data_Cr4In5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.32
_cell_length_b   8.32
_cell_length_c   5.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr4In5
_chemical_formula_sum   'Cr8 In10'
_cell_volume   354.86
_cell_formula_units_Z   2
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
  Cr  Cr0  1  0.0  0.0  0.96  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Cr  Cr2  1  0.53  0.64  0.44  1.0
  Cr  Cr3  1  0.26  0.0  0.44  1.0
  Cr  Cr4  1  0.37  0.56  0.44  1.0
  Cr  Cr5  1  0.63  0.56  0.48  1.0
  Cr  Cr6  1  0.05  0.0  0.48  1.0
  Cr  Cr7  1  0.47  0.64  0.48  1.0
  In  In8  1  0.93  0.08  0.44  1.0
  In  In9  1  0.45  0.0  0.44  1.0
  In  In10  1  0.77  0.13  0.44  1.0
  In  In11  1  0.23  0.13  0.48  1.0
  In  In12  1  0.86  0.0  0.48  1.0
  In  In13  1  0.07  0.08  0.48  1.0
  In  In14  1  0.0  0.8  0.96  1.0
  In  In15  1  0.16  0.4  0.0  1.0
  In  In16  1  0.16  0.4  0.96  1.0
  In  In17  1  0.0  0.8  0.0  1.0

data_Cr4In5
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.93
_cell_length_b   8.32
_cell_length_c   8.32
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr4In5
_chemical_formula_sum   'Cr8 In10'
_cell_volume   354.86
_cell_formula_units_Z   2
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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.44  0.26  0.0  1.0
  Cr  Cr2  1  0.44  0.37  0.56  1.0
  Cr  Cr3  1  0.44  0.53  0.64  1.0
  Cr  Cr4  1  0.48  0.05  0.0  1.0
  Cr  Cr5  1  0.48  0.47  0.64  1.0
  Cr  Cr6  1  0.48  0.63  0.56  1.0
  Cr  Cr7  1  0.96  0.0  0.0  1.0
  In  In8  1  -0.0  0.16  0.4  1.0
  In  In9  1  -0.0  0.0  0.8  1.0
  In  In10  1  0.44  0.45  0.0  1.0
  In  In11  1  0.44  0.77  0.13  1.0
  In  In12  1  0.44  0.93  0.08  1.0
  In  In13  1  0.48  0.07  0.08  1.0
  In  In14  1  0.48  0.23  0.13  1.0
  In  In15  1  0.48  0.86  0.0  1.0
  In  In16  1  0.96  0.0  0.8  1.0
  In  In17  1  0.96  0.16  0.4  1.0

Cr Cr Cr Cr Cr Cr Cr Cr In In In In In In In In In In