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The title compound, K8[{WVIO2(SO4)2}2(μ-SO4)2], precipitated from a melt of tungsten trioxide and potassium sulfate in potassium pyro­sulfate. The WVI coordination sphere in the independent K4[WVIO2(SO4)3] moiety is completed by inversion symmetry, resulting in a dimer with two bridging sulfate ligands and a unit cell with two dimeric units.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805007579/wm6051sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805007579/wm6051Isup2.hkl
Contains datablock I

Key indicators

  • Single-crystal X-ray study
  • T = 120 K
  • Mean [sigma](S-O) = 0.002 Å
  • R factor = 0.013
  • wR factor = 0.031
  • Data-to-parameter ratio = 12.4

checkCIF/PLATON results

No syntax errors found



Alert level C PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT220_ALERT_2_C Large Non-Solvent O Ueq(max)/Ueq(min) ... 2.99 Ratio PLAT430_ALERT_2_C Short Inter D...A Contact O1 .. O10 .. 2.90 Ang. PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 5 K
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 4 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 ALERT type 2 Indicator that the structure model may be wrong or deficient 0 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 2002); cell refinement: SAINT (Bruker, 2002); data reduction: SAINT; program(s) used to solve structure: SHELXTL (Bruker, 2002); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: CIFTAB in SHELX97-2 (Sheldrick, 2001).

Octapotassium di-µ-sulfato-κ2O:O'-bis[cis-dioxo-cis-disulfatotungstate(VI)] top
Crystal data top
K8[WO4(SO4)6]F(000) = 1240
Mr = 1320.86Dx = 3.266 Mg m3
Monoclinic, P21/nMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ynCell parameters from 5682 reflections
a = 9.4362 (5) Åθ = 2.5–28.0°
b = 13.9625 (7) ŵ = 10.38 mm1
c = 10.1948 (5) ÅT = 120 K
β = 90.780 (1)°Tabular, colorless
V = 1343.07 (12) Å30.18 × 0.10 × 0.05 mm
Z = 2
Data collection top
Bruker Platform/CCD
diffractometer
2458 independent reflections
Radiation source: normal-focus sealed tube2429 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.019
profile data from ω scansθmax = 25.3°, θmin = 2.5°
Absorption correction: integration
XPREP (Bruker, 2001)
h = 1111
Tmin = 0.245, Tmax = 0.619k = 1616
13095 measured reflectionsl = 1212
Refinement top
Refinement on F20 restraints
Least-squares matrix: fullPrimary atom site location: structure-invariant direct methods
R[F2 > 2σ(F2)] = 0.013Secondary atom site location: difference Fourier map
wR(F2) = 0.031 w = 1/[σ2(Fo2) + (0.0121P)2 + 2.1788P]
where P = (Fo2 + 2Fc2)/3
S = 1.13(Δ/σ)max = 0.001
2458 reflectionsΔρmax = 0.58 e Å3
199 parametersΔρmin = 0.44 e Å3
Special details top

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.

Refinement. Five frame series were filtered for statistical outliers then corrected for absorption by integration using SHELXTL/XPREP (Bruker, 2001) before using SAINT/SADABS (Bruker, 2002) to sort, merge, and scale the combined data. A series of identical frames was collected twice during the experiment to monitor decay. No decay correction was applied. Systematic conditions suggested the unambiguous space group. The structure was solved by direct methods (Sheldrick, 2001). The space group choice was confirmed by successful convergence of the full-matrix least-squares refinement on F2 (Sheldrick, 2001). The highest peaks in the final difference Fourier map were 0.98 Å and 0.87 Å from atoms W1 and O1, respectively; the deepest hole was 0.74 Å from S3. The final map had no other significant features. A final analysis of variance between observed and calculated structure factors showed no dependence on amplitude or resolution.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
W10.167155 (11)0.378486 (7)0.083299 (10)0.00768 (4)
S10.08697 (7)0.49756 (5)0.20754 (6)0.00853 (13)
S20.47796 (7)0.28010 (5)0.02132 (7)0.01076 (14)
S30.02707 (7)0.15499 (5)0.04722 (6)0.00912 (13)
O10.2338 (2)0.49339 (14)0.09336 (19)0.0153 (4)
O20.2094 (2)0.33519 (14)0.23580 (19)0.0137 (4)
O30.0958 (2)0.41250 (13)0.12018 (18)0.0115 (4)
O40.03432 (19)0.58184 (13)0.12471 (19)0.0114 (4)
O50.0130 (2)0.47739 (14)0.31210 (18)0.0135 (4)
O60.2256 (2)0.52544 (13)0.25320 (19)0.0130 (4)
O70.3270 (2)0.32171 (15)0.01132 (19)0.0166 (4)
O80.4858 (2)0.26308 (15)0.16109 (19)0.0178 (4)
O90.4873 (3)0.19490 (17)0.0578 (2)0.0308 (6)
O100.5747 (3)0.35493 (19)0.0166 (3)0.0338 (6)
O110.0556 (2)0.25956 (13)0.01147 (19)0.0133 (4)
O120.1453 (2)0.11950 (13)0.1276 (2)0.0160 (4)
O130.0135 (2)0.10445 (14)0.0768 (2)0.0181 (5)
O140.1057 (2)0.15340 (15)0.1199 (2)0.0167 (4)
K10.32372 (6)0.17573 (4)0.33893 (6)0.01357 (13)
K20.50716 (6)0.50475 (5)0.19847 (6)0.01533 (13)
K30.20905 (6)0.46053 (5)0.47727 (6)0.01602 (13)
K40.24597 (6)0.21985 (4)0.22989 (6)0.01415 (13)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
W10.00668 (6)0.00793 (6)0.00842 (7)0.00067 (4)0.00051 (4)0.00047 (4)
S10.0078 (3)0.0089 (3)0.0088 (3)0.0011 (2)0.0006 (2)0.0009 (3)
S20.0074 (3)0.0141 (3)0.0109 (3)0.0023 (3)0.0007 (2)0.0002 (3)
S30.0094 (3)0.0077 (3)0.0102 (3)0.0008 (3)0.0003 (3)0.0002 (3)
O10.0136 (10)0.0149 (10)0.0175 (11)0.0035 (8)0.0003 (8)0.0009 (8)
O20.0126 (10)0.0167 (10)0.0120 (10)0.0044 (8)0.0004 (8)0.0001 (8)
O30.0151 (10)0.0085 (9)0.0108 (10)0.0007 (8)0.0006 (8)0.0014 (8)
O40.0074 (9)0.0109 (10)0.0157 (10)0.0012 (8)0.0006 (7)0.0023 (8)
O50.0158 (10)0.0138 (10)0.0108 (10)0.0017 (8)0.0033 (8)0.0005 (8)
O60.0108 (10)0.0124 (9)0.0158 (10)0.0009 (8)0.0049 (8)0.0006 (8)
O70.0103 (10)0.0284 (12)0.0110 (10)0.0105 (9)0.0004 (8)0.0035 (9)
O80.0133 (10)0.0286 (12)0.0114 (10)0.0035 (9)0.0006 (8)0.0036 (9)
O90.0398 (15)0.0277 (13)0.0246 (13)0.0219 (11)0.0095 (11)0.0112 (10)
O100.0204 (13)0.0469 (15)0.0341 (14)0.0161 (11)0.0016 (10)0.0169 (12)
O110.0163 (10)0.0085 (9)0.0149 (10)0.0035 (8)0.0038 (8)0.0009 (8)
O120.0138 (11)0.0125 (10)0.0216 (11)0.0002 (8)0.0045 (9)0.0022 (8)
O130.0302 (12)0.0125 (10)0.0115 (10)0.0031 (9)0.0014 (9)0.0023 (8)
O140.0108 (10)0.0189 (11)0.0205 (11)0.0026 (8)0.0047 (8)0.0001 (9)
K10.0117 (3)0.0126 (3)0.0163 (3)0.0004 (2)0.0019 (2)0.0031 (2)
K20.0126 (3)0.0200 (3)0.0133 (3)0.0034 (2)0.0029 (2)0.0022 (2)
K30.0135 (3)0.0224 (3)0.0121 (3)0.0026 (3)0.0017 (2)0.0028 (3)
K40.0141 (3)0.0137 (3)0.0146 (3)0.0010 (2)0.0026 (2)0.0006 (2)
Geometric parameters (Å, º) top
W1—O11.7258 (19)O7—K42.743 (2)
W1—O21.7102 (19)O9—K42.877 (2)
W1—O32.2237 (19)O9—K3viii3.033 (2)
W1—O4i2.0302 (18)O10—K2iii2.799 (3)
W1—O71.9681 (19)O10—K1viii2.823 (3)
W1—O112.0930 (18)O10—K23.102 (3)
W1—K23.8311 (6)O11—K1v2.931 (2)
W1—K43.9646 (6)O11—K43.116 (2)
W1—K14.1090 (6)O12—K2ix2.802 (2)
S1—O51.441 (2)O12—K12.827 (2)
S1—O61.447 (2)O12—K3ix2.828 (2)
S1—O31.4861 (19)O13—K2v2.752 (2)
S1—O41.5349 (19)O13—K3v3.070 (2)
S2—O91.441 (2)O13—K43.152 (2)
S2—O101.443 (2)O14—K4x2.738 (2)
S2—O81.445 (2)O14—K3v2.762 (2)
S2—O71.5700 (19)O14—K2ix2.925 (2)
S2—K43.4505 (9)K1—O1ix2.695 (2)
S2—K23.6281 (9)K1—O10x2.823 (3)
S3—O131.452 (2)K1—O3iv2.873 (2)
S3—O121.462 (2)K1—O11iv2.931 (2)
S3—O141.464 (2)K1—O5iv3.063 (2)
S3—O111.5296 (19)K1—K34.3605 (9)
S3—K43.6369 (9)K2—O6iii2.610 (2)
O1—K1ii2.695 (2)K2—O13iv2.752 (2)
O1—K22.784 (2)K2—O10iii2.799 (3)
O2—K12.682 (2)K2—O12ii2.802 (2)
O8—K12.681 (2)K2—O14ii2.925 (2)
O6—K2iii2.610 (2)K2—K34.0732 (9)
O5—K3i2.632 (2)K3—O5i2.632 (2)
O8—K4iv2.692 (2)K3—O14iv2.762 (2)
O8—K23.401 (2)K3—O12ii2.828 (2)
O2—K33.020 (2)K3—O6xi2.896 (2)
O3—K1v2.873 (2)K3—O5xi3.029 (2)
O3—K43.246 (2)K3—O9x3.033 (2)
O4—W1i2.0302 (18)K3—O13iv3.070 (2)
O4—K4vi3.208 (2)K4—O8v2.692 (2)
O5—K3vii3.029 (2)K4—O6xii2.733 (2)
O5—K1v3.063 (2)K4—O14viii2.738 (2)
O6—K4vi2.733 (2)K4—O4xii3.208 (2)
O6—K3vii2.896 (2)
O2—W1—O1101.20 (9)O1ix—K1—K3136.63 (5)
O2—W1—O797.61 (9)O10x—K1—K375.97 (5)
O1—W1—O797.03 (9)O12—K1—K3110.60 (4)
O2—W1—O4i96.59 (8)O3iv—K1—K3124.70 (4)
O1—W1—O4i94.34 (9)O11iv—K1—K373.22 (4)
O7—W1—O4i159.71 (8)O5iv—K1—K3158.11 (4)
O2—W1—O1198.49 (9)W1—K1—K359.215 (12)
O1—W1—O11159.97 (8)O6iii—K2—O13iv73.89 (6)
O7—W1—O1183.92 (8)O6iii—K2—O1163.86 (6)
O4i—W1—O1179.70 (8)O13iv—K2—O1107.36 (7)
O2—W1—O3170.94 (8)O6iii—K2—O10iii120.78 (7)
O1—W1—O387.85 (8)O13iv—K2—O10iii160.39 (8)
O7—W1—O381.56 (8)O1—K2—O10iii62.55 (6)
O4i—W1—O382.13 (7)O6iii—K2—O12ii117.39 (6)
O11—W1—O372.45 (7)O13iv—K2—O12ii78.19 (6)
O2—W1—K272.55 (7)O1—K2—O12ii78.18 (6)
O1—W1—K241.49 (7)O10iii—K2—O12ii83.09 (7)
O7—W1—K272.03 (6)O6iii—K2—O14ii71.41 (6)
O4i—W1—K2126.40 (5)O13iv—K2—O14ii82.12 (6)
O11—W1—K2152.55 (5)O1—K2—O14ii124.68 (6)
O3—W1—K2115.43 (5)O10iii—K2—O14ii90.30 (7)
O2—W1—K4119.39 (6)O12ii—K2—O14ii49.84 (6)
O1—W1—K4119.67 (7)O6iii—K2—O1080.50 (6)
O7—W1—K439.36 (6)O13iv—K2—O10102.26 (6)
O4i—W1—K4120.43 (5)O1—K2—O1083.55 (6)
O11—W1—K451.24 (6)O10iii—K2—O1093.51 (8)
O3—W1—K454.96 (5)O12ii—K2—O10160.89 (6)
K2—W1—K4109.780 (13)O14ii—K2—O10149.23 (6)
O2—W1—K126.17 (7)O6iii—K2—O885.37 (6)
O1—W1—K1118.37 (7)O13iv—K2—O862.89 (6)
O7—W1—K176.23 (6)O1—K2—O881.21 (6)
O4i—W1—K1112.69 (5)O10iii—K2—O8127.21 (7)
O11—W1—K181.38 (5)O12ii—K2—O8127.45 (6)
O3—W1—K1147.20 (5)O14ii—K2—O8142.44 (6)
K2—W1—K180.229 (13)O10—K2—O842.64 (6)
K4—W1—K193.217 (13)O6iii—K2—S291.91 (5)
O5—S1—O6113.55 (12)O13iv—K2—S286.33 (5)
O5—S1—O3108.53 (11)O1—K2—S272.27 (4)
O6—S1—O3111.37 (11)O10iii—K2—S2104.89 (6)
O5—S1—O4110.08 (11)O12ii—K2—S2140.64 (5)
O6—S1—O4105.74 (11)O14ii—K2—S2161.80 (5)
O3—S1—O4107.39 (11)O10—K2—S223.11 (4)
O9—S2—O10113.86 (16)O8—K2—S223.45 (3)
O9—S2—O8114.42 (14)O6iii—K2—W1142.56 (5)
O10—S2—O8111.01 (14)O13iv—K2—W190.50 (5)
O9—S2—O7104.42 (13)O1—K2—W124.25 (4)
O10—S2—O7104.51 (14)O10iii—K2—W184.07 (5)
O8—S2—O7107.70 (11)O12ii—K2—W191.26 (4)
O9—S2—K454.98 (9)O14ii—K2—W1141.10 (4)
O10—S2—K4112.02 (11)O10—K2—W169.66 (4)
O8—S2—K4135.65 (9)O8—K2—W157.39 (3)
O7—S2—K450.82 (8)S2—K2—W152.554 (14)
O9—S2—K2171.05 (11)O6iii—K2—K3120.06 (5)
O10—S2—K257.54 (12)O13iv—K2—K348.89 (5)
O8—S2—K269.44 (9)O1—K2—K367.35 (4)
O7—S2—K281.26 (8)O10iii—K2—K3112.43 (6)
K4—S2—K2128.56 (2)O12ii—K2—K343.91 (4)
O13—S3—O12112.38 (13)O14ii—K2—K383.25 (4)
O13—S3—O14111.54 (13)O10—K2—K3122.77 (5)
O12—S3—O14111.29 (13)O8—K2—K383.53 (4)
O13—S3—O11105.67 (11)S2—K2—K399.66 (2)
O12—S3—O11108.77 (11)W1—K2—K363.939 (14)
O14—S3—O11106.83 (12)O5i—K3—O14iv163.90 (7)
O13—S3—K459.27 (9)O5i—K3—O12ii80.84 (6)
O12—S3—K494.73 (9)O14iv—K3—O12ii110.10 (6)
O14—S3—K4153.59 (9)O5i—K3—O6xi122.16 (6)
O11—S3—K458.24 (8)O14iv—K3—O6xi69.84 (6)
W1—O1—K1ii144.97 (10)O12ii—K3—O6xi95.33 (6)
W1—O1—K2114.26 (9)O5i—K3—O271.21 (6)
K1ii—O1—K292.09 (6)O14iv—K3—O295.02 (6)
W1—O2—K1137.50 (10)O12ii—K3—O298.09 (6)
W1—O2—K3122.23 (9)O6xi—K3—O2162.58 (6)
K1—O2—K399.58 (6)O5i—K3—O5xi86.61 (6)
S1—O3—W1138.03 (12)O14iv—K3—O5xi96.34 (6)
S1—O3—K1v102.32 (9)O12ii—K3—O5xi123.45 (6)
W1—O3—K1v107.61 (7)O6xi—K3—O5xi48.07 (5)
S1—O3—K4118.47 (10)O2—K3—O5xi129.14 (6)
W1—O3—K490.93 (6)O5i—K3—O9x71.47 (6)
K1v—O3—K489.32 (5)O14iv—K3—O9x94.63 (7)
S1—O4—W1i129.39 (11)O12ii—K3—O9x148.78 (6)
S1—O4—K4vi89.44 (8)O6xi—K3—O9x111.34 (6)
W1i—O4—K4vi123.03 (8)O2—K3—O9x59.85 (6)
S1—O5—K3i148.88 (12)O5xi—K3—O9x69.90 (6)
S1—O5—K3vii95.03 (9)O5i—K3—O13iv129.35 (6)
K3i—O5—K3vii93.39 (6)O14iv—K3—O13iv48.49 (6)
S1—O5—K1v95.34 (9)O12ii—K3—O13iv72.74 (6)
K3i—O5—K1v101.38 (6)O6xi—K3—O13iv102.98 (6)
K3vii—O5—K1v131.27 (7)O2—K3—O13iv70.79 (5)
S1—O6—K2iii139.68 (12)O5xi—K3—O13iv143.91 (6)
S1—O6—K4vi112.18 (10)O9x—K3—O13iv114.42 (7)
K2iii—O6—K4vi94.49 (6)O5i—K3—K289.42 (5)
S1—O6—K3vii100.59 (10)O14iv—K3—K290.94 (4)
K2iii—O6—K3vii101.05 (6)O12ii—K3—K243.40 (4)
K4vi—O6—K3vii104.78 (6)O6xi—K3—K2125.87 (4)
S2—O7—W1138.10 (12)O2—K3—K260.70 (4)
S2—O7—K4102.85 (9)O5xi—K3—K2166.82 (4)
W1—O7—K4113.58 (8)O9x—K3—K2120.55 (5)
S2—O8—K1135.99 (12)O13iv—K3—K242.49 (4)
S2—O8—K4iv115.26 (11)O5i—K3—K1105.59 (5)
K1—O8—K4iv106.65 (7)O14iv—K3—K159.14 (5)
S2—O8—K287.11 (9)O12ii—K3—K1118.00 (5)
K1—O8—K2114.14 (7)O6xi—K3—K1125.59 (4)
K4iv—O8—K279.26 (5)O2—K3—K137.34 (4)
S2—O9—K4100.81 (11)O5xi—K3—K1118.50 (4)
S2—O9—K3viii124.91 (13)O9x—K3—K158.88 (5)
K4—O9—K3viii134.25 (8)O13iv—K3—K155.63 (4)
S2—O10—K2iii120.94 (13)K2—K3—K174.678 (16)
S2—O10—K1viii124.31 (16)O8v—K4—O6xii98.73 (6)
K2iii—O10—K1viii89.11 (7)O8v—K4—O14viii100.49 (7)
S2—O10—K299.35 (13)O6xii—K4—O14viii123.73 (6)
K2iii—O10—K286.49 (8)O8v—K4—O7122.14 (6)
K1viii—O10—K2130.64 (9)O6xii—K4—O7122.65 (6)
S3—O11—W1139.75 (12)O14viii—K4—O788.87 (6)
S3—O11—K1v107.75 (9)O8v—K4—O9166.53 (7)
W1—O11—K1v109.46 (7)O6xii—K4—O980.82 (6)
S3—O11—K497.09 (9)O14viii—K4—O990.75 (7)
W1—O11—K497.17 (7)O7—K4—O950.05 (6)
K1v—O11—K490.84 (5)O8v—K4—O1177.17 (6)
S3—O12—K2ix98.86 (10)O6xii—K4—O11106.54 (6)
S3—O12—K1140.80 (11)O14viii—K4—O11129.15 (6)
K2ix—O12—K188.97 (6)O7—K4—O1154.81 (6)
S3—O12—K3ix115.18 (11)O9—K4—O1190.00 (6)
K2ix—O12—K3ix92.68 (6)O8v—K4—O1367.22 (6)
K1—O12—K3ix102.63 (7)O6xii—K4—O1366.00 (6)
S3—O13—K2v174.14 (13)O14viii—K4—O13166.38 (6)
S3—O13—K3v93.38 (10)O7—K4—O1392.92 (6)
K2v—O13—K3v88.62 (6)O9—K4—O13100.75 (7)
S3—O13—K497.41 (10)O11—K4—O1344.56 (5)
K2v—O13—K483.01 (6)O8v—K4—O4xii116.99 (6)
K3v—O13—K4154.06 (8)O6xii—K4—O4xii46.34 (5)
S3—O14—K4x136.11 (12)O14viii—K4—O4xii77.95 (6)
S3—O14—K3v106.39 (11)O7—K4—O4xii120.80 (6)
K4x—O14—K3v110.00 (7)O9—K4—O4xii72.42 (6)
S3—O14—K2ix93.68 (10)O11—K4—O4xii148.74 (5)
K4x—O14—K2ix105.37 (7)O13—K4—O4xii112.34 (5)
K3v—O14—K2ix96.78 (6)O8v—K4—O370.66 (6)
O8—K1—O265.63 (6)O6xii—K4—O3152.66 (6)
O8—K1—O1ix136.19 (7)O14viii—K4—O383.46 (6)
O2—K1—O1ix143.43 (6)O7—K4—O353.75 (5)
O8—K1—O10x155.28 (7)O9—K4—O3103.65 (6)
O2—K1—O10x89.85 (7)O11—K4—O347.26 (5)
O1ix—K1—O10x63.32 (7)O13—K4—O386.73 (5)
O8—K1—O1287.15 (6)O4xii—K4—O3160.88 (5)
O2—K1—O1272.53 (6)O8v—K4—S2148.30 (5)
O1ix—K1—O1279.22 (6)O6xii—K4—S2103.12 (5)
O10x—K1—O1282.20 (7)O14viii—K4—S286.20 (5)
O8—K1—O3iv77.08 (6)O7—K4—S226.33 (4)
O2—K1—O3iv140.05 (6)O9—K4—S224.21 (4)
O1ix—K1—O3iv74.96 (6)O11—K4—S274.77 (4)
O10x—K1—O3iv127.43 (7)O13—K4—S2101.30 (4)
O12—K1—O3iv120.87 (6)O4xii—K4—S294.70 (4)
O8—K1—O11iv80.65 (6)O3—K4—S279.51 (4)
O2—K1—O11iv105.80 (6)O8v—K4—S379.53 (5)
O1ix—K1—O11iv106.79 (6)O6xii—K4—S381.90 (4)
O10x—K1—O11iv110.70 (7)O14viii—K4—S3153.59 (5)
O12—K1—O11iv167.08 (6)O7—K4—S369.70 (5)
O3iv—K1—O11iv52.18 (5)O9—K4—S387.09 (6)
O8—K1—O5iv71.46 (6)O11—K4—S324.67 (4)
O2—K1—O5iv125.78 (6)O13—K4—S323.32 (4)
O1ix—K1—O5iv64.78 (6)O4xii—K4—S3125.93 (4)
O10x—K1—O5iv125.77 (7)O3—K4—S371.54 (4)
O12—K1—O5iv73.83 (6)S2—K4—S381.11 (2)
O3iv—K1—O5iv47.07 (5)O8v—K4—W195.92 (5)
O11iv—K1—O5iv98.06 (5)O6xii—K4—W1128.70 (4)
O8—K1—W157.40 (4)O14viii—K4—W1101.09 (5)
O2—K1—W116.33 (4)O7—K4—W127.06 (4)
O1ix—K1—W1137.85 (5)O9—K4—W174.46 (5)
O10x—K1—W198.09 (6)O11—K4—W131.59 (3)
O12—K1—W160.18 (4)O13—K4—W175.37 (4)
O3iv—K1—W1134.46 (4)O4xii—K4—W1146.84 (4)
O11iv—K1—W1115.29 (4)O3—K4—W134.11 (3)
O5iv—K1—W1109.94 (4)S2—K4—W152.420 (14)
O8—K1—K387.15 (5)S3—K4—W153.042 (14)
O2—K1—K343.08 (4)
Symmetry codes: (i) x, y+1, z; (ii) x+1/2, y+1/2, z+1/2; (iii) x+1, y+1, z; (iv) x+1/2, y+1/2, z+1/2; (v) x1/2, y+1/2, z1/2; (vi) x+1/2, y+1/2, z1/2; (vii) x, y, z1; (viii) x+1/2, y+1/2, z1/2; (ix) x+1/2, y1/2, z+1/2; (x) x1/2, y+1/2, z+1/2; (xi) x, y, z+1; (xii) x+1/2, y1/2, z1/2.
 

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