data_ZnCoRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.7
_cell_length_b   5.7
_cell_length_c   5.7
_cell_angle_alpha   152.45
_cell_angle_beta   152.45
_cell_angle_gamma   39.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCoRe
_chemical_formula_sum   'Zn1 Co1 Re1'
_cell_volume   39.54
_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
  Zn  Zn2  1  0.0  0.0  0.07  1.0
  Co  Co0  1  0.0  0.0  0.68  1.0
  Re  Re1  1  0.0  0.0  0.72  1.0

data_ZnCoRe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.84
_cell_length_b   3.84
_cell_length_c   5.7
_cell_angle_alpha   90.0
_cell_angle_beta   109.68
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZnCoRe
_chemical_formula_sum   'Zn2 Co2 Re2'
_cell_volume   79.09
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zn  Zn0  2  0.07  0.0  0.07  1.0
  Co  Co1  2  0.18  0.5  0.68  1.0
  Re  Re2  2  0.22  0.5  0.72  1.0

Zn Co Re