data_KInRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.3
_cell_length_b   6.3
_cell_length_c   6.3
_cell_angle_alpha   154.62
_cell_angle_beta   131.65
_cell_angle_gamma   55.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KInRe2
_chemical_formula_sum   'K1 In1 Re2'
_cell_volume   79.66
_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
  K  K1  1  0.0  0.0  0.0  1.0
  In  In0  1  0.0  0.0  0.58  1.0
  Re  Re2  1  0.38  0.0  0.14  1.0
  Re  Re3  1  0.0  0.58  0.44  1.0

data_KInRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   5.16
_cell_length_c   6.3
_cell_angle_alpha   114.17
_cell_angle_beta   102.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KInRe2
_chemical_formula_sum   'K1 In1 Re2'
_cell_volume   79.66
_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
  K  K0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.42  0.42  0.42  1.0
  Re  Re2  1  0.25  0.86  0.25  1.0
  Re  Re3  1  0.56  0.14  0.14  1.0

K In Re Re
K In Re Re 0 3 o o o 0 3 o - - 0 2 o o o 1 3 o - o 2 3 o - - 