data_ZnCr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.3
_cell_length_b   7.3
_cell_length_c   2.4
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCr2
_chemical_formula_sum   'Zn3 Cr6'
_cell_volume   111.1
_cell_formula_units_Z   3
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  Zn6  1  0.0  0.0  0.0  1.0
  Zn  Zn7  1  0.0  0.22  0.2  1.0
  Zn  Zn8  1  0.65  0.11  0.2  1.0
  Cr  Cr0  1  0.84  0.0  0.2  1.0
  Cr  Cr1  1  0.62  0.12  0.0  1.0
  Cr  Cr2  1  0.31  0.0  0.2  1.0
  Cr  Cr3  1  0.5  0.32  0.2  1.0
  Cr  Cr4  1  0.76  0.0  0.0  1.0
  Cr  Cr5  1  0.27  0.21  0.0  1.0

data_ZnCr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.4
_cell_length_b   7.3
_cell_length_c   7.3
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCr2
_chemical_formula_sum   'Zn3 Cr6'
_cell_volume   111.1
_cell_formula_units_Z   3
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  0.0  0.0  0.0  1.0
  Zn  Zn1  1  0.2  0.0  0.22  1.0
  Zn  Zn2  1  0.2  0.65  0.11  1.0
  Cr  Cr3  1  0.0  0.27  0.21  1.0
  Cr  Cr4  1  0.0  0.62  0.12  1.0
  Cr  Cr5  1  0.0  0.76  0.0  1.0
  Cr  Cr6  1  0.2  0.31  0.0  1.0
  Cr  Cr7  1  0.2  0.5  0.32  1.0
  Cr  Cr8  1  0.2  0.84  0.0  1.0

Zn Zn Zn Cr Cr Cr Cr Cr Cr