The material described by MnNiTe2 crystallizes in the trigonal P-3m1 space group. Mn(1) is bonded in a 8-coordinate geometry to two equivalent Ni(1) and six equivalent Te(1) atoms. Ni(1) is bonded in a distorted body-centered cubic geometry to two equivalent Mn(1) and six equivalent Te(1) atoms. Te(1) is bonded in a 6-coordinate geometry to three equivalent Mn(1) and three equivalent Ni(1) atoms. is represented by the CIF card [CIF]
data_MnNiTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.021
_cell_length_b   4.021
_cell_length_c   5.766
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   80.739
_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
  Mn  Mn0  1  0.000  0.000  0.500  1.0
  Ni  Ni1  1  0.000  0.000  0.000  1.0
  Te  Te2  1  0.667  0.333  0.232  1.0
  Te  Te3  1  0.333  0.667  0.768  1.0
[/CIF]
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The material described by MnNiTe2 crystallizes in the trigonal P-3m1 space group. Mn(1) is bonded in a 8-coordinate geometry to two equivalent Ni(1) and six equivalent Te(1) atoms. Ni(1) is bonded in a distorted body-centered cubic geometry to two equivalent Mn(1) and six equivalent Te(1) atoms. Te(1) is bonded in a 6-coordinate geometry to three equivalent Mn(1) and three equivalent Ni(1) atoms. is represented by the CIF card [CIF]
data_MnNiTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.021
_cell_length_b   4.021
_cell_length_c   5.766
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   80.739
_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
  Mn  Mn0  1  0.000  0.000  0.500  1.0
  Ni  Ni1  1  0.000  0.000  0.000  1.0
  Te  Te2  1  0.667  0.333  0.232  1.0
  Te  Te3  1  0.333  0.667  0.768  1.0
[/CIF]
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