data_KInNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.15
_cell_length_b   3.25
_cell_length_c   8.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KInNi2
_chemical_formula_sum   'K1 In1 Ni2'
_cell_volume   82.47
_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  0.31  1.0
  In  In0  1  0.57  0.63  0.39  1.0
  Ni  Ni2  1  0.57  0.63  0.81  1.0
  Ni  Ni3  1  0.0  0.0  0.57  1.0

data_KInNi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   3.25
_cell_length_c   8.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KInNi2
_chemical_formula_sum   'K1 In1 Ni2'
_cell_volume   82.47
_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  0.31  1.0
  In  In1  1  0.57  0.63  0.39  1.0
  Ni  Ni2  1  0.0  0.0  0.57  1.0
  Ni  Ni3  1  0.57  0.63  0.81  1.0

K In Ni Ni
K In Ni Ni 0 1 - - o 0 1 o - o 0 3 o o o 1 3 + + o 1 2 o o o 2 3 o o o 2 3 o + o 2 3 + o o 2 3 + + o 2 2 + o o 2 2 o + o 