data_ZrCrRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24
_cell_length_b   5.24
_cell_length_c   5.24
_cell_angle_alpha   145.46
_cell_angle_beta   129.1
_cell_angle_gamma   62.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCrRe2
_chemical_formula_sum   'Zr1 Cr1 Re2'
_cell_volume   62.76
_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
  Zr  Zr3  1  0.0  0.0  0.47  1.0
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.25  0.34  1.0
  Re  Re2  1  0.56  0.0  0.13  1.0

data_ZrCrRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   4.51
_cell_length_c   5.24
_cell_angle_alpha   115.45
_cell_angle_beta   107.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCrRe2
_chemical_formula_sum   'Zr1 Cr1 Re2'
_cell_volume   62.76
_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
  Zr  Zr0  1  0.0  0.47  0.47  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.0  0.13  0.57  1.0
  Re  Re3  1  0.75  0.09  0.09  1.0

Zr Cr Re Re
Zr Cr Re Re 0 2 o o o 0 3 - o o 1 2 o o o 