data_LaYNbMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaYNbMo
_chemical_formula_sum   'La1 Y1 Nb1 Mo1'
_cell_volume   90.63
_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  La0  1  0.35  0.35  0.35  1.0
  Y  Y3  1  0.0  0.0  0.0  1.0
  Nb  Nb2  1  0.78  0.78  0.78  1.0
  Mo  Mo1  1  0.57  0.57  0.57  1.0

data_LaYNbMo
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   12.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   LaYNbMo
_chemical_formula_sum   'La3 Y3 Nb3 Mo3'
_cell_volume   271.89
_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  0.65  1.0
  Y  Y1  3  0.0  0.0  0.0  1.0
  Nb  Nb2  3  0.0  0.0  0.22  1.0
  Mo  Mo3  3  0.0  0.0  0.43  1.0

La Y Nb Mo
LaYNbMo crystallizes in the trigonal R3m space group. La(1) is bonded in a distorted single-bond geometry to three equivalent Y(1), three equivalent Nb(1), and four equivalent Mo(1) atoms. All La(1)-Y(1) bond lengths are 2.92 Å. All La(1)-Nb(1) bond lengths are 3.17 Å. There is one shorter (2.69 Å) and three longer (3.24 Å) La(1)-Mo(1) bond lengths. Y(1) is bonded in a 10-coordinate geometry to three equivalent La(1), four equivalent Nb(1), and three equivalent Mo(1) atoms. There is one shorter (2.69 Å) and three longer (3.24 Å) Y(1)-Nb(1) bond lengths. All Y(1)-Mo(1) bond lengths are 3.17 Å. Nb(1) is bonded in a 11-coordinate geometry to three equivalent La(1), four equivalent Y(1), and four equivalent Mo(1) atoms. There is one shorter (2.69 Å) and three longer (3.24 Å) Nb(1)-Mo(1) bond lengths. Mo(1) is bonded in a 11-coordinate geometry to four equivalent La(1), three equivalent Y(1), and four equivalent Nb(1) atoms.