The material structure described by MgMnTe4 is Pyrite-derived structured and crystallizes in the monoclinic P2_1/c space group. Mg(1) is bonded to two equivalent Te(1) and four equivalent Te(2) atoms to form MgTe6 octahedra that share corners with four equivalent Mg(1)Te6 octahedra, corners with eight equivalent Mn(1)Te6 octahedra, corners with two equivalent Te(1)MgMn2Te tetrahedra, and corners with four equivalent Te(2)Mg2MnTe tetrahedra. The corner-sharing octahedral tilt angles range from 64-66°. Mn(1) is bonded to two equivalent Te(2) and four equivalent Te(1) atoms to form MnTe6 octahedra that share corners with four equivalent Mn(1)Te6 octahedra, corners with eight equivalent Mg(1)Te6 octahedra, corners with two equivalent Te(2)Mg2MnTe tetrahedra, and corners with four equivalent Te(1)MgMn2Te tetrahedra. The corner-sharing octahedral tilt angles range from 63-65°. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to one Mg(1), two equivalent Mn(1), and one Te(1) atom to form distorted TeMgMn2Te tetrahedra that share  a cornercorner with one Mg(1)Te6 octahedra, corners with two equivalent Mn(1)Te6 octahedra, corners with seven equivalent Te(1)MgMn2Te tetrahedra, and corners with eight equivalent Te(2)Mg2MnTe tetrahedra. The corner-sharing octahedral tilt angles range from 77-80°. In the second Te site, Te(2) is bonded to two equivalent Mg(1), one Mn(1), and one Te(2) atom to form distorted TeMg2MnTe tetrahedra that share  a cornercorner with one Mn(1)Te6 octahedra, corners with two equivalent Mg(1)Te6 octahedra, corners with seven equivalent Te(2)Mg2MnTe tetrahedra, and corners with eight equivalent Te(1)MgMn2Te tetrahedra. The corner-sharing octahedral tilt angles range from 75-79°. is represented by the Crystallographic Information File (CIF) [CIF]
data_MgMnTe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.021
_cell_length_b   7.019
_cell_length_c   7.034
_cell_angle_alpha   89.941
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   346.650
_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
  Mg  Mg0  1  0.500  0.000  0.500  1.0
  Mg  Mg1  1  0.000  0.500  0.500  1.0
  Mn  Mn2  1  0.500  0.500  0.000  1.0
  Mn  Mn3  1  0.000  0.000  0.000  1.0
  Te  Te4  1  0.881  0.619  0.890  1.0
  Te  Te5  1  0.381  0.881  0.110  1.0
  Te  Te6  1  0.112  0.112  0.621  1.0
  Te  Te7  1  0.612  0.388  0.379  1.0
  Te  Te8  1  0.119  0.381  0.110  1.0
  Te  Te9  1  0.619  0.119  0.890  1.0
  Te  Te10  1  0.888  0.888  0.379  1.0
  Te  Te11  1  0.388  0.612  0.621  1.0
[/CIF]
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The material structure described by MgMnTe4 is Pyrite-derived structured and crystallizes in the monoclinic P2_1/c space group. Mg(1) is bonded to two equivalent Te(1) and four equivalent Te(2) atoms to form MgTe6 octahedra that share corners with four equivalent Mg(1)Te6 octahedra, corners with eight equivalent Mn(1)Te6 octahedra, corners with two equivalent Te(1)MgMn2Te tetrahedra, and corners with four equivalent Te(2)Mg2MnTe tetrahedra. The corner-sharing octahedral tilt angles range from 64-66°. Mn(1) is bonded to two equivalent Te(2) and four equivalent Te(1) atoms to form MnTe6 octahedra that share corners with four equivalent Mn(1)Te6 octahedra, corners with eight equivalent Mg(1)Te6 octahedra, corners with two equivalent Te(2)Mg2MnTe tetrahedra, and corners with four equivalent Te(1)MgMn2Te tetrahedra. The corner-sharing octahedral tilt angles range from 63-65°. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to one Mg(1), two equivalent Mn(1), and one Te(1) atom to form distorted TeMgMn2Te tetrahedra that share  a cornercorner with one Mg(1)Te6 octahedra, corners with two equivalent Mn(1)Te6 octahedra, corners with seven equivalent Te(1)MgMn2Te tetrahedra, and corners with eight equivalent Te(2)Mg2MnTe tetrahedra. The corner-sharing octahedral tilt angles range from 77-80°. In the second Te site, Te(2) is bonded to two equivalent Mg(1), one Mn(1), and one Te(2) atom to form distorted TeMg2MnTe tetrahedra that share  a cornercorner with one Mn(1)Te6 octahedra, corners with two equivalent Mg(1)Te6 octahedra, corners with seven equivalent Te(2)Mg2MnTe tetrahedra, and corners with eight equivalent Te(1)MgMn2Te tetrahedra. The corner-sharing octahedral tilt angles range from 75-79°. is represented by the Crystallographic Information File (CIF) [CIF]
data_MgMnTe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.021
_cell_length_b   7.019
_cell_length_c   7.034
_cell_angle_alpha   89.941
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   346.650
_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
  Mg  Mg0  1  0.500  0.000  0.500  1.0
  Mg  Mg1  1  0.000  0.500  0.500  1.0
  Mn  Mn2  1  0.500  0.500  0.000  1.0
  Mn  Mn3  1  0.000  0.000  0.000  1.0
  Te  Te4  1  0.881  0.619  0.890  1.0
  Te  Te5  1  0.381  0.881  0.110  1.0
  Te  Te6  1  0.112  0.112  0.621  1.0
  Te  Te7  1  0.612  0.388  0.379  1.0
  Te  Te8  1  0.119  0.381  0.110  1.0
  Te  Te9  1  0.619  0.119  0.890  1.0
  Te  Te10  1  0.888  0.888  0.379  1.0
  Te  Te11  1  0.388  0.612  0.621  1.0
[/CIF]
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