The material structure described by CaAg4(RuO3)4 crystallizes in the orthorhombic Imm2 space group. Ca(1) is bonded in a distorted octahedral geometry to one O(2), one O(5), and four equivalent O(3) atoms. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 6-coordinate geometry to one O(2), one O(6), two equivalent O(1), and two equivalent O(3) atoms. In the second Ru site, Ru(2) is bonded in a 6-coordinate geometry to one O(4), one O(5), two equivalent O(1), and two equivalent O(3) atoms. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a distorted trigonal planar geometry to one O(2) and two equivalent O(3) atoms. In the second Ag site, Ag(2) is bonded in a distorted trigonal planar geometry to one O(5) and two equivalent O(3) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Ru(1) and one Ru(2) atom. In the second O site, O(2) is bonded in a 5-coordinate geometry to one Ca(1), two equivalent Ru(1), and two equivalent Ag(1) atoms. In the third O site, O(3) is bonded in a 5-coordinate geometry to one Ca(1), one Ru(1), one Ru(2), one Ag(1), and one Ag(2) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to two equivalent Ru(2) atoms. In the fifth O site, O(5) is bonded in a distorted pentagonal planar geometry to one Ca(1), two equivalent Ru(2), and two equivalent Ag(2) atoms. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to two equivalent Ru(1) atoms. is represented by the CIF card [CIF]
data_CaAg4(RuO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.503
_cell_length_b   7.496
_cell_length_c   7.488
_cell_angle_alpha   60.037
_cell_angle_beta   90.000
_cell_angle_gamma   120.030
_symmetry_Int_Tables_number   1
_cell_volume   297.813
_cell_formula_units_Z   1
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
  Ca  Ca0  1  0.373  0.747  0.377  1.0
  Ag  Ag1  1  0.577  0.553  0.973  1.0
  Ag  Ag2  1  0.975  0.950  0.973  1.0
  Ag  Ag3  1  0.976  0.553  0.973  1.0
  Ag  Ag4  1  0.975  0.950  0.578  1.0
  Ru  Ru5  1  0.512  0.024  0.965  1.0
  Ru  Ru6  1  0.512  0.024  0.512  1.0
  Ru  Ru7  1  0.512  0.475  0.513  1.0
  Ru  Ru8  1  0.962  0.475  0.513  1.0
  O  O9  1  0.814  0.250  0.435  1.0
  O  O10  1  0.586  0.172  0.164  1.0
  O  O11  1  0.587  0.749  0.163  1.0
  O  O12  1  0.814  0.250  0.816  1.0
  O  O13  1  0.815  0.630  0.435  1.0
  O  O14  1  0.435  0.250  0.435  1.0
  O  O15  1  0.587  0.749  0.588  1.0
  O  O16  1  0.162  0.749  0.163  1.0
  O  O17  1  0.162  0.323  0.588  1.0
  O  O18  1  0.435  0.250  0.816  1.0
  O  O19  1  0.435  0.871  0.815  1.0
  O  O20  1  0.162  0.749  0.588  1.0
[/CIF]
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The material structure described by CaAg4(RuO3)4 crystallizes in the orthorhombic Imm2 space group. Ca(1) is bonded in a distorted octahedral geometry to one O(2), one O(5), and four equivalent O(3) atoms. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 6-coordinate geometry to one O(2), one O(6), two equivalent O(1), and two equivalent O(3) atoms. In the second Ru site, Ru(2) is bonded in a 6-coordinate geometry to one O(4), one O(5), two equivalent O(1), and two equivalent O(3) atoms. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a distorted trigonal planar geometry to one O(2) and two equivalent O(3) atoms. In the second Ag site, Ag(2) is bonded in a distorted trigonal planar geometry to one O(5) and two equivalent O(3) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Ru(1) and one Ru(2) atom. In the second O site, O(2) is bonded in a 5-coordinate geometry to one Ca(1), two equivalent Ru(1), and two equivalent Ag(1) atoms. In the third O site, O(3) is bonded in a 5-coordinate geometry to one Ca(1), one Ru(1), one Ru(2), one Ag(1), and one Ag(2) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to two equivalent Ru(2) atoms. In the fifth O site, O(5) is bonded in a distorted pentagonal planar geometry to one Ca(1), two equivalent Ru(2), and two equivalent Ag(2) atoms. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to two equivalent Ru(1) atoms. is represented by the CIF card [CIF]
data_CaAg4(RuO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.503
_cell_length_b   7.496
_cell_length_c   7.488
_cell_angle_alpha   60.037
_cell_angle_beta   90.000
_cell_angle_gamma   120.030
_symmetry_Int_Tables_number   1
_cell_volume   297.813
_cell_formula_units_Z   1
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
  Ca  Ca0  1  0.373  0.747  0.377  1.0
  Ag  Ag1  1  0.577  0.553  0.973  1.0
  Ag  Ag2  1  0.975  0.950  0.973  1.0
  Ag  Ag3  1  0.976  0.553  0.973  1.0
  Ag  Ag4  1  0.975  0.950  0.578  1.0
  Ru  Ru5  1  0.512  0.024  0.965  1.0
  Ru  Ru6  1  0.512  0.024  0.512  1.0
  Ru  Ru7  1  0.512  0.475  0.513  1.0
  Ru  Ru8  1  0.962  0.475  0.513  1.0
  O  O9  1  0.814  0.250  0.435  1.0
  O  O10  1  0.586  0.172  0.164  1.0
  O  O11  1  0.587  0.749  0.163  1.0
  O  O12  1  0.814  0.250  0.816  1.0
  O  O13  1  0.815  0.630  0.435  1.0
  O  O14  1  0.435  0.250  0.435  1.0
  O  O15  1  0.587  0.749  0.588  1.0
  O  O16  1  0.162  0.749  0.163  1.0
  O  O17  1  0.162  0.323  0.588  1.0
  O  O18  1  0.435  0.250  0.816  1.0
  O  O19  1  0.435  0.871  0.815  1.0
  O  O20  1  0.162  0.749  0.588  1.0
[/CIF]
.