The compound described by SrV2O6 crystallizes in the orthorhombic Pnma space group. Sr(1) is bonded in a 9-coordinate geometry to one O(2), one O(6), two equivalent O(4), two equivalent O(5), and three equivalent O(1) atoms. There are two inequivalent V sites. In the first V site, V(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), and two equivalent O(6) atoms. In the second V site, V(2) is bonded in a 5-coordinate geometry to one O(4), one O(5), one O(6), and two equivalent O(3) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Sr(1) and one V(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Sr(1) and one V(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one V(1) and two equivalent V(2) atoms. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent Sr(1) and one V(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to two equivalent Sr(1) and one V(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Sr(1), one V(2), and two equivalent V(1) atoms. is represented by the CIF file [CIF]
data_SrV2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.650
_cell_length_b   9.734
_cell_length_c   12.660
_cell_angle_alpha   89.990
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   449.808
_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
  Sr  Sr0  1  0.250  0.131  0.119  1.0
  Sr  Sr1  1  0.750  0.869  0.881  1.0
  Sr  Sr2  1  0.250  0.631  0.381  1.0
  Sr  Sr3  1  0.750  0.369  0.619  1.0
  V  V4  1  0.250  0.742  0.091  1.0
  V  V5  1  0.750  0.258  0.909  1.0
  V  V6  1  0.250  0.242  0.409  1.0
  V  V7  1  0.750  0.758  0.591  1.0
  V  V8  1  0.250  0.504  0.871  1.0
  V  V9  1  0.750  0.496  0.129  1.0
  V  V10  1  0.750  0.996  0.372  1.0
  V  V11  1  0.250  0.004  0.628  1.0
  O  O12  1  0.250  0.894  0.025  1.0
  O  O13  1  0.750  0.106  0.975  1.0
  O  O14  1  0.250  0.394  0.475  1.0
  O  O15  1  0.750  0.606  0.525  1.0
  O  O16  1  0.250  0.779  0.216  1.0
  O  O17  1  0.750  0.221  0.784  1.0
  O  O18  1  0.250  0.279  0.284  1.0
  O  O19  1  0.750  0.721  0.716  1.0
  O  O20  1  0.250  0.532  0.092  1.0
  O  O21  1  0.750  0.468  0.908  1.0
  O  O22  1  0.250  0.032  0.408  1.0
  O  O23  1  0.750  0.968  0.592  1.0
  O  O24  1  0.750  0.826  0.394  1.0
  O  O25  1  0.250  0.174  0.606  1.0
  O  O26  1  0.750  0.326  0.106  1.0
  O  O27  1  0.250  0.674  0.894  1.0
  O  O28  1  0.750  0.025  0.243  1.0
  O  O29  1  0.250  0.975  0.757  1.0
  O  O30  1  0.250  0.308  0.932  1.0
  O  O31  1  0.250  0.476  0.742  1.0
  O  O32  1  0.750  0.192  0.432  1.0
  O  O33  1  0.250  0.808  0.568  1.0
  O  O34  1  0.750  0.692  0.068  1.0
  O  O35  1  0.750  0.524  0.258  1.0
[/CIF]
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The compound described by SrV2O6 crystallizes in the orthorhombic Pnma space group. Sr(1) is bonded in a 9-coordinate geometry to one O(2), one O(6), two equivalent O(4), two equivalent O(5), and three equivalent O(1) atoms. There are two inequivalent V sites. In the first V site, V(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), and two equivalent O(6) atoms. In the second V site, V(2) is bonded in a 5-coordinate geometry to one O(4), one O(5), one O(6), and two equivalent O(3) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Sr(1) and one V(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Sr(1) and one V(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one V(1) and two equivalent V(2) atoms. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent Sr(1) and one V(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to two equivalent Sr(1) and one V(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Sr(1), one V(2), and two equivalent V(1) atoms. is represented by the CIF file [CIF]
data_SrV2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.650
_cell_length_b   9.734
_cell_length_c   12.660
_cell_angle_alpha   89.990
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   449.808
_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
  Sr  Sr0  1  0.250  0.131  0.119  1.0
  Sr  Sr1  1  0.750  0.869  0.881  1.0
  Sr  Sr2  1  0.250  0.631  0.381  1.0
  Sr  Sr3  1  0.750  0.369  0.619  1.0
  V  V4  1  0.250  0.742  0.091  1.0
  V  V5  1  0.750  0.258  0.909  1.0
  V  V6  1  0.250  0.242  0.409  1.0
  V  V7  1  0.750  0.758  0.591  1.0
  V  V8  1  0.250  0.504  0.871  1.0
  V  V9  1  0.750  0.496  0.129  1.0
  V  V10  1  0.750  0.996  0.372  1.0
  V  V11  1  0.250  0.004  0.628  1.0
  O  O12  1  0.250  0.894  0.025  1.0
  O  O13  1  0.750  0.106  0.975  1.0
  O  O14  1  0.250  0.394  0.475  1.0
  O  O15  1  0.750  0.606  0.525  1.0
  O  O16  1  0.250  0.779  0.216  1.0
  O  O17  1  0.750  0.221  0.784  1.0
  O  O18  1  0.250  0.279  0.284  1.0
  O  O19  1  0.750  0.721  0.716  1.0
  O  O20  1  0.250  0.532  0.092  1.0
  O  O21  1  0.750  0.468  0.908  1.0
  O  O22  1  0.250  0.032  0.408  1.0
  O  O23  1  0.750  0.968  0.592  1.0
  O  O24  1  0.750  0.826  0.394  1.0
  O  O25  1  0.250  0.174  0.606  1.0
  O  O26  1  0.750  0.326  0.106  1.0
  O  O27  1  0.250  0.674  0.894  1.0
  O  O28  1  0.750  0.025  0.243  1.0
  O  O29  1  0.250  0.975  0.757  1.0
  O  O30  1  0.250  0.308  0.932  1.0
  O  O31  1  0.250  0.476  0.742  1.0
  O  O32  1  0.750  0.192  0.432  1.0
  O  O33  1  0.250  0.808  0.568  1.0
  O  O34  1  0.750  0.692  0.068  1.0
  O  O35  1  0.750  0.524  0.258  1.0
[/CIF]
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