data_MgMnZnIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   4.67
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgMnZnIn
_chemical_formula_sum   'Mg1 Mn1 Zn1 In1'
_cell_volume   71.8
_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  Mg1  1  0.0  0.0  0.0  1.0
  Mn  Mn2  1  0.3  0.3  0.3  1.0
  Zn  Zn3  1  0.95  0.95  0.95  1.0
  In  In0  1  0.65  0.65  0.65  1.0

data_MgMnZnIn
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   11.43
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   MgMnZnIn
_chemical_formula_sum   'Mg3 Mn3 Zn3 In3'
_cell_volume   215.41
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  3  0.0  0.0  0.0  1.0
  Mn  Mn1  3  0.0  0.0  0.7  1.0
  Zn  Zn2  3  0.0  0.0  0.05  1.0
  In  In3  3  0.0  0.0  0.35  1.0

Mg Mn Zn In
MgMnZnIn crystallizes in the trigonal R3m space group. Mg(1) is bonded in a single-bond geometry to four equivalent Mn(1), one Zn(1), and three equivalent In(1) atoms. There are three shorter (2.72 Å) and one longer (3.42 Å) Mg(1)-Mn(1) bond length. The Mg(1)-Zn(1) bond length is 0.59 Å. All Mg(1)-In(1) bond lengths are 2.70 Å. Mn(1) is bonded in a distorted q6 geometry to four equivalent Mg(1), three equivalent Zn(1), and three equivalent In(1) atoms. All Mn(1)-Zn(1) bond lengths are 2.70 Å. All Mn(1)-In(1) bond lengths are 2.70 Å. Zn(1) is bonded in a single-bond geometry to one Mg(1), three equivalent Mn(1), and four equivalent In(1) atoms. There are three shorter (2.72 Å) and one longer (3.42 Å) Zn(1)-In(1) bond length. In(1) is bonded in a 10-coordinate geometry to three equivalent Mg(1), three equivalent Mn(1), and four equivalent Zn(1) atoms.