data_LaYMnCd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15
_cell_length_b   5.15
_cell_length_c   5.15
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaYMnCd
_chemical_formula_sum   'La1 Y1 Mn1 Cd1'
_cell_volume   96.51
_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  0.82  0.82  0.82  1.0
  Y  Y3  1  0.46  0.46  0.46  1.0
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Cd  Cd0  1  0.64  0.64  0.64  1.0

data_LaYMnCd
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.15
_cell_length_b   5.15
_cell_length_c   12.61
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   LaYMnCd
_chemical_formula_sum   'La3 Y3 Mn3 Cd3'
_cell_volume   289.52
_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  0.18  1.0
  Y  Y1  3  0.0  0.0  0.54  1.0
  Mn  Mn2  3  0.0  0.0  0.0  1.0
  Cd  Cd3  3  0.0  0.0  0.36  1.0

La Y Mn Cd
La Y Mn Cd 0 3 o o o 0 2 + + + 1 3 o o o 
LaYMnCd is Copper structured and crystallizes in the trigonal R3m space group. The structure is zero-dimensional and consists of three LaYMnCd clusters. La(1) is bonded in a distorted linear geometry to one Mn(1) and one Cd(1) atom. The La(1)-Mn(1) bond length is 2.27 Å. The La(1)-Cd(1) bond length is 2.27 Å. Y(1) is bonded in a distorted single-bond geometry to one Cd(1) atom. The Y(1)-Cd(1) bond length is 2.27 Å. Mn(1) is bonded in a distorted single-bond geometry to one La(1) atom. Cd(1) is bonded in a distorted linear geometry to one La(1) and one Y(1) atom.