data_Er16In4Ir4O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.55
_cell_length_b   9.55
_cell_length_c   9.55
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er16In4Ir4O
_chemical_formula_sum   'Er16 In4 Ir4 O1'
_cell_volume   616.07
_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
  Er  Er0  1  0.41  0.09  0.41  1.0
  Er  Er1  1  0.09  0.09  0.09  1.0
  Er  Er2  1  0.09  0.41  0.41  1.0
  Er  Er3  1  0.41  0.41  0.09  1.0
  Er  Er4  1  0.49  0.75  0.75  1.0
  Er  Er5  1  0.02  0.75  0.75  1.0
  Er  Er6  1  0.75  0.75  0.49  1.0
  Er  Er7  1  0.75  0.75  0.02  1.0
  Er  Er8  1  0.75  0.02  0.75  1.0
  Er  Er9  1  0.75  0.49  0.75  1.0
  Er  Er10  1  0.79  0.38  0.38  1.0
  Er  Er11  1  0.96  0.38  0.38  1.0
  Er  Er12  1  0.38  0.38  0.79  1.0
  Er  Er13  1  0.38  0.38  0.96  1.0
  Er  Er14  1  0.38  0.96  0.38  1.0
  Er  Er15  1  0.38  0.79  0.38  1.0
  In  In16  1  0.0  0.26  0.0  1.0
  In  In17  1  0.26  0.26  0.26  1.0
  In  In18  1  0.26  0.0  0.0  1.0
  In  In19  1  0.0  0.0  0.26  1.0
  Ir  Ir20  1  0.22  0.28  0.22  1.0
  Ir  Ir21  1  0.28  0.28  0.28  1.0
  Ir  Ir22  1  0.28  0.22  0.22  1.0
  Ir  Ir23  1  0.22  0.22  0.28  1.0
  O  O24  1  0.0  0.0  0.0  1.0

data_Er16In4Ir4O
_symmetry_space_group_name_H-M   R3m
_cell_length_a   9.55
_cell_length_b   9.55
_cell_length_c   23.4
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Er16In4Ir4O
_chemical_formula_sum   'Er48 In12 Ir12 O3'
_cell_volume   1848.2
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  Er  Er0  9  0.06  0.53  0.15  1.0
  Er  Er1  9  0.09  0.18  0.16  1.0
  Er  Er2  9  0.18  0.09  0.33  1.0
  Er  Er3  9  0.19  0.39  0.43  1.0
  Er  Er4  9  0.21  0.11  0.69  1.0
  Er  Er5  3  0.0  0.0  0.91  1.0
  In  In6  9  0.09  0.17  0.91  1.0
  In  In7  3  0.0  0.0  0.74  1.0
  Ir  Ir8  9  0.02  0.04  0.76  1.0
  Ir  Ir9  3  0.0  0.0  0.72  1.0
  O  O10  3  0.0  0.0  0.0  1.0

Er Er Er Er Er Er Er Er Er Er Er Er Er Er Er Er In In In In Ir Ir Ir Ir O
Er Er Er Er Er Er Er Er Er Er Er Er Er Er Er Er In In In In Ir Ir Ir Ir O 0 14 o - o 0 21 o o o 0 17 o o o 1 19 o o o 1 16 o o o 1 18 o o o 1 24 o o o 2 11 - o o 2 21 o o o 2 17 o o o 3 13 o o - 3 21 o o o 3 17 o o o 4 9 o o o 4 6 o o o 5 8 - + o 5 7 - o + 6 9 o o o 7 8 o + - 10 11 o o o 12 13 o o o 14 15 o o o 16 24 o o o 17 23 o o o 17 20 o o o 17 22 o o o 17 21 o o o 18 24 o o o 19 24 o o o 20 23 o o o 20 22 o o o 22 23 o o o 