The material described by MnAl(WO4)2 is Hydrophilite-derived structured and crystallizes in the monoclinic Pc space group. There are two inequivalent W sites. In the first W site, W(1) is bonded to one O(1), one O(3), one O(4), one O(6), one O(7), and one O(8) atom to form WO6 octahedra that share corners with four equivalent Mn(1)O6 octahedra, corners with four equivalent Al(1)O6 octahedra, and edges with two equivalent W(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-57°. In the second W site, W(2) is bonded to one O(2), one O(3), one O(4), one O(5), one O(7), and one O(8) atom to form distorted WO6 octahedra that share corners with four equivalent Mn(1)O6 octahedra, corners with four equivalent Al(1)O6 octahedra, and edges with two equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. Mn(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form MnO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 50-59°. Al(1) is bonded to one O(1), one O(2), one O(5), one O(6), one O(7), and one O(8) atom to form AlO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-53°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one W(1), one Mn(1), and one Al(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one W(2), one Mn(1), and one Al(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Mn(1) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Mn(1) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one W(2), one Mn(1), and one Al(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one W(1), one Mn(1), and one Al(1) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one W(1), one W(2), and one Al(1) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Al(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnAl(WO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.122
_cell_length_b   5.672
_cell_length_c   9.276
_cell_angle_alpha   90.000
_cell_angle_beta   91.471
_cell_angle_gamma   89.999
_symmetry_Int_Tables_number   1
_cell_volume   269.401
_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
  Mn  Mn0  1  0.251  0.651  0.748  1.0
  Mn  Mn1  1  0.751  0.349  0.248  1.0
  Al  Al2  1  0.248  0.657  0.245  1.0
  Al  Al3  1  0.748  0.343  0.745  1.0
  W  W4  1  0.242  0.162  0.996  1.0
  W  W5  1  0.742  0.838  0.496  1.0
  W  W6  1  0.746  0.829  0.001  1.0
  W  W7  1  0.246  0.171  0.501  1.0
  O  O8  1  0.378  0.392  0.124  1.0
  O  O9  1  0.127  0.396  0.368  1.0
  O  O10  1  0.627  0.604  0.868  1.0
  O  O11  1  0.878  0.608  0.624  1.0
  O  O12  1  0.433  0.890  0.608  1.0
  O  O13  1  0.087  0.883  0.893  1.0
  O  O14  1  0.587  0.117  0.393  1.0
  O  O15  1  0.933  0.110  0.108  1.0
  O  O16  1  0.934  0.639  0.145  1.0
  O  O17  1  0.566  0.644  0.362  1.0
  O  O18  1  0.066  0.356  0.862  1.0
  O  O19  1  0.434  0.361  0.645  1.0
  O  O20  1  0.418  0.884  0.119  1.0
  O  O21  1  0.570  0.120  0.890  1.0
  O  O22  1  0.070  0.880  0.390  1.0
  O  O23  1  0.918  0.116  0.619  1.0
[/CIF]
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The material described by MnAl(WO4)2 is Hydrophilite-derived structured and crystallizes in the monoclinic Pc space group. There are two inequivalent W sites. In the first W site, W(1) is bonded to one O(1), one O(3), one O(4), one O(6), one O(7), and one O(8) atom to form WO6 octahedra that share corners with four equivalent Mn(1)O6 octahedra, corners with four equivalent Al(1)O6 octahedra, and edges with two equivalent W(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-57°. In the second W site, W(2) is bonded to one O(2), one O(3), one O(4), one O(5), one O(7), and one O(8) atom to form distorted WO6 octahedra that share corners with four equivalent Mn(1)O6 octahedra, corners with four equivalent Al(1)O6 octahedra, and edges with two equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. Mn(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form MnO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 50-59°. Al(1) is bonded to one O(1), one O(2), one O(5), one O(6), one O(7), and one O(8) atom to form AlO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-53°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one W(1), one Mn(1), and one Al(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one W(2), one Mn(1), and one Al(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Mn(1) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Mn(1) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one W(2), one Mn(1), and one Al(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one W(1), one Mn(1), and one Al(1) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one W(1), one W(2), and one Al(1) atom. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one W(1), one W(2), and one Al(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnAl(WO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.122
_cell_length_b   5.672
_cell_length_c   9.276
_cell_angle_alpha   90.000
_cell_angle_beta   91.471
_cell_angle_gamma   89.999
_symmetry_Int_Tables_number   1
_cell_volume   269.401
_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
  Mn  Mn0  1  0.251  0.651  0.748  1.0
  Mn  Mn1  1  0.751  0.349  0.248  1.0
  Al  Al2  1  0.248  0.657  0.245  1.0
  Al  Al3  1  0.748  0.343  0.745  1.0
  W  W4  1  0.242  0.162  0.996  1.0
  W  W5  1  0.742  0.838  0.496  1.0
  W  W6  1  0.746  0.829  0.001  1.0
  W  W7  1  0.246  0.171  0.501  1.0
  O  O8  1  0.378  0.392  0.124  1.0
  O  O9  1  0.127  0.396  0.368  1.0
  O  O10  1  0.627  0.604  0.868  1.0
  O  O11  1  0.878  0.608  0.624  1.0
  O  O12  1  0.433  0.890  0.608  1.0
  O  O13  1  0.087  0.883  0.893  1.0
  O  O14  1  0.587  0.117  0.393  1.0
  O  O15  1  0.933  0.110  0.108  1.0
  O  O16  1  0.934  0.639  0.145  1.0
  O  O17  1  0.566  0.644  0.362  1.0
  O  O18  1  0.066  0.356  0.862  1.0
  O  O19  1  0.434  0.361  0.645  1.0
  O  O20  1  0.418  0.884  0.119  1.0
  O  O21  1  0.570  0.120  0.890  1.0
  O  O22  1  0.070  0.880  0.390  1.0
  O  O23  1  0.918  0.116  0.619  1.0
[/CIF]
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