data_InNi6Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41
_cell_length_b   6.41
_cell_length_c   10.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InNi6Au
_chemical_formula_sum   'In4 Ni24 Au4'
_cell_volume   407.15
_cell_formula_units_Z   4
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
  In  In4  1  0.7  0.37  0.0  1.0
  In  In5  1  0.7  0.63  0.0  1.0
  In  In6  1  0.0  0.0  0.87  1.0
  In  In7  1  0.0  0.0  0.63  1.0
  Ni  Ni8  1  0.7  0.39  0.87  1.0
  Ni  Ni9  1  0.86  0.69  0.19  1.0
  Ni  Ni10  1  0.53  0.31  0.19  1.0
  Ni  Ni11  1  0.7  0.61  0.87  1.0
  Ni  Ni12  1  0.53  0.69  0.19  1.0
  Ni  Ni13  1  0.86  0.31  0.19  1.0
  Ni  Ni14  1  0.0  0.0  0.25  1.0
  Ni  Ni15  1  0.53  0.32  0.56  1.0
  Ni  Ni16  1  0.53  0.68  0.56  1.0
  Ni  Ni17  1  0.7  0.39  0.64  1.0
  Ni  Ni18  1  0.86  0.68  0.95  1.0
  Ni  Ni19  1  0.53  0.32  0.95  1.0
  Ni  Ni20  1  0.7  0.61  0.64  1.0
  Ni  Ni21  1  0.53  0.68  0.95  1.0
  Ni  Ni22  1  0.86  0.32  0.95  1.0
  Ni  Ni23  1  0.0  0.0  0.0  1.0
  Ni  Ni24  1  0.53  0.31  0.32  1.0
  Ni  Ni25  1  0.53  0.69  0.32  1.0
  Ni  Ni26  1  0.7  0.0  0.25  1.0
  Ni  Ni27  1  0.86  0.32  0.56  1.0
  Ni  Ni28  1  0.86  0.68  0.56  1.0
  Ni  Ni29  1  0.7  0.0  0.0  1.0
  Ni  Ni30  1  0.86  0.31  0.32  1.0
  Ni  Ni31  1  0.86  0.69  0.32  1.0
  Au  Au0  1  0.7  0.36  0.25  1.0
  Au  Au1  1  0.7  0.64  0.25  1.0
  Au  Au2  1  0.7  0.0  0.87  1.0
  Au  Au3  1  0.7  0.0  0.63  1.0

data_InNi6Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.41
_cell_length_b   6.41
_cell_length_c   10.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InNi6Au
_chemical_formula_sum   'In4 Ni24 Au4'
_cell_volume   407.15
_cell_formula_units_Z   4
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
  In  In0  1  0.0  0.0  0.63  1.0
  In  In1  1  0.0  0.0  0.87  1.0
  In  In2  1  0.7  0.37  -0.0  1.0
  In  In3  1  0.7  0.63  -0.0  1.0
  Ni  Ni4  1  0.0  0.0  0.0  1.0
  Ni  Ni5  1  0.0  0.0  0.25  1.0
  Ni  Ni6  1  0.53  0.31  0.19  1.0
  Ni  Ni7  1  0.53  0.31  0.32  1.0
  Ni  Ni8  1  0.53  0.69  0.19  1.0
  Ni  Ni9  1  0.53  0.69  0.32  1.0
  Ni  Ni10  1  0.53  0.32  0.56  1.0
  Ni  Ni11  1  0.53  0.32  0.95  1.0
  Ni  Ni12  1  0.53  0.68  0.56  1.0
  Ni  Ni13  1  0.53  0.68  0.95  1.0
  Ni  Ni14  1  0.7  0.0  -0.0  1.0
  Ni  Ni15  1  0.7  0.0  0.25  1.0
  Ni  Ni16  1  0.7  0.39  0.64  1.0
  Ni  Ni17  1  0.7  0.39  0.87  1.0
  Ni  Ni18  1  0.7  0.61  0.64  1.0
  Ni  Ni19  1  0.7  0.61  0.87  1.0
  Ni  Ni20  1  0.86  0.32  0.56  1.0
  Ni  Ni21  1  0.86  0.32  0.95  1.0
  Ni  Ni22  1  0.86  0.68  0.56  1.0
  Ni  Ni23  1  0.86  0.68  0.95  1.0
  Ni  Ni24  1  0.86  0.31  0.19  1.0
  Ni  Ni25  1  0.86  0.31  0.32  1.0
  Ni  Ni26  1  0.86  0.69  0.19  1.0
  Ni  Ni27  1  0.86  0.69  0.32  1.0
  Au  Au28  1  0.7  0.0  0.63  1.0
  Au  Au29  1  0.7  0.0  0.87  1.0
  Au  Au30  1  0.7  0.36  0.25  1.0
  Au  Au31  1  0.7  0.64  0.25  1.0

In In In In Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Au Au Au Au
In In In In Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Ni Au Au Au Au 0 15 o o - 0 18 o o - 0 4 o o - 1 17 o o - 1 14 o o - 1 7 o o - 2 19 o o + 3 24 - - o 3 31 - o o 4 15 o o o 4 7 o o o 4 18 o o o 5 29 o o o 5 27 o o o 5 10 + + o 6 28 o o o 6 20 o o o 7 17 o o o 7 14 o o o 8 29 o o o 8 21 o o o 8 22 o + o 9 28 o o o 9 26 o o o 9 22 o o o 10 27 - - o 10 22 - o o 11 13 o o o 12 16 o o o 12 31 o + o 13 16 o o o 13 23 o o o 16 24 o o o 20 28 o o o 21 29 o o o 21 22 o + o 22 28 o o o 22 29 o - o 22 26 o o o 23 31 o o o 25 30 o o - 26 28 o o o 27 29 o o o 30 31 o o o 