The material described by ZnMn3O7 crystallizes in the orthorhombic Pnma space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(4), two equivalent O(1), and two equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing MnO5 trigonal bipyramids. In the second Mn site, Mn(2) is bonded to one O(3), two equivalent O(1), and two equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing MnO5 square pyramids. Zn(1) is bonded in a 5-coordinate geometry to one O(3), two equivalent O(1), and two equivalent O(4) atoms. There are four inequivalent O sites. In the first O site, O(3) is bonded in a water-like geometry to one Mn(2) and one Zn(1) atom. In the second O site, O(4) is bonded in a bent 120 degrees geometry to one Mn(1) and one Zn(1) atom. In the third O site, O(1) is bonded in a 4-coordinate geometry to one Mn(2), two equivalent Mn(1), and one Zn(1) atom. In the fourth O site, O(2) is bonded in a T-shaped geometry to one Mn(2) and two equivalent Mn(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn3ZnO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.552
_cell_length_b   9.344
_cell_length_c   10.447
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   542.048
_cell_formula_units_Z   4
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  0.727  0.706  0.977  1.0
  Mn  Mn1  1  0.227  0.794  0.023  1.0
  Mn  Mn2  1  0.273  0.294  0.477  1.0
  Mn  Mn3  1  0.773  0.206  0.523  1.0
  Mn  Mn4  1  0.727  0.760  0.250  1.0
  Mn  Mn5  1  0.227  0.740  0.750  1.0
  Mn  Mn6  1  0.273  0.240  0.750  1.0
  Mn  Mn7  1  0.773  0.260  0.250  1.0
  Mn  Mn8  1  0.227  0.794  0.477  1.0
  Mn  Mn9  1  0.727  0.706  0.523  1.0
  Mn  Mn10  1  0.773  0.206  0.977  1.0
  Mn  Mn11  1  0.273  0.294  0.023  1.0
  Zn  Zn12  1  0.382  0.010  0.250  1.0
  Zn  Zn13  1  0.882  0.490  0.750  1.0
  Zn  Zn14  1  0.618  0.990  0.750  1.0
  Zn  Zn15  1  0.118  0.510  0.250  1.0
  O  O16  1  0.040  0.290  0.881  1.0
  O  O17  1  0.540  0.210  0.119  1.0
  O  O18  1  0.960  0.710  0.381  1.0
  O  O19  1  0.460  0.790  0.619  1.0
  O  O20  1  0.960  0.710  0.119  1.0
  O  O21  1  0.460  0.790  0.881  1.0
  O  O22  1  0.040  0.290  0.619  1.0
  O  O23  1  0.540  0.210  0.381  1.0
  O  O24  1  0.501  0.277  0.884  1.0
  O  O25  1  0.001  0.223  0.116  1.0
  O  O26  1  0.499  0.723  0.384  1.0
  O  O27  1  0.999  0.777  0.616  1.0
  O  O28  1  0.499  0.723  0.116  1.0
  O  O29  1  0.999  0.777  0.884  1.0
  O  O30  1  0.501  0.277  0.616  1.0
  O  O31  1  0.001  0.223  0.384  1.0
  O  O32  1  0.781  0.447  0.250  1.0
  O  O33  1  0.281  0.053  0.750  1.0
  O  O34  1  0.219  0.553  0.750  1.0
  O  O35  1  0.719  0.947  0.250  1.0
  O  O36  1  0.772  0.033  0.588  1.0
  O  O37  1  0.272  0.467  0.412  1.0
  O  O38  1  0.228  0.967  0.088  1.0
  O  O39  1  0.728  0.533  0.912  1.0
  O  O40  1  0.228  0.967  0.412  1.0
  O  O41  1  0.728  0.533  0.588  1.0
  O  O42  1  0.772  0.033  0.912  1.0
  O  O43  1  0.272  0.467  0.088  1.0
[/CIF]
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The material described by ZnMn3O7 crystallizes in the orthorhombic Pnma space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(4), two equivalent O(1), and two equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing MnO5 trigonal bipyramids. In the second Mn site, Mn(2) is bonded to one O(3), two equivalent O(1), and two equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing MnO5 square pyramids. Zn(1) is bonded in a 5-coordinate geometry to one O(3), two equivalent O(1), and two equivalent O(4) atoms. There are four inequivalent O sites. In the first O site, O(3) is bonded in a water-like geometry to one Mn(2) and one Zn(1) atom. In the second O site, O(4) is bonded in a bent 120 degrees geometry to one Mn(1) and one Zn(1) atom. In the third O site, O(1) is bonded in a 4-coordinate geometry to one Mn(2), two equivalent Mn(1), and one Zn(1) atom. In the fourth O site, O(2) is bonded in a T-shaped geometry to one Mn(2) and two equivalent Mn(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn3ZnO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.552
_cell_length_b   9.344
_cell_length_c   10.447
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   542.048
_cell_formula_units_Z   4
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  0.727  0.706  0.977  1.0
  Mn  Mn1  1  0.227  0.794  0.023  1.0
  Mn  Mn2  1  0.273  0.294  0.477  1.0
  Mn  Mn3  1  0.773  0.206  0.523  1.0
  Mn  Mn4  1  0.727  0.760  0.250  1.0
  Mn  Mn5  1  0.227  0.740  0.750  1.0
  Mn  Mn6  1  0.273  0.240  0.750  1.0
  Mn  Mn7  1  0.773  0.260  0.250  1.0
  Mn  Mn8  1  0.227  0.794  0.477  1.0
  Mn  Mn9  1  0.727  0.706  0.523  1.0
  Mn  Mn10  1  0.773  0.206  0.977  1.0
  Mn  Mn11  1  0.273  0.294  0.023  1.0
  Zn  Zn12  1  0.382  0.010  0.250  1.0
  Zn  Zn13  1  0.882  0.490  0.750  1.0
  Zn  Zn14  1  0.618  0.990  0.750  1.0
  Zn  Zn15  1  0.118  0.510  0.250  1.0
  O  O16  1  0.040  0.290  0.881  1.0
  O  O17  1  0.540  0.210  0.119  1.0
  O  O18  1  0.960  0.710  0.381  1.0
  O  O19  1  0.460  0.790  0.619  1.0
  O  O20  1  0.960  0.710  0.119  1.0
  O  O21  1  0.460  0.790  0.881  1.0
  O  O22  1  0.040  0.290  0.619  1.0
  O  O23  1  0.540  0.210  0.381  1.0
  O  O24  1  0.501  0.277  0.884  1.0
  O  O25  1  0.001  0.223  0.116  1.0
  O  O26  1  0.499  0.723  0.384  1.0
  O  O27  1  0.999  0.777  0.616  1.0
  O  O28  1  0.499  0.723  0.116  1.0
  O  O29  1  0.999  0.777  0.884  1.0
  O  O30  1  0.501  0.277  0.616  1.0
  O  O31  1  0.001  0.223  0.384  1.0
  O  O32  1  0.781  0.447  0.250  1.0
  O  O33  1  0.281  0.053  0.750  1.0
  O  O34  1  0.219  0.553  0.750  1.0
  O  O35  1  0.719  0.947  0.250  1.0
  O  O36  1  0.772  0.033  0.588  1.0
  O  O37  1  0.272  0.467  0.412  1.0
  O  O38  1  0.228  0.967  0.088  1.0
  O  O39  1  0.728  0.533  0.912  1.0
  O  O40  1  0.228  0.967  0.412  1.0
  O  O41  1  0.728  0.533  0.588  1.0
  O  O42  1  0.772  0.033  0.912  1.0
  O  O43  1  0.272  0.467  0.088  1.0
[/CIF]
.