data_Cr5Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   4.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr5Co
_chemical_formula_sum   'Cr5 Co1'
_cell_volume   75.78
_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
  Cr  Cr1  1  0.17  0.02  0.01  1.0
  Cr  Cr2  1  0.33  0.35  0.0  1.0
  Cr  Cr3  1  0.83  0.02  0.01  1.0
  Cr  Cr4  1  0.33  0.0  0.01  1.0
  Cr  Cr5  1  0.0  0.69  0.0  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0

data_Cr5Co
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.67
_cell_length_b   4.02
_cell_length_c   4.67
_cell_angle_alpha   90.0
_cell_angle_beta   120.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Cr5Co
_chemical_formula_sum   'Cr5 Co1'
_cell_volume   75.78
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Cr  Cr0  1  -0.0  0.0  0.69  1.0
  Cr  Cr1  1  0.17  0.0  0.02  1.0
  Cr  Cr2  1  0.33  0.0  0.0  1.0
  Cr  Cr3  1  0.33  0.0  0.35  1.0
  Cr  Cr4  1  0.83  0.0  0.02  1.0
  Co  Co5  1  0.0  0.0  0.0  1.0

Cr Cr Cr Cr Cr Co
Cr Cr Cr Cr Cr Co 0 5 o o o 0 3 o o o 0 1 o o o 0 4 o - o 1 5 o o o 1 3 o o o 2 5 + o o 3 4 o - o 4 5 o + o 