The material described by CeMnIn crystallizes in the orthorhombic Amm2 space group. Ce(1) is bonded to two equivalent Ce(1), six equivalent Mn(1), and six equivalent In(1) atoms to form a mixture of distorted edge, corner, and face-sharing CeCe2Mn6In6 cuboctahedra. Mn(1) is bonded in a 11-coordinate geometry to six equivalent Ce(1), two equivalent Mn(1), and three equivalent In(1) atoms. In(1) is bonded in a 11-coordinate geometry to six equivalent Ce(1), three equivalent Mn(1), and two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CeMnIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.335
_cell_length_b   4.923
_cell_length_c   4.920
_cell_angle_alpha   120.006
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   69.940
_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
  Ce  Ce0  1  0.000  1.000  0.001  1.0
  Mn  Mn1  1  0.500  0.334  0.666  1.0
  In  In2  1  0.500  0.666  0.333  1.0
[/CIF]
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The material described by CeMnIn crystallizes in the orthorhombic Amm2 space group. Ce(1) is bonded to two equivalent Ce(1), six equivalent Mn(1), and six equivalent In(1) atoms to form a mixture of distorted edge, corner, and face-sharing CeCe2Mn6In6 cuboctahedra. Mn(1) is bonded in a 11-coordinate geometry to six equivalent Ce(1), two equivalent Mn(1), and three equivalent In(1) atoms. In(1) is bonded in a 11-coordinate geometry to six equivalent Ce(1), three equivalent Mn(1), and two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CeMnIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.335
_cell_length_b   4.923
_cell_length_c   4.920
_cell_angle_alpha   120.006
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   69.940
_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
  Ce  Ce0  1  0.000  1.000  0.001  1.0
  Mn  Mn1  1  0.500  0.334  0.666  1.0
  In  In2  1  0.500  0.666  0.333  1.0
[/CIF]
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