data_LaInOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaInOs2
_chemical_formula_sum   'La1 In1 Os2'
_cell_volume   80.92
_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
  La  La1  1  0.15  0.15  0.15  1.0
  In  In0  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.43  0.43  0.43  1.0
  Os  Os3  1  0.72  0.72  0.72  1.0

data_LaInOs2
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   11.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   LaInOs2
_chemical_formula_sum   'La3 In3 Os6'
_cell_volume   242.75
_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
  La  La0  3  0.0  0.0  0.85  1.0
  In  In1  3  0.0  0.0  0.0  1.0
  Os  Os2  3  0.0  0.0  0.28  1.0
  Os  Os3  3  0.0  0.0  0.57  1.0

La In Os Os
LaOs2In crystallizes in the trigonal R3m space group. La(1) is bonded in a distorted single-bond geometry to four equivalent Os(1), six equivalent Os(2), and one In(1) atom. There are three shorter (2.86 Å) and one longer (3.37 Å) La(1)-Os(1) bond length. There are three shorter (3.04 Å) and three longer (3.95 Å) La(1)-Os(2) bond lengths. The La(1)-In(1) bond length is 1.78 Å. There are two inequivalent Os sites. In the first Os site, Os(1) is bonded in a 11-coordinate geometry to four equivalent La(1), four equivalent Os(2), and three equivalent In(1) atoms. There are three shorter (2.86 Å) and one longer (3.37 Å) Os(1)-Os(2) bond length. All Os(1)-In(1) bond lengths are 3.04 Å. In the second Os site, Os(2) is bonded in a 14-coordinate geometry to six equivalent La(1), four equivalent Os(1), and four equivalent In(1) atoms. There are three shorter (2.86 Å) and one longer (3.37 Å) Os(2)-In(1) bond length. In(1) is bonded in a single-bond geometry to one La(1), three equivalent Os(1), and four equivalent Os(2) atoms.