The compound described by Mg6WMo crystallizes in the orthorhombic Amm2 space group. There are four inequivalent Mg sites. In the first Mg site, Mg(1) is bonded in a 12-coordinate geometry to two equivalent Mg(1), two equivalent Mg(2), two equivalent Mg(3), two equivalent Mg(4), two equivalent W(1), and two equivalent Mo(1) atoms. In the second Mg site, Mg(2) is bonded in a distorted linear geometry to four equivalent Mg(1), four equivalent Mg(3), and two equivalent Mo(1) atoms. In the third Mg site, Mg(3) is bonded in a 12-coordinate geometry to two equivalent Mg(1), two equivalent Mg(2), two equivalent Mg(3), two equivalent Mg(4), two equivalent W(1), and two equivalent Mo(1) atoms. In the fourth Mg site, Mg(4) is bonded in a distorted linear geometry to four equivalent Mg(1), four equivalent Mg(3), and two equivalent W(1) atoms. W(1) is bonded to two equivalent Mg(4), four equivalent Mg(1), four equivalent Mg(3), and two equivalent Mo(1) atoms to form WMg10Mo2 cuboctahedra that share corners with six equivalent W(1)Mg10Mo2 cuboctahedra, edges with four equivalent Mo(1)Mg10W2 cuboctahedra, faces with two equivalent W(1)Mg10Mo2 cuboctahedra, and faces with two equivalent Mo(1)Mg10W2 cuboctahedra. Mo(1) is bonded to two equivalent Mg(2), four equivalent Mg(1), four equivalent Mg(3), and two equivalent W(1) atoms to form MoMg10W2 cuboctahedra that share corners with six equivalent Mo(1)Mg10W2 cuboctahedra, edges with four equivalent W(1)Mg10Mo2 cuboctahedra, faces with two equivalent W(1)Mg10Mo2 cuboctahedra, and faces with two equivalent Mo(1)Mg10W2 cuboctahedra. is represented by the CIF card [CIF]
data_Mg6MoW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.743
_cell_length_b   5.956
_cell_length_c   6.202
_cell_angle_alpha   118.699
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   153.665
_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  1.000  0.817  0.153  1.0
  Mg  Mg1  1  1.000  0.336  0.153  1.0
  Mg  Mg2  1  0.000  0.330  0.661  1.0
  Mg  Mg3  1  0.500  0.683  0.849  1.0
  Mg  Mg4  1  0.500  0.166  0.849  1.0
  Mg  Mg5  1  0.500  0.169  0.339  1.0
  Mo  Mo6  1  0.000  0.810  0.619  1.0
  W  W7  1  0.500  0.689  0.378  1.0
[/CIF]
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The compound described by Mg6WMo crystallizes in the orthorhombic Amm2 space group. There are four inequivalent Mg sites. In the first Mg site, Mg(1) is bonded in a 12-coordinate geometry to two equivalent Mg(1), two equivalent Mg(2), two equivalent Mg(3), two equivalent Mg(4), two equivalent W(1), and two equivalent Mo(1) atoms. In the second Mg site, Mg(2) is bonded in a distorted linear geometry to four equivalent Mg(1), four equivalent Mg(3), and two equivalent Mo(1) atoms. In the third Mg site, Mg(3) is bonded in a 12-coordinate geometry to two equivalent Mg(1), two equivalent Mg(2), two equivalent Mg(3), two equivalent Mg(4), two equivalent W(1), and two equivalent Mo(1) atoms. In the fourth Mg site, Mg(4) is bonded in a distorted linear geometry to four equivalent Mg(1), four equivalent Mg(3), and two equivalent W(1) atoms. W(1) is bonded to two equivalent Mg(4), four equivalent Mg(1), four equivalent Mg(3), and two equivalent Mo(1) atoms to form WMg10Mo2 cuboctahedra that share corners with six equivalent W(1)Mg10Mo2 cuboctahedra, edges with four equivalent Mo(1)Mg10W2 cuboctahedra, faces with two equivalent W(1)Mg10Mo2 cuboctahedra, and faces with two equivalent Mo(1)Mg10W2 cuboctahedra. Mo(1) is bonded to two equivalent Mg(2), four equivalent Mg(1), four equivalent Mg(3), and two equivalent W(1) atoms to form MoMg10W2 cuboctahedra that share corners with six equivalent Mo(1)Mg10W2 cuboctahedra, edges with four equivalent W(1)Mg10Mo2 cuboctahedra, faces with two equivalent W(1)Mg10Mo2 cuboctahedra, and faces with two equivalent Mo(1)Mg10W2 cuboctahedra. is represented by the CIF card [CIF]
data_Mg6MoW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.743
_cell_length_b   5.956
_cell_length_c   6.202
_cell_angle_alpha   118.699
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   153.665
_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  1.000  0.817  0.153  1.0
  Mg  Mg1  1  1.000  0.336  0.153  1.0
  Mg  Mg2  1  0.000  0.330  0.661  1.0
  Mg  Mg3  1  0.500  0.683  0.849  1.0
  Mg  Mg4  1  0.500  0.166  0.849  1.0
  Mg  Mg5  1  0.500  0.169  0.339  1.0
  Mo  Mo6  1  0.000  0.810  0.619  1.0
  W  W7  1  0.500  0.689  0.378  1.0
[/CIF]
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