data_ZnRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.72
_cell_length_b   4.72
_cell_length_c   4.72
_cell_angle_alpha   145.43
_cell_angle_beta   132.16
_cell_angle_gamma   60.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnRe2
_chemical_formula_sum   'Zn1 Re2'
_cell_volume   43.92
_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  0.0  1.0
  Re  Re0  1  0.0  0.0  0.68  1.0
  Re  Re1  1  0.0  0.0  0.49  1.0

data_ZnRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   3.83
_cell_length_c   4.72
_cell_angle_alpha   113.92
_cell_angle_beta   107.28
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnRe2
_chemical_formula_sum   'Zn1 Re2'
_cell_volume   43.92
_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  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.49  0.49  1.0
  Re  Re2  1  0.0  0.68  0.68  1.0

Zn Re Re
Zn Re Re 0 1 o o - 1 2 o o o 