The compound described by MgCd2Te2(MoO6)2 crystallizes in the tetragonal P-4 space group. Mg(1) is bonded to four equivalent O(1) atoms to form MgO4 tetrahedra that share corners with four equivalent Mo(1)O4 tetrahedra. Mo(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form distorted MoO4 tetrahedra that share corners with two equivalent Mg(1)O4 tetrahedra. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 8-coordinate geometry to four equivalent O(2) and four equivalent O(3) atoms. In the second Cd site, Cd(2) is bonded in a tetrahedral geometry to four equivalent O(3) atoms. Te(1) is bonded in a distorted see-saw-like geometry to two equivalent O(2) and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Mg(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Mo(1), one Cd(1), and one Te(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Cd(1), one Cd(2), and one Te(1) atom. is represented by the CIF card [CIF]
data_MgCd2Te2(MoO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.343
_cell_length_b   5.343
_cell_length_c   10.393
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   296.679
_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
  Mg  Mg0  1  0.500  0.500  0.000  1.0
  Cd  Cd1  1  0.000  0.000  0.500  1.0
  Cd  Cd2  1  0.500  0.500  0.500  1.0
  Te  Te3  1  0.000  0.500  0.270  1.0
  Te  Te4  1  0.500  0.000  0.730  1.0
  Mo  Mo5  1  0.500  0.000  0.219  1.0
  Mo  Mo6  1  0.000  0.500  0.781  1.0
  O  O7  1  0.359  0.236  0.111  1.0
  O  O8  1  0.236  0.641  0.889  1.0
  O  O9  1  0.641  0.764  0.111  1.0
  O  O10  1  0.764  0.359  0.889  1.0
  O  O11  1  0.265  0.787  0.306  1.0
  O  O12  1  0.213  0.265  0.694  1.0
  O  O13  1  0.735  0.213  0.306  1.0
  O  O14  1  0.787  0.735  0.694  1.0
  O  O15  1  0.199  0.307  0.387  1.0
  O  O16  1  0.307  0.801  0.613  1.0
  O  O17  1  0.801  0.693  0.387  1.0
  O  O18  1  0.693  0.199  0.613  1.0
[/CIF]
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The compound described by MgCd2Te2(MoO6)2 crystallizes in the tetragonal P-4 space group. Mg(1) is bonded to four equivalent O(1) atoms to form MgO4 tetrahedra that share corners with four equivalent Mo(1)O4 tetrahedra. Mo(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form distorted MoO4 tetrahedra that share corners with two equivalent Mg(1)O4 tetrahedra. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 8-coordinate geometry to four equivalent O(2) and four equivalent O(3) atoms. In the second Cd site, Cd(2) is bonded in a tetrahedral geometry to four equivalent O(3) atoms. Te(1) is bonded in a distorted see-saw-like geometry to two equivalent O(2) and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Mg(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Mo(1), one Cd(1), and one Te(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Cd(1), one Cd(2), and one Te(1) atom. is represented by the CIF card [CIF]
data_MgCd2Te2(MoO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.343
_cell_length_b   5.343
_cell_length_c   10.393
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   296.679
_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
  Mg  Mg0  1  0.500  0.500  0.000  1.0
  Cd  Cd1  1  0.000  0.000  0.500  1.0
  Cd  Cd2  1  0.500  0.500  0.500  1.0
  Te  Te3  1  0.000  0.500  0.270  1.0
  Te  Te4  1  0.500  0.000  0.730  1.0
  Mo  Mo5  1  0.500  0.000  0.219  1.0
  Mo  Mo6  1  0.000  0.500  0.781  1.0
  O  O7  1  0.359  0.236  0.111  1.0
  O  O8  1  0.236  0.641  0.889  1.0
  O  O9  1  0.641  0.764  0.111  1.0
  O  O10  1  0.764  0.359  0.889  1.0
  O  O11  1  0.265  0.787  0.306  1.0
  O  O12  1  0.213  0.265  0.694  1.0
  O  O13  1  0.735  0.213  0.306  1.0
  O  O14  1  0.787  0.735  0.694  1.0
  O  O15  1  0.199  0.307  0.387  1.0
  O  O16  1  0.307  0.801  0.613  1.0
  O  O17  1  0.801  0.693  0.387  1.0
  O  O18  1  0.693  0.199  0.613  1.0
[/CIF]
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