The material structure described by Cs2MnSnTe4 crystallizes in the orthorhombic Fddd space group. Cs(1) is bonded in a 8-coordinate geometry to eight equivalent Te(1) atoms. Mn(1) is bonded to four equivalent Te(1) atoms to form MnTe4 tetrahedra that share edges with two equivalent Sn(1)Te4 tetrahedra. Sn(1) is bonded to four equivalent Te(1) atoms to form distorted SnTe4 tetrahedra that share edges with two equivalent Mn(1)Te4 tetrahedra. Te(1) is bonded in a 6-coordinate geometry to four equivalent Cs(1), one Mn(1), and one Sn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2MnSnTe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.299
_cell_length_b   13.569
_cell_length_c   8.552
_cell_angle_alpha   84.267
_cell_angle_beta   61.939
_cell_angle_gamma   33.794
_symmetry_Int_Tables_number   1
_cell_volume   701.659
_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
  Cs  Cs0  1  0.816  0.816  0.184  1.0
  Cs  Cs1  1  0.184  0.184  0.816  1.0
  Cs  Cs2  1  0.434  0.434  0.066  1.0
  Cs  Cs3  1  0.066  0.066  0.434  1.0
  Mn  Mn4  1  0.750  0.750  0.750  1.0
  Mn  Mn5  1  0.500  0.500  0.500  1.0
  Sn  Sn6  1  0.250  0.250  0.250  1.0
  Sn  Sn7  1  0.000  0.000  0.000  1.0
  Te  Te8  1  0.410  0.710  0.785  1.0
  Te  Te9  1  0.095  0.785  0.710  1.0
  Te  Te10  1  0.785  0.095  0.410  1.0
  Te  Te11  1  0.710  0.410  0.095  1.0
  Te  Te12  1  0.840  0.540  0.465  1.0
  Te  Te13  1  0.155  0.465  0.540  1.0
  Te  Te14  1  0.465  0.155  0.840  1.0
  Te  Te15  1  0.540  0.840  0.155  1.0
[/CIF]
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The material structure described by Cs2MnSnTe4 crystallizes in the orthorhombic Fddd space group. Cs(1) is bonded in a 8-coordinate geometry to eight equivalent Te(1) atoms. Mn(1) is bonded to four equivalent Te(1) atoms to form MnTe4 tetrahedra that share edges with two equivalent Sn(1)Te4 tetrahedra. Sn(1) is bonded to four equivalent Te(1) atoms to form distorted SnTe4 tetrahedra that share edges with two equivalent Mn(1)Te4 tetrahedra. Te(1) is bonded in a 6-coordinate geometry to four equivalent Cs(1), one Mn(1), and one Sn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2MnSnTe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.299
_cell_length_b   13.569
_cell_length_c   8.552
_cell_angle_alpha   84.267
_cell_angle_beta   61.939
_cell_angle_gamma   33.794
_symmetry_Int_Tables_number   1
_cell_volume   701.659
_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
  Cs  Cs0  1  0.816  0.816  0.184  1.0
  Cs  Cs1  1  0.184  0.184  0.816  1.0
  Cs  Cs2  1  0.434  0.434  0.066  1.0
  Cs  Cs3  1  0.066  0.066  0.434  1.0
  Mn  Mn4  1  0.750  0.750  0.750  1.0
  Mn  Mn5  1  0.500  0.500  0.500  1.0
  Sn  Sn6  1  0.250  0.250  0.250  1.0
  Sn  Sn7  1  0.000  0.000  0.000  1.0
  Te  Te8  1  0.410  0.710  0.785  1.0
  Te  Te9  1  0.095  0.785  0.710  1.0
  Te  Te10  1  0.785  0.095  0.410  1.0
  Te  Te11  1  0.710  0.410  0.095  1.0
  Te  Te12  1  0.840  0.540  0.465  1.0
  Te  Te13  1  0.155  0.465  0.540  1.0
  Te  Te14  1  0.465  0.155  0.840  1.0
  Te  Te15  1  0.540  0.840  0.155  1.0
[/CIF]
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