data_CoRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.62
_cell_length_b   11.62
_cell_length_c   11.62
_cell_angle_alpha   161.22
_cell_angle_beta   161.22
_cell_angle_gamma   26.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoRe2
_chemical_formula_sum   'Co4 Re8'
_cell_volume   162.41
_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
  Co  Co0  1  0.0  0.0  0.9  1.0
  Co  Co1  1  0.0  0.0  0.71  1.0
  Co  Co2  1  0.0  0.9  0.55  1.0
  Co  Co3  1  0.0  0.9  0.75  1.0
  Re  Re4  1  0.0  0.0  0.62  1.0
  Re  Re5  1  0.0  0.0  0.99  1.0
  Re  Re6  1  0.0  0.9  0.27  1.0
  Re  Re7  1  0.0  0.9  0.03  1.0
  Re  Re8  1  0.0  0.0  0.36  1.0
  Re  Re9  1  0.0  0.0  0.24  1.0
  Re  Re10  1  0.9  0.0  0.71  1.0
  Re  Re11  1  0.9  0.0  0.59  1.0

data_CoRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.79
_cell_length_b   3.79
_cell_length_c   11.62
_cell_angle_alpha   99.39
_cell_angle_beta   99.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoRe2
_chemical_formula_sum   'Co4 Re8'
_cell_volume   162.41
_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
  Co  Co0  1  0.66  0.55  0.66  1.0
  Co  Co1  1  0.71  0.71  0.71  1.0
  Co  Co2  1  0.85  0.75  0.85  1.0
  Co  Co3  1  0.9  0.9  0.9  1.0
  Re  Re4  1  0.14  0.03  0.14  1.0
  Re  Re5  1  0.24  0.24  0.24  1.0
  Re  Re6  1  0.36  0.36  0.36  1.0
  Re  Re7  1  0.38  0.27  0.38  1.0
  Re  Re8  1  0.59  0.7  0.7  1.0
  Re  Re9  1  0.62  0.62  0.62  1.0
  Re  Re10  1  0.71  0.82  0.82  1.0
  Re  Re11  1  0.99  0.99  0.99  1.0

Co Co Co Co Re Re Re Re Re Re Re Re