data_DyMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48
_cell_length_b   6.48
_cell_length_c   6.28
_cell_angle_alpha   118.59
_cell_angle_beta   118.59
_cell_angle_gamma   57.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   DyMn2O4
_chemical_formula_sum   'Dy2 Mn4 O8'
_cell_volume   186.48
_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
  Dy  Dy0  1  0.16  0.0  0.22  1.0
  Dy  Dy1  1  0.79  0.0  0.04  1.0
  Mn  Mn2  1  0.29  0.0  0.63  1.0
  Mn  Mn3  1  0.0  0.0  0.0  1.0
  Mn  Mn4  1  0.84  0.56  0.0  1.0
  Mn  Mn5  1  0.84  0.44  0.0  1.0
  O  O6  1  1.0  0.0  0.19  1.0
  O  O7  1  0.76  0.0  0.16  1.0
  O  O8  1  0.68  0.27  0.4  1.0
  O  O9  1  0.68  0.73  0.4  1.0
  O  O10  1  0.95  0.0  0.07  1.0
  O  O11  1  0.19  0.0  0.1  1.0
  O  O12  1  0.27  0.73  0.87  1.0
  O  O13  1  0.27  0.27  0.87  1.0

data_DyMn2O4
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.23
_cell_length_b   6.28
_cell_length_c   6.48
_cell_angle_alpha   118.59
_cell_angle_beta   118.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   DyMn2O4
_chemical_formula_sum   'Dy2 Mn4 O8'
_cell_volume   186.48
_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
  Dy  Dy0  1  0.0  0.04  0.79  1.0
  Dy  Dy1  1  0.0  0.22  0.16  1.0
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Mn  Mn3  1  0.0  0.63  0.29  1.0
  Mn  Mn4  1  0.44  0.0  0.29  1.0
  Mn  Mn5  1  0.56  0.0  0.4  1.0
  O  O6  1  0.0  0.07  0.95  1.0
  O  O7  1  0.0  0.1  0.19  1.0
  O  O8  1  0.0  0.16  0.76  1.0
  O  O9  1  0.0  0.19  1.0  1.0
  O  O10  1  0.27  0.4  0.95  1.0
  O  O11  1  0.27  0.87  0.53  1.0
  O  O12  1  0.73  0.4  0.42  1.0
  O  O13  1  0.73  0.87  0.0  1.0

Dy Dy Mn Mn Mn Mn O O O O O O O O
DyMn2O4 crystallizes in the triclinic P1 space group. There are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded in a bent 120 degrees geometry to one O(1), one O(4), and one O(6) atom. The Dy(1)-O(1) bond length is 1.01 Å. The Dy(1)-O(4) bond length is 2.73 Å. The Dy(1)-O(6) bond length is 0.81 Å. In the second Dy site, Dy(2) is bonded in a distorted bent 120 degrees geometry to one O(1), one O(2), and one O(5) atom. The Dy(2)-O(1) bond length is 1.23 Å. The Dy(2)-O(2) bond length is 0.81 Å. The Dy(2)-O(5) bond length is 1.01 Å. There are four inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a single-bond geometry to one O(4), one O(7), and one O(8) atom. The Mn(1)-O(4) bond length is 2.85 Å. The Mn(1)-O(7) bond length is 2.82 Å. The Mn(1)-O(8) bond length is 1.63 Å. In the second Mn site, Mn(2) is bonded in a distorted water-like geometry to one O(5), one O(6), and one O(7) atom. The Mn(2)-O(5) bond length is 0.66 Å. The Mn(2)-O(6) bond length is 1.06 Å. The Mn(2)-O(7) bond length is 1.86 Å. In the third Mn site, Mn(3) is bonded in a 3-coordinate geometry to one Mn(4), one O(2), one O(4), and one O(8) atom. The Mn(3)-Mn(4) bond length is 0.74 Å. The Mn(3)-O(2) bond length is 2.38 Å. The Mn(3)-O(4) bond length is 2.67 Å. The Mn(3)-O(8) bond length is 2.63 Å. In the fourth Mn site, Mn(4) is bonded in a 1-coordinate geometry to one Mn(3) and one O(4) atom. The Mn(4)-O(4) bond length is 2.60 Å. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Dy(1), one Dy(2), and one O(5) atom. The O(1)-O(5) bond length is 0.66 Å. In the second O site, O(2) is bonded in a single-bond geometry to one Dy(2), one Mn(3), and one O(3) atom. The O(2)-O(3) bond length is 1.67 Å. In the third O site, O(3) is bonded in a single-bond geometry to one O(2) atom. In the fourth O site, O(4) is bonded in a 4-coordinate geometry to one Dy(1), one Mn(1), one Mn(3), and one Mn(4) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Dy(2), one Mn(2), and one O(1) atom. In the sixth O site, O(6) is bonded in an L-shaped geometry to one Dy(1), one Mn(2), and one O(7) atom. The O(6)-O(7) bond length is 1.67 Å. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Mn(1), one Mn(2), and one O(6) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Mn(1) and one Mn(3) atom.