The material structure described by Mn crystallizes in the cubic F-43m space group. There are five inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 9-coordinate geometry to three equivalent Mn(2), three equivalent Mn(3), and three equivalent Mn(5) atoms. In the second Mn site, Mn(2) is bonded in a 6-coordinate geometry to three equivalent Mn(1) and three equivalent Mn(5) atoms. In the third Mn site, Mn(3) is bonded in a 10-coordinate geometry to one Mn(4), three equivalent Mn(1), three equivalent Mn(3), and three equivalent Mn(5) atoms. In the fourth Mn site, Mn(4) is bonded in a 1-coordinate geometry to one Mn(3) and three equivalent Mn(5) atoms. In the fifth Mn site, Mn(5) is bonded in a 12-coordinate geometry to two equivalent Mn(1), two equivalent Mn(2), two equivalent Mn(3), two equivalent Mn(4), and four equivalent Mn(5) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.885
_cell_length_b   7.885
_cell_length_c   7.885
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   346.638
_cell_formula_units_Z   22
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  0.900  0.367  0.367  1.0
  Mn  Mn1  1  0.367  0.900  0.367  1.0
  Mn  Mn2  1  0.367  0.367  0.900  1.0
  Mn  Mn3  1  0.367  0.367  0.367  1.0
  Mn  Mn4  1  0.518  0.161  0.161  1.0
  Mn  Mn5  1  0.161  0.518  0.161  1.0
  Mn  Mn6  1  0.161  0.161  0.518  1.0
  Mn  Mn7  1  0.161  0.161  0.161  1.0
  Mn  Mn8  1  0.280  0.573  0.573  1.0
  Mn  Mn9  1  0.573  0.280  0.573  1.0
  Mn  Mn10  1  0.573  0.573  0.280  1.0
  Mn  Mn11  1  0.573  0.573  0.573  1.0
  Mn  Mn12  1  0.978  0.674  0.674  1.0
  Mn  Mn13  1  0.674  0.978  0.674  1.0
  Mn  Mn14  1  0.674  0.674  0.978  1.0
  Mn  Mn15  1  0.674  0.674  0.674  1.0
  Mn  Mn16  1  0.198  0.802  0.198  1.0
  Mn  Mn17  1  0.198  0.802  0.802  1.0
  Mn  Mn18  1  0.198  0.198  0.802  1.0
  Mn  Mn19  1  0.802  0.198  0.802  1.0
  Mn  Mn20  1  0.802  0.198  0.198  1.0
  Mn  Mn21  1  0.802  0.802  0.198  1.0
[/CIF]
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The material structure described by Mn crystallizes in the cubic F-43m space group. There are five inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 9-coordinate geometry to three equivalent Mn(2), three equivalent Mn(3), and three equivalent Mn(5) atoms. In the second Mn site, Mn(2) is bonded in a 6-coordinate geometry to three equivalent Mn(1) and three equivalent Mn(5) atoms. In the third Mn site, Mn(3) is bonded in a 10-coordinate geometry to one Mn(4), three equivalent Mn(1), three equivalent Mn(3), and three equivalent Mn(5) atoms. In the fourth Mn site, Mn(4) is bonded in a 1-coordinate geometry to one Mn(3) and three equivalent Mn(5) atoms. In the fifth Mn site, Mn(5) is bonded in a 12-coordinate geometry to two equivalent Mn(1), two equivalent Mn(2), two equivalent Mn(3), two equivalent Mn(4), and four equivalent Mn(5) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.885
_cell_length_b   7.885
_cell_length_c   7.885
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   346.638
_cell_formula_units_Z   22
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  0.900  0.367  0.367  1.0
  Mn  Mn1  1  0.367  0.900  0.367  1.0
  Mn  Mn2  1  0.367  0.367  0.900  1.0
  Mn  Mn3  1  0.367  0.367  0.367  1.0
  Mn  Mn4  1  0.518  0.161  0.161  1.0
  Mn  Mn5  1  0.161  0.518  0.161  1.0
  Mn  Mn6  1  0.161  0.161  0.518  1.0
  Mn  Mn7  1  0.161  0.161  0.161  1.0
  Mn  Mn8  1  0.280  0.573  0.573  1.0
  Mn  Mn9  1  0.573  0.280  0.573  1.0
  Mn  Mn10  1  0.573  0.573  0.280  1.0
  Mn  Mn11  1  0.573  0.573  0.573  1.0
  Mn  Mn12  1  0.978  0.674  0.674  1.0
  Mn  Mn13  1  0.674  0.978  0.674  1.0
  Mn  Mn14  1  0.674  0.674  0.978  1.0
  Mn  Mn15  1  0.674  0.674  0.674  1.0
  Mn  Mn16  1  0.198  0.802  0.198  1.0
  Mn  Mn17  1  0.198  0.802  0.802  1.0
  Mn  Mn18  1  0.198  0.198  0.802  1.0
  Mn  Mn19  1  0.802  0.198  0.802  1.0
  Mn  Mn20  1  0.802  0.198  0.198  1.0
  Mn  Mn21  1  0.802  0.802  0.198  1.0
[/CIF]
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