The compound described by KBaGd(MoO4)3 is Zircon-derived structured and crystallizes in the monoclinic C2 space group. K(1) is bonded in a 8-coordinate geometry to one O(11), one O(12), one O(3), one O(4), one O(5), one O(6), one O(7), and one O(9) atom. Ba(1) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(12), one O(3), one O(4), one O(5), one O(6), and one O(8) atom. There are two inequivalent Gd sites. In the first Gd site, Gd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(7), and two equivalent O(9) atoms. In the second Gd site, Gd(2) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(10), two equivalent O(2), and two equivalent O(8) atoms. There are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to two equivalent O(3) and two equivalent O(7) atoms. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to two equivalent O(4) and two equivalent O(8) atoms. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(10), one O(12), one O(2), and one O(6) atom. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(1), one O(11), one O(5), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one Mo(4) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one Mo(3) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(4) atom. In the sixth O site, O(6) is bonded in a 1-coordinate geometry to one K(1), one Ba(1), and one Mo(3) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one K(1), one Gd(1), and one Mo(1) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Ba(1), one Gd(2), and one Mo(2) atom. In the ninth O site, O(9) is bonded in a 3-coordinate geometry to one K(1), one Gd(1), and one Mo(4) atom. In the tenth O site, O(10) is bonded in a 3-coordinate geometry to one Ba(1), one Gd(2), and one Mo(3) atom. In the eleventh O site, O(11) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(4) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(3) atom. is represented by the CIF card [CIF]
data_KBaGd(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.801
_cell_length_b   10.801
_cell_length_c   5.418
_cell_angle_alpha   76.810
_cell_angle_beta   76.810
_cell_angle_gamma   70.116
_symmetry_Int_Tables_number   1
_cell_volume   570.837
_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
  K  K0  1  0.709  0.962  0.173  1.0
  K  K1  1  0.038  0.291  0.827  1.0
  Ba  Ba2  1  0.290  0.042  0.326  1.0
  Ba  Ba3  1  0.958  0.710  0.674  1.0
  Gd  Gd4  1  0.622  0.378  0.000  1.0
  Gd  Gd5  1  0.384  0.616  0.500  1.0
  Mo  Mo6  1  0.850  0.150  0.500  1.0
  Mo  Mo7  1  0.151  0.849  0.000  1.0
  Mo  Mo8  1  0.546  0.767  0.850  1.0
  Mo  Mo9  1  0.233  0.454  0.150  1.0
  Mo  Mo10  1  0.454  0.233  0.649  1.0
  Mo  Mo11  1  0.767  0.546  0.351  1.0
  O  O12  1  0.613  0.538  0.596  1.0
  O  O13  1  0.462  0.387  0.404  1.0
  O  O14  1  0.385  0.464  0.905  1.0
  O  O15  1  0.536  0.615  0.095  1.0
  O  O16  1  0.013  0.143  0.325  1.0
  O  O17  1  0.857  0.987  0.675  1.0
  O  O18  1  0.989  0.853  0.177  1.0
  O  O19  1  0.147  0.011  0.823  1.0
  O  O20  1  0.762  0.698  0.135  1.0
  O  O21  1  0.302  0.238  0.865  1.0
  O  O22  1  0.240  0.300  0.362  1.0
  O  O23  1  0.700  0.760  0.638  1.0
  O  O24  1  0.730  0.193  0.283  1.0
  O  O25  1  0.807  0.270  0.717  1.0
  O  O26  1  0.269  0.810  0.220  1.0
  O  O27  1  0.190  0.731  0.780  1.0
  O  O28  1  0.797  0.425  0.145  1.0
  O  O29  1  0.575  0.203  0.855  1.0
  O  O30  1  0.201  0.576  0.356  1.0
  O  O31  1  0.424  0.799  0.644  1.0
  O  O32  1  0.491  0.095  0.494  1.0
  O  O33  1  0.905  0.509  0.506  1.0
  O  O34  1  0.505  0.905  0.007  1.0
  O  O35  1  0.095  0.495  0.993  1.0
[/CIF]
.
The compound described by KBaGd(MoO4)3 is Zircon-derived structured and crystallizes in the monoclinic C2 space group. K(1) is bonded in a 8-coordinate geometry to one O(11), one O(12), one O(3), one O(4), one O(5), one O(6), one O(7), and one O(9) atom. Ba(1) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(12), one O(3), one O(4), one O(5), one O(6), and one O(8) atom. There are two inequivalent Gd sites. In the first Gd site, Gd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(7), and two equivalent O(9) atoms. In the second Gd site, Gd(2) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(10), two equivalent O(2), and two equivalent O(8) atoms. There are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to two equivalent O(3) and two equivalent O(7) atoms. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to two equivalent O(4) and two equivalent O(8) atoms. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(10), one O(12), one O(2), and one O(6) atom. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(1), one O(11), one O(5), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one Mo(4) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one Mo(3) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(4) atom. In the sixth O site, O(6) is bonded in a 1-coordinate geometry to one K(1), one Ba(1), and one Mo(3) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one K(1), one Gd(1), and one Mo(1) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Ba(1), one Gd(2), and one Mo(2) atom. In the ninth O site, O(9) is bonded in a 3-coordinate geometry to one K(1), one Gd(1), and one Mo(4) atom. In the tenth O site, O(10) is bonded in a 3-coordinate geometry to one Ba(1), one Gd(2), and one Mo(3) atom. In the eleventh O site, O(11) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(4) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one K(1), one Ba(1), and one Mo(3) atom. is represented by the CIF card [CIF]
data_KBaGd(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.801
_cell_length_b   10.801
_cell_length_c   5.418
_cell_angle_alpha   76.810
_cell_angle_beta   76.810
_cell_angle_gamma   70.116
_symmetry_Int_Tables_number   1
_cell_volume   570.837
_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
  K  K0  1  0.709  0.962  0.173  1.0
  K  K1  1  0.038  0.291  0.827  1.0
  Ba  Ba2  1  0.290  0.042  0.326  1.0
  Ba  Ba3  1  0.958  0.710  0.674  1.0
  Gd  Gd4  1  0.622  0.378  0.000  1.0
  Gd  Gd5  1  0.384  0.616  0.500  1.0
  Mo  Mo6  1  0.850  0.150  0.500  1.0
  Mo  Mo7  1  0.151  0.849  0.000  1.0
  Mo  Mo8  1  0.546  0.767  0.850  1.0
  Mo  Mo9  1  0.233  0.454  0.150  1.0
  Mo  Mo10  1  0.454  0.233  0.649  1.0
  Mo  Mo11  1  0.767  0.546  0.351  1.0
  O  O12  1  0.613  0.538  0.596  1.0
  O  O13  1  0.462  0.387  0.404  1.0
  O  O14  1  0.385  0.464  0.905  1.0
  O  O15  1  0.536  0.615  0.095  1.0
  O  O16  1  0.013  0.143  0.325  1.0
  O  O17  1  0.857  0.987  0.675  1.0
  O  O18  1  0.989  0.853  0.177  1.0
  O  O19  1  0.147  0.011  0.823  1.0
  O  O20  1  0.762  0.698  0.135  1.0
  O  O21  1  0.302  0.238  0.865  1.0
  O  O22  1  0.240  0.300  0.362  1.0
  O  O23  1  0.700  0.760  0.638  1.0
  O  O24  1  0.730  0.193  0.283  1.0
  O  O25  1  0.807  0.270  0.717  1.0
  O  O26  1  0.269  0.810  0.220  1.0
  O  O27  1  0.190  0.731  0.780  1.0
  O  O28  1  0.797  0.425  0.145  1.0
  O  O29  1  0.575  0.203  0.855  1.0
  O  O30  1  0.201  0.576  0.356  1.0
  O  O31  1  0.424  0.799  0.644  1.0
  O  O32  1  0.491  0.095  0.494  1.0
  O  O33  1  0.905  0.509  0.506  1.0
  O  O34  1  0.505  0.905  0.007  1.0
  O  O35  1  0.095  0.495  0.993  1.0
[/CIF]
.