data_[K2In2H6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2319]
_cell_length_b [5.5526]
_cell_length_c [7.2812]
_cell_angle_alpha [106.6034]
_cell_angle_beta [107.7231]
_cell_angle_gamma [90.9056]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [KInH3]
_chemical_formula_sum '[K2 In2 H6]'
_cell_volume [191.8539]
_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
[
  K  K0  1  0.5819  0.2633  0.2060  1
  K  K1  1  0.8417  0.8985  0.6914  1
  In  In2  1  0.0700  0.7813  0.2290  1
  In  In3  1  0.3246  0.3440  0.6717  1
  H  H4  1  0.0407  0.0264  0.0858  1
  H  H5  1  0.0451  0.1367  0.4637  1
  H  H6  1  0.1929  0.5864  0.8215  1
  H  H7  1  0.4429  0.1255  0.8104  1
  H  H8  1  0.4526  0.8680  0.3357  1
  H  H9  1  0.5842  0.4482  0.5959  1
]