data_Zn2CrCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55
_cell_length_b   4.55
_cell_length_c   2.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2CrCo
_chemical_formula_sum   'Zn2 Cr1 Co1'
_cell_volume   51.42
_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  0.31  0.86  0.32  1.0
  Zn  Zn3  1  0.31  0.14  0.32  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.63  0.0  0.0  1.0

data_Zn2CrCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.63
_cell_length_b   4.55
_cell_length_c   4.55
_cell_angle_alpha   109.55
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2CrCo
_chemical_formula_sum   'Zn2 Cr1 Co1'
_cell_volume   51.42
_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  Zn0  1  0.32  0.31  0.14  1.0
  Zn  Zn1  1  0.32  0.31  0.86  1.0
  Cr  Cr2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  -0.0  0.63  0.0  1.0

Zn Zn Cr Co
Zn Zn Cr Co 0 1 o + o 0 2 o + o 0 3 o + o 1 2 o o o 1 3 o o o 2 3 - o o 