The structure described by MgCd2Te2(MoO6)2 crystallizes in the orthorhombic Cmm2 space group. Mg(1) is bonded to two equivalent O(4), two equivalent O(5), and two equivalent O(6) atoms to form MgO6 octahedra that share corners with four equivalent Te(2)O6 octahedra and  an edgeedge with one Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-43°. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms. In the second Mo site, Mo(2) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(4) atoms. Cd(1) is bonded in a 4-coordinate geometry to two equivalent O(3), two equivalent O(5), and two equivalent O(6) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms to form distorted TeO6 octahedra that share  an edgeedge with one Mg(1)O6 octahedra. In the second Te site, Te(2) is bonded to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms to form distorted TeO6 octahedra that share corners with four equivalent Mg(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-43°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Mo(1), one Mo(2), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Mo(1), one Mo(2), and one Te(2) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Mo(1), two equivalent Cd(1), and one Te(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Mg(1), one Mo(2), and one Te(2) atom. In the fifth O site, O(5) is bonded to one Mg(1), two equivalent Cd(1), and one Te(1) atom to form a mixture of distorted edge and corner-sharing OMgCd2Te trigonal pyramids. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Mg(1), two equivalent Cd(1), and one Te(2) atom. is represented by the CIF file [CIF]
data_MgCd2Te2(MoO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.212
_cell_length_b   5.212
_cell_length_c   9.409
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   89.712
_symmetry_Int_Tables_number   1
_cell_volume   255.602
_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  0.000  0.500  0.597  1.0
  Cd  Cd1  1  0.000  0.000  0.465  1.0
  Cd  Cd2  1  0.500  0.500  0.465  1.0
  Te  Te3  1  0.000  0.500  0.227  1.0
  Te  Te4  1  0.500  0.000  0.749  1.0
  Mo  Mo5  1  0.500  0.000  0.117  1.0
  Mo  Mo6  1  0.000  0.500  0.900  1.0
  O  O7  1  0.256  0.244  0.063  1.0
  O  O8  1  0.243  0.743  0.950  1.0
  O  O9  1  0.744  0.756  0.063  1.0
  O  O10  1  0.757  0.257  0.950  1.0
  O  O11  1  0.294  0.794  0.257  1.0
  O  O12  1  0.195  0.305  0.745  1.0
  O  O13  1  0.706  0.206  0.257  1.0
  O  O14  1  0.805  0.695  0.745  1.0
  O  O15  1  0.165  0.335  0.395  1.0
  O  O16  1  0.306  0.806  0.605  1.0
  O  O17  1  0.835  0.665  0.395  1.0
  O  O18  1  0.694  0.194  0.605  1.0
[/CIF]
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The structure described by MgCd2Te2(MoO6)2 crystallizes in the orthorhombic Cmm2 space group. Mg(1) is bonded to two equivalent O(4), two equivalent O(5), and two equivalent O(6) atoms to form MgO6 octahedra that share corners with four equivalent Te(2)O6 octahedra and  an edgeedge with one Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-43°. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms. In the second Mo site, Mo(2) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(4) atoms. Cd(1) is bonded in a 4-coordinate geometry to two equivalent O(3), two equivalent O(5), and two equivalent O(6) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms to form distorted TeO6 octahedra that share  an edgeedge with one Mg(1)O6 octahedra. In the second Te site, Te(2) is bonded to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms to form distorted TeO6 octahedra that share corners with four equivalent Mg(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-43°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Mo(1), one Mo(2), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Mo(1), one Mo(2), and one Te(2) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Mo(1), two equivalent Cd(1), and one Te(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Mg(1), one Mo(2), and one Te(2) atom. In the fifth O site, O(5) is bonded to one Mg(1), two equivalent Cd(1), and one Te(1) atom to form a mixture of distorted edge and corner-sharing OMgCd2Te trigonal pyramids. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Mg(1), two equivalent Cd(1), and one Te(2) atom. is represented by the CIF file [CIF]
data_MgCd2Te2(MoO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.212
_cell_length_b   5.212
_cell_length_c   9.409
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   89.712
_symmetry_Int_Tables_number   1
_cell_volume   255.602
_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  0.000  0.500  0.597  1.0
  Cd  Cd1  1  0.000  0.000  0.465  1.0
  Cd  Cd2  1  0.500  0.500  0.465  1.0
  Te  Te3  1  0.000  0.500  0.227  1.0
  Te  Te4  1  0.500  0.000  0.749  1.0
  Mo  Mo5  1  0.500  0.000  0.117  1.0
  Mo  Mo6  1  0.000  0.500  0.900  1.0
  O  O7  1  0.256  0.244  0.063  1.0
  O  O8  1  0.243  0.743  0.950  1.0
  O  O9  1  0.744  0.756  0.063  1.0
  O  O10  1  0.757  0.257  0.950  1.0
  O  O11  1  0.294  0.794  0.257  1.0
  O  O12  1  0.195  0.305  0.745  1.0
  O  O13  1  0.706  0.206  0.257  1.0
  O  O14  1  0.805  0.695  0.745  1.0
  O  O15  1  0.165  0.335  0.395  1.0
  O  O16  1  0.306  0.806  0.605  1.0
  O  O17  1  0.835  0.665  0.395  1.0
  O  O18  1  0.694  0.194  0.605  1.0
[/CIF]
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