data_CrCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   3.49
_cell_length_c   7.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCo2
_chemical_formula_sum   'Cr4 Co8'
_cell_volume   128.32
_cell_formula_units_Z   4
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  Cr8  1  0.68  0.87  0.78  1.0
  Cr  Cr9  1  0.79  0.62  0.07  1.0
  Cr  Cr10  1  0.16  0.87  0.36  1.0
  Cr  Cr11  1  0.26  0.62  0.64  1.0
  Co  Co0  1  0.61  0.87  0.83  1.0
  Co  Co1  1  0.63  0.87  0.33  1.0
  Co  Co2  1  0.84  0.62  0.62  1.0
  Co  Co3  1  0.86  0.62  0.54  1.0
  Co  Co4  1  0.09  0.87  0.88  1.0
  Co  Co5  1  0.11  0.87  0.8  1.0
  Co  Co6  1  0.31  0.62  0.09  1.0
  Co  Co7  1  0.33  0.62  0.6  1.0

data_CrCo2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.49
_cell_length_b   4.95
_cell_length_c   7.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   CrCo2
_chemical_formula_sum   'Cr4 Co8'
_cell_volume   128.32
_cell_formula_units_Z   4
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  2  0.13  0.18  0.64  1.0
  Cr  Cr1  2  0.13  0.71  0.07  1.0
  Co  Co2  2  0.13  0.11  0.17  1.0
  Co  Co3  2  0.13  0.13  0.09  1.0
  Co  Co4  2  0.13  0.64  0.12  1.0
  Co  Co5  2  0.13  0.66  0.62  1.0

Cr Cr Cr Cr Co Co Co Co Co Co Co Co