume   62.01
_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  0.99  0.0  0.99  1.0
  Co  Co1  1  0.05  0.98  0.05  1.0
  Co  Co2  1  0.21  0.98  0.21  1.0
  Co  Co3  1  0.66  0.0  0.66  1.0
  Co  Co4  1  0.78  0.0  0.78  1.0
  Co  Co5  1  0.79  0.98  0.79  1.0

Be Co Co Co Co Co