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Microporous VSH-13Na of composition Na2(VO)(Si4O10)·3H2O was synthesized under mild hydro­thermal conditions and studied by single-crystal X-ray diffraction at room temperature and 398 K. Its vanadosilicate framework, consisting of sheets of silicate tetrahedra connected by vanadyl-type square-based pyramids, closely resembles that of the mineral cavansite, Ca(VO)(Si4O10)·4H2O. Due to the disorder in the orientation of the short apical vanadyl groups, the topological symmetry of VSH-13Na was originally described in space group Imma. However, when analysing the systematic absences in our dataset, only the 21 screw axis along b was strictly fulfilled suggesting monoclinic space group P1211. The resulting structure in P21 with a = 14.364 (4), b = 9.134 (2), c = 10.373 (3) Å, β = 90.056 (7)°, V = 1360.9 (7) Å3 was interpreted as a case of allotwinning of two polytypes with topologically idealized orthorhombic symmetry: A (∼62%) with antiparallel orientation of the vanadyl groups in adjacent (100) layers and B (∼38%) with all vanadyl groups in adjacent layers oriented in the same way. At 398 K, the structure of VSH-13Na became fully dehydrated and adopted the unit-cell parameters a = 12.584 (16), b = 9.525 (13), c = 9.696 (14) Å, β = 90.10 (4)°, V = 1162 (3) Å3 (space group P21). Release of H2O caused severe contraction of T—O—T angles and the unit-cell volume decreased by ∼15%. Despite their structural similarity, the VSH-13Na framework seems to be more flexible upon dehydration compared with cavansite, whose structure collapsed before removal of the last H2O molecule. Thus, the presence of monovalent or divalent extraframework cations plays a key role in the dehydration process of natural and synthetic vanadosilicates.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S2052520618011423/lo5030sup1.cif
Contains datablocks global, I, II, III

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S2052520618011423/lo5030Isup2.hkl
Contains datablock I

pdf

Portable Document Format (PDF) file https://doi.org/10.1107/S2052520618011423/lo5030sup3.pdf
Supplementary material

CCDC references: 1861363; 1863348; 1863349

Computing details top

Program(s) used to solve structure: SHELXT 2014/5 (Sheldrick, 2014) for (I). For all structures, program(s) used to refine structure: SHELXL2018/3 (Sheldrick, 2018).

(I) top
Crystal data top
H0Na2O14Si4VF(000) = 852
Mr = 433.28Dx = 2.122 Mg m3
Monoclinic, P21Mo Kα radiation, λ = 0.71073 Å
a = 14.3328 (7) ÅCell parameters from 29173 reflections
b = 9.1209 (4) Åθ = 1.6–26.4°
c = 10.3732 (5) ŵ = 1.22 mm1
β = 90.007 (2)°T = 304 K
V = 1356.07 (11) Å3Prismatic, blue
Z = 40.10 × 0.05 × 0.03 mm
Data collection top
Bruker D8 Venture
diffractometer
Rint = 0.078
Absorption correction: multi-scan
(SADABS; Bruker, 2003)
θmax = 26.4°, θmin = 2.2°
h = 1717
29173 measured reflectionsk = 1111
5549 independent reflectionsl = 1212
4686 reflections with I > 2σ(I)
Refinement top
Refinement on F2H-atom parameters not defined
Least-squares matrix: full w = 1/[σ2(Fo2) + (0.1155P)2 + 43.7061P]
where P = (Fo2 + 2Fc2)/3
R[F2 > 2σ(F2)] = 0.110(Δ/σ)max = 0.015
wR(F2) = 0.287Δρmax = 2.18 e Å3
S = 1.05Δρmin = 2.63 e Å3
5549 reflectionsExtinction correction: SHELXL-2018/3 (Sheldrick 2018), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4
188 parametersExtinction coefficient: 0.030 (4)
81 restraintsAbsolute structure: Twinning involves inversion, so Flack parameter cannot be determined
Special details top

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

Refinement. Refined as a 2-component inversion twin.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
V10.0023 (3)0.7464 (5)0.0285 (4)0.0125 (6)
V20.5002 (5)0.1236 (9)0.4607 (6)0.0125 (6)0.625
V2A0.4975 (9)0.2346 (13)0.5177 (9)0.0125 (6)0.375
Si10.2096 (5)0.6161 (9)0.1163 (7)0.0152 (5)
Si20.1976 (5)0.7784 (9)0.1164 (7)0.0152 (5)
Si30.1943 (5)0.1183 (9)0.8558 (7)0.0152 (5)
Si40.2058 (5)0.2788 (9)1.0972 (7)0.0152 (5)
Si50.2955 (5)0.1003 (9)0.5991 (7)0.0152 (5)
Si60.3051 (5)0.2592 (9)0.3508 (7)0.0152 (5)
Si70.2982 (5)0.7562 (9)0.6223 (7)0.0152 (5)
Si80.3068 (5)0.6001 (9)0.3647 (6)0.0152 (5)
Na110.0075 (10)0.4460 (13)0.2158 (15)0.0298 (14)
Na120.4879 (10)0.9272 (14)0.7138 (15)0.0298 (14)
Na210.0125 (11)0.5811 (18)0.2577 (14)0.039 (2)
Na220.498 (2)0.292 (4)0.773 (2)0.039 (2)0.622
Na2A0.512 (3)0.286 (5)0.720 (4)0.039 (2)0.378
O110.0985 (11)0.239 (2)1.1105 (19)0.0169 (11)
O120.0851 (11)0.139 (2)0.8610 (18)0.0169 (11)
O130.4059 (11)0.116 (2)0.6069 (18)0.0169 (11)
O140.4136 (11)0.228 (2)0.3464 (17)0.0169 (11)
O150.4172 (11)0.625 (2)0.3767 (18)0.0169 (11)
O160.4120 (11)0.744 (2)0.6196 (16)0.0169 (11)
O170.0856 (11)0.751 (3)0.1170 (19)0.0169 (11)
O180.1026 (11)0.650 (2)0.1374 (17)0.0169 (11)
O210.2651 (13)0.0704 (17)0.6047 (17)0.0184 (16)
O220.2232 (14)0.0489 (17)0.8693 (17)0.0184 (16)
O230.2291 (13)0.4495 (17)1.0833 (18)0.0184 (16)
O240.2741 (14)0.4294 (17)0.3789 (17)0.0184 (16)
O310.2408 (15)0.176 (2)0.7220 (17)0.0241 (19)
O320.2599 (15)0.206 (2)0.2153 (17)0.0241 (19)
O330.2466 (14)0.697 (2)0.2413 (16)0.0241 (19)
O340.2650 (14)0.671 (2)0.2381 (16)0.0241 (19)
O410.2530 (12)0.6799 (18)0.4838 (15)0.0166 (16)
O420.2486 (11)0.723 (2)0.0134 (15)0.0166 (16)
O430.2481 (12)0.204 (2)0.9689 (17)0.0166 (16)
O440.2513 (12)0.168 (2)0.4665 (16)0.0166 (16)
OV10.001 (2)0.9088 (19)0.0846 (19)0.026 (5)
OV20.494 (2)0.437 (3)0.579 (2)0.050 (8)
OW10.033 (2)0.289 (4)0.404 (3)0.066 (6)*
OW20.499 (3)1.046 (3)0.916 (3)0.066 (6)*
OW30.107 (2)0.390 (4)0.364 (3)0.060 (3)*
OW40.390 (2)0.426 (4)0.865 (3)0.060 (3)*
OW50.114 (2)0.443 (4)0.374 (3)0.060 (3)*
OW60.620 (2)0.439 (4)0.855 (3)0.060 (3)*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
V10.0065 (10)0.0213 (12)0.0097 (12)0.0000.0000.0014 (10)
V20.0065 (10)0.0213 (12)0.0097 (12)0.0000.0000.0014 (10)
V2A0.0065 (10)0.0213 (12)0.0097 (12)0.0000.0000.0014 (10)
Si10.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si20.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si30.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si40.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si50.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si60.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si70.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Si80.0111 (8)0.0173 (8)0.0173 (10)0.0032 (10)0.0041 (7)0.0116 (10)
Na110.019 (3)0.024 (3)0.047 (4)0.0000.0000.000
Na120.019 (3)0.024 (3)0.047 (4)0.0000.0000.000
Na210.038 (5)0.051 (4)0.028 (6)0.0000.0000.004 (5)
Na220.038 (5)0.051 (4)0.028 (6)0.0000.0000.004 (5)
Na2A0.038 (5)0.051 (4)0.028 (6)0.0000.0000.009 (19)
O110.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O120.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O130.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O140.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O150.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O160.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O170.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O180.012 (2)0.025 (2)0.014 (2)0.008 (3)0.0035 (18)0.008 (3)
O210.025 (3)0.020 (3)0.010 (4)0.0000.008 (3)0.000
O220.025 (3)0.020 (3)0.010 (4)0.0000.008 (3)0.000
O230.025 (3)0.020 (3)0.010 (4)0.0000.008 (3)0.000
O240.025 (3)0.020 (3)0.010 (4)0.0000.008 (3)0.000
O310.037 (4)0.014 (3)0.020 (5)0.0000.014 (3)0.000
O320.037 (4)0.014 (3)0.020 (5)0.0000.014 (3)0.000
O330.037 (4)0.014 (3)0.020 (5)0.0000.014 (3)0.000
O340.037 (4)0.014 (3)0.020 (5)0.0000.014 (3)0.000
O410.009 (3)0.023 (4)0.019 (4)0.0000.0000.008 (5)
O420.009 (3)0.023 (4)0.019 (4)0.0000.0000.008 (5)
O430.009 (3)0.023 (4)0.019 (4)0.0000.0000.008 (5)
O440.009 (3)0.023 (4)0.019 (4)0.0000.0000.008 (5)
OV10.060 (14)0.002 (7)0.016 (9)0.0000.0000.000
OV20.026 (12)0.10 (2)0.028 (13)0.0000.0000.000
Geometric parameters (Å, º) top
V1—OV11.592 (19)Si5—O441.636 (17)
V1—O171.924 (18)Si5—O311.649 (16)
V1—O12i1.961 (18)Si5—Na12iv3.393 (16)
V1—O182.030 (18)Si6—O141.582 (16)
V1—O11i2.042 (19)Si6—O321.621 (17)
V1—Na11ii3.123 (15)Si6—O241.641 (17)
V1—Na213.336 (15)Si6—O441.650 (17)
V1—Na113.360 (15)Si6—Na12iii3.406 (16)
V2—V2A1.174 (14)Si7—O161.635 (16)
V2—OV2iii1.75 (3)Si7—O21ix1.661 (17)
V2—O16iii1.86 (2)Si7—O33viii1.686 (16)
V2—O141.961 (19)Si7—O411.723 (16)
V2—O132.033 (18)Si7—Na123.274 (17)
V2—O15iii2.060 (19)Si8—O341.580 (17)
V2—Na2A3.08 (4)Si8—O151.604 (17)
V2—Na12iv3.184 (16)Si8—O411.629 (16)
V2—Na12iii3.313 (16)Si8—O241.632 (17)
V2—Na223.59 (3)Si8—Na2Ax3.22 (4)
V2—Na2Aiii3.61 (5)Si8—Na12iii3.437 (16)
V2A—O15iii1.92 (2)Na11—O12i2.34 (2)
V2A—O16iii1.93 (2)Na11—OW12.45 (4)
V2A—O131.94 (2)Na11—O182.45 (2)
V2A—OV21.95 (3)Na11—O17xi2.45 (2)
V2A—O142.15 (2)Na11—O11v2.54 (2)
V2A—Na2A2.16 (4)Na11—Na21xi3.36 (2)
V2A—Na222.70 (3)Na12—O162.22 (2)
V2A—Na12iii2.982 (18)Na12—O13ix2.36 (2)
V2A—Na12iv3.467 (18)Na12—OW22.36 (4)
Si1—O421.548 (16)Na12—O14x2.39 (2)
Si1—O341.572 (17)Na12—O15x2.45 (2)
Si1—O181.580 (16)Na12—Na2Aix3.29 (5)
Si1—O23v1.583 (17)Na12—Na22ix3.38 (4)
Si1—Si22.837 (10)Na21—OV1xi2.39 (2)
Si1—Na113.444 (16)Na21—O11i2.43 (2)
Si2—O421.615 (15)Na21—OW1ii2.45 (4)
Si2—O22vi1.624 (17)Na21—OW32.47 (4)
Si2—O171.625 (16)Na21—OW52.52 (4)
Si2—O331.652 (16)Na21—O172.55 (3)
Si2—Na11ii3.470 (16)Na22—Na2A0.59 (4)
Si3—O121.578 (16)Na22—OW42.19 (4)
Si3—O221.587 (17)Na22—OW62.37 (5)
Si3—O431.607 (17)Na22—OV22.42 (4)
Si3—O311.627 (16)Na22—O15iii2.49 (3)
Si3—Na11vii3.375 (16)Na22—OW2iv2.68 (4)
Si4—O111.587 (16)Na22—O132.70 (4)
Si4—O32viii1.593 (17)Na2A—OV22.03 (5)
Si4—O231.599 (16)Na2A—O15iii2.05 (5)
Si4—O431.613 (16)Na2A—O132.47 (5)
Si4—Na11viii3.453 (16)Na2A—OW62.51 (6)
Si5—O131.590 (16)Na2A—OW42.64 (5)
Si5—O211.618 (17)Na2A—OW2iv2.99 (6)
OV1—V1—O17106.0 (11)O16—Na12—OW2140.3 (11)
OV1—V1—O12i104.1 (11)O13ix—Na12—OW296.7 (11)
O17—V1—O12i149.9 (10)O16—Na12—O14x66.4 (7)
OV1—V1—O18102.0 (11)O13ix—Na12—O14x136.7 (10)
O17—V1—O1890.3 (8)OW2—Na12—O14x122.7 (11)
O12i—V1—O1884.8 (7)O16—Na12—O15x131.2 (9)
OV1—V1—O11i106.3 (12)O13ix—Na12—O15x63.8 (6)
O17—V1—O11i83.4 (7)OW2—Na12—O15x87.9 (10)
O12i—V1—O11i86.8 (8)O14x—Na12—O15x97.6 (8)
O18—V1—O11i151.7 (8)O16—Na12—V2Ax40.3 (5)
OV1—V1—Na11ii75.8 (8)O13ix—Na12—V2Ax94.9 (8)
O17—V1—Na11ii51.7 (7)OW2—Na12—V2Ax168.1 (11)
O12i—V1—Na11ii137.5 (6)O14x—Na12—V2Ax45.5 (5)
O18—V1—Na11ii137.4 (6)O15x—Na12—V2Ax94.9 (7)
O11i—V1—Na11ii54.2 (6)O16—Na12—V2ix95.1 (7)
OV1—V1—Na21138.2 (8)O13ix—Na12—V2ix39.6 (5)
O17—V1—Na2149.5 (6)OW2—Na12—V2ix118.0 (9)
O12i—V1—Na21104.7 (7)O14x—Na12—V2ix100.4 (7)
O18—V1—Na21110.2 (6)O15x—Na12—V2ix40.3 (5)
O11i—V1—Na2146.5 (6)V2Ax—Na12—V2ix70.3 (4)
Na11ii—V1—Na2162.5 (4)O16—Na12—Si726.8 (5)
OV1—V1—Na11123.2 (7)O13ix—Na12—Si778.3 (6)
O17—V1—Na11117.1 (7)OW2—Na12—Si7122.2 (10)
O12i—V1—Na1143.0 (6)O14x—Na12—Si793.0 (6)
O18—V1—Na1146.3 (6)O15x—Na12—Si7134.5 (7)
O11i—V1—Na11113.4 (6)V2Ax—Na12—Si762.9 (4)
Na11ii—V1—Na11161.0 (3)V2ix—Na12—Si794.3 (5)
Na21—V1—Na1198.5 (4)O16—Na12—Na2Aix144.1 (11)
V2A—V2—OV2iii163.2 (11)O13ix—Na12—Na2Aix48.5 (9)
V2A—V2—O16iii75.0 (9)OW2—Na12—Na2Aix61.3 (11)
OV2iii—V2—O16iii115.6 (11)O14x—Na12—Na2Aix134.4 (10)
V2A—V2—O1482.3 (9)O15x—Na12—Na2Aix38.3 (8)
OV2iii—V2—O14111.1 (12)V2Ax—Na12—Na2Aix126.4 (9)
O16iii—V2—O1482.7 (8)V2ix—Na12—Na2Aix56.7 (7)
V2A—V2—O1368.4 (9)Si7—Na12—Na2Aix124.6 (9)
OV2iii—V2—O1399.9 (11)O16—Na12—V2x32.4 (5)
O16iii—V2—O13143.4 (9)O13ix—Na12—V2x112.2 (8)
O14—V2—O1392.7 (8)OW2—Na12—V2x149.7 (10)
V2A—V2—O15iii66.5 (9)O14x—Na12—V2x35.8 (5)
OV2iii—V2—O15iii99.7 (11)O15x—Na12—V2x112.2 (7)
O16iii—V2—O15iii88.5 (8)V2Ax—Na12—V2x20.6 (3)
O14—V2—O15iii148.8 (10)V2ix—Na12—V2x91.0 (4)
O13—V2—O15iii76.8 (7)Si7—Na12—V2x59.1 (3)
V2A—V2—Na2A31.3 (11)Na2Aix—Na12—V2x146.7 (9)
OV2iii—V2—Na2A132.0 (12)O16—Na12—Na22ix147.2 (9)
O16iii—V2—Na2A94.0 (11)O13ix—Na12—Na22ix52.4 (7)
O14—V2—Na2A109.3 (11)OW2—Na12—Na22ix52.1 (9)
O13—V2—Na2A53.2 (10)O14x—Na12—Na22ix140.6 (9)
O15iii—V2—Na2A41.3 (10)O15x—Na12—Na22ix47.4 (7)
V2A—V2—Na12iv93.9 (6)V2Ax—Na12—Na22ix136.2 (7)
OV2iii—V2—Na12iv69.4 (9)V2ix—Na12—Na22ix66.1 (5)
O16iii—V2—Na12iv137.4 (7)Si7—Na12—Na22ix123.7 (7)
O14—V2—Na12iv137.4 (6)Na2Aix—Na12—Na22ix10.1 (7)
O13—V2—Na12iv47.8 (6)V2x—Na12—Na22ix156.7 (7)
O15iii—V2—Na12iv50.2 (7)O16—Na12—Si5ix78.4 (6)
Na2A—V2—Na12iv63.4 (9)O13ix—Na12—Si5ix24.7 (4)
V2A—V2—Na12iii63.6 (6)OW2—Na12—Si5ix98.9 (10)
OV2iii—V2—Na12iii133.0 (9)O14x—Na12—Si5ix138.1 (7)
O16iii—V2—Na12iii39.7 (6)O15x—Na12—Si5ix88.5 (6)
O14—V2—Na12iii45.4 (7)V2Ax—Na12—Si5ix92.8 (5)
O13—V2—Na12iii118.1 (7)V2ix—Na12—Si5ix59.6 (3)
O15iii—V2—Na12iii114.4 (7)Si7—Na12—Si5ix56.3 (3)
Na2A—V2—Na12iii94.2 (10)Na2Aix—Na12—Si5ix68.3 (8)
Na12iv—V2—Na12iii157.5 (4)V2x—Na12—Si5ix103.9 (5)
V2A—V2—Na2234.5 (7)Na22ix—Na12—Si5ix68.9 (6)
OV2iii—V2—Na22128.8 (11)OV1xi—Na21—O11i87.3 (9)
O16iii—V2—Na2299.2 (8)OV1xi—Na21—OW1ii169.5 (12)
O14—V2—Na22109.4 (8)O11i—Na21—OW1ii82.6 (11)
O13—V2—Na2248.2 (7)OV1xi—Na21—OW384.7 (11)
O15iii—V2—Na2242.6 (7)O11i—Na21—OW3114.8 (11)
Na2A—V2—Na225.2 (11)OW1ii—Na21—OW3101.9 (12)
Na12iv—V2—Na2259.6 (6)OV1xi—Na21—OW589.0 (12)
Na12iii—V2—Na2297.9 (6)O11i—Na21—OW5164.1 (12)
V2A—V2—Na2Aiii175.1 (10)OW1ii—Na21—OW5100.0 (12)
OV2iii—V2—Na2Aiii18.7 (11)OW3—Na21—OW580.2 (12)
O16iii—V2—Na2Aiii107.6 (9)OV1xi—Na21—O1786.0 (9)
O14—V2—Na2Aiii93.9 (9)O11i—Na21—O1764.0 (6)
O13—V2—Na2Aiii108.9 (9)OW1ii—Na21—O1787.2 (11)
O15iii—V2—Na2Aiii117.3 (9)OW3—Na21—O17170.7 (11)
Na2A—V2—Na2Aiii150.2 (12)OW5—Na21—O17100.4 (11)
Na12iv—V2—Na2Aiii86.9 (7)OV1xi—Na21—V167.9 (6)
Na12iii—V2—Na2Aiii115.6 (7)O11i—Na21—V137.5 (5)
Na22—V2—Na2Aiii146.5 (7)OW1ii—Na21—V1102.1 (10)
V2—V2A—O15iii79.4 (9)OW3—Na21—V1138.7 (10)
V2—V2A—O16iii69.0 (8)OW5—Na21—V1127.4 (10)
O15iii—V2A—O16iii90.8 (9)O17—Na21—V135.0 (4)
V2—V2A—O1377.3 (10)OV1xi—Na21—Na11ii123.5 (7)
O15iii—V2A—O1382.4 (9)O11i—Na21—Na11ii48.9 (6)
O16iii—V2A—O13146.3 (11)OW1ii—Na21—Na11ii46.7 (9)
V2—V2A—OV2168.6 (11)OW3—Na21—Na11ii140.3 (10)
O15iii—V2A—OV2109.0 (11)OW5—Na21—Na11ii122.8 (11)
O16iii—V2A—OV2102.6 (11)O17—Na21—Na11ii46.6 (6)
O13—V2A—OV2110.9 (11)V1—Na21—Na11ii55.6 (4)
V2—V2A—O1464.9 (8)Na2A—Na22—OW4135 (7)
O15iii—V2A—O14144.3 (10)Na2A—Na22—OW697 (6)
O16iii—V2A—O1476.5 (7)OW4—Na22—OW693.0 (16)
O13—V2A—O1490.0 (9)Na2A—Na22—OV244 (6)
OV2—V2A—O14106.3 (11)OW4—Na22—OV292.3 (15)
V2—V2A—Na2A132.3 (16)OW6—Na22—OV290.2 (15)
O15iii—V2A—Na2A59.8 (14)Na2A—Na22—O15iii36 (6)
O16iii—V2A—Na2A129.9 (14)OW4—Na22—O15iii163.3 (16)
O13—V2A—Na2A73.9 (14)OW6—Na22—O15iii101.8 (14)
OV2—V2A—Na2A58.9 (15)OV2—Na22—O15iii79.9 (11)
O14—V2A—Na2A149.9 (14)Na2A—Na22—OW2iv116 (7)
V2—V2A—Na22131.3 (10)OW4—Na22—OW2iv103.6 (15)
O15iii—V2A—Na2262.7 (9)OW6—Na22—OW2iv105.6 (15)
O16iii—V2A—Na22135.7 (10)OV2—Na22—OW2iv156.7 (16)
O13—V2A—Na2268.8 (9)O15iii—Na22—OW2iv80.2 (13)
OV2—V2A—Na2260.0 (11)Na2A—Na22—O1362 (6)
O14—V2A—Na22144.9 (9)OW4—Na22—O13105.5 (14)
Na2A—V2A—Na225.8 (15)OW6—Na22—O13158.0 (14)
V2—V2A—Na12iii95.8 (6)OV2—Na22—O1377.4 (11)
O15iii—V2A—Na12iii136.1 (8)O15iii—Na22—O1358.5 (8)
O16iii—V2A—Na12iii48.2 (7)OW2iv—Na22—O1381.9 (13)
O13—V2A—Na12iii139.6 (8)Na2A—Na22—V2A22 (6)
OV2—V2A—Na12iii72.9 (9)OW4—Na22—V2A122.3 (15)
O14—V2A—Na12iii52.4 (6)OW6—Na22—V2A117.4 (13)
Na2A—V2A—Na12iii130.4 (15)OV2—Na22—V2A44.5 (8)
Na22—V2A—Na12iii132.6 (8)O15iii—Na22—V2A43.2 (7)
V2—V2A—Na12iv66.3 (6)OW2iv—Na22—V2A112.3 (13)
O15iii—V2A—Na12iv43.1 (7)O13—Na22—V2A42.1 (6)
O16iii—V2A—Na12iv119.6 (8)Na2A—Na22—Na12iv76 (7)
O13—V2A—Na12iv40.6 (6)OW4—Na22—Na12iv126.8 (15)
OV2—V2A—Na12iv125.0 (9)OW6—Na22—Na12iv130.7 (14)
O14—V2A—Na12iv116.1 (7)OV2—Na22—Na12iv112.8 (12)
Na2A—V2A—Na12iv67.0 (14)O15iii—Na22—Na12iv46.2 (8)
Na22—V2A—Na12iv65.1 (8)OW2iv—Na22—Na12iv44.0 (9)
Na12iii—V2A—Na12iv162.1 (5)O13—Na22—Na12iv43.9 (7)
O42—Si1—O3499.9 (10)V2A—Na22—Na12iv68.4 (8)
O42—Si1—O18108.8 (10)Na2A—Na22—V228 (6)
O34—Si1—O18108.5 (11)OW4—Na22—V2129.8 (14)
O42—Si1—O23v113.0 (11)OW6—Na22—V2123.9 (12)
O34—Si1—O23v112.9 (11)OV2—Na22—V258.7 (9)
O18—Si1—O23v112.9 (11)O15iii—Na22—V234.0 (5)
O42—Si1—Si226.8 (6)OW2iv—Na22—V298.1 (11)
O34—Si1—Si2123.3 (8)O13—Na22—V234.2 (5)
O18—Si1—Si287.5 (8)V2A—Na22—V214.2 (4)
O23v—Si1—Si2109.1 (8)Na12iv—Na22—V254.3 (5)
O42—Si1—Na11142.5 (7)Na22—Na2A—OV2125 (8)
O34—Si1—Na11109.0 (9)Na22—Na2A—O15iii134 (8)
O18—Si1—Na1139.7 (8)OV2—Na2A—O15iii101.4 (19)
O23v—Si1—Na1177.3 (8)Na22—Na2A—V2A153 (7)
Si2—Si1—Na11116.0 (4)OV2—Na2A—V2A55.4 (13)
O42—Si2—O22vi106.2 (10)O15iii—Na2A—V2A54.3 (12)
O42—Si2—O17113.6 (10)Na22—Na2A—O13106 (7)
O22vi—Si2—O17112.0 (12)OV2—Na2A—O1390.2 (17)
O42—Si2—O33108.6 (10)O15iii—Na2A—O1367.7 (14)
O22vi—Si2—O33105.7 (9)V2A—Na2A—O1348.9 (10)
O17—Si2—O33110.3 (11)Na22—Na2A—OW670 (6)
O42—Si2—Si125.6 (6)OV2—Na2A—OW696 (2)
O22vi—Si2—Si1124.7 (8)O15iii—Na2A—OW6112 (2)
O17—Si2—Si188.9 (8)V2A—Na2A—OW6136 (2)
O33—Si2—Si1114.0 (8)O13—Na2A—OW6174 (2)
O42—Si2—Na11ii140.4 (7)Na22—Na2A—OW436 (6)
O22vi—Si2—Na11ii74.8 (8)OV2—Na2A—OW490 (2)
O17—Si2—Na11ii39.7 (9)O15iii—Na2A—OW4163 (3)
O33—Si2—Na11ii109.0 (8)V2A—Na2A—OW4126 (2)
Si1—Si2—Na11ii122.3 (4)O13—Na2A—OW499.4 (17)
O12—Si3—O22111.8 (12)OW6—Na2A—OW479.9 (15)
O12—Si3—O43113.1 (10)Na22—Na2A—OW2iv54 (7)
O22—Si3—O43106.1 (11)OV2—Na2A—OW2iv168 (2)
O12—Si3—O31113.4 (11)O15iii—Na2A—OW2iv80.7 (18)
O22—Si3—O31106.2 (10)V2A—Na2A—OW2iv120 (2)
O43—Si3—O31105.6 (10)O13—Na2A—OW2iv79.8 (16)
O12—Si3—Na11vii38.1 (8)OW6—Na2A—OW2iv93.8 (16)
O22—Si3—Na11vii78.2 (8)OW4—Na2A—OW2iv85.8 (15)
O43—Si3—Na11vii143.0 (8)Na22—Na2A—V2147 (7)
O31—Si3—Na11vii108.3 (9)OV2—Na2A—V271.8 (13)
O11—Si4—O32viii108.0 (12)O15iii—Na2A—V241.7 (9)
O11—Si4—O23115.7 (11)V2A—Na2A—V216.4 (6)
O32viii—Si4—O23111.8 (11)O13—Na2A—V241.2 (7)
O11—Si4—O43109.8 (10)OW6—Na2A—V2142.1 (18)
O32viii—Si4—O43106.0 (11)OW4—Na2A—V2133.9 (17)
O23—Si4—O43105.0 (10)OW2iv—Na2A—V2103.7 (16)
O11—Si4—Na11viii43.3 (8)Na22—Na2A—Si8iii126 (7)
O32viii—Si4—Na11viii108.0 (9)OV2—Na2A—Si8iii105.4 (17)
O23—Si4—Na11viii76.9 (8)O15iii—Na2A—Si8iii24.6 (8)
O43—Si4—Na11viii142.2 (8)V2A—Na2A—Si8iii72.5 (12)
O13—Si5—O21110.5 (11)O13—Na2A—Si8iii92.1 (14)
O13—Si5—O44113.2 (10)OW6—Na2A—Si8iii87.0 (15)
O21—Si5—O44106.9 (10)OW4—Na2A—Si8iii161.0 (17)
O13—Si5—O31113.4 (12)OW2iv—Na2A—Si8iii81.3 (13)
O21—Si5—O31104.3 (10)V2—Na2A—Si8iii63.5 (8)
O44—Si5—O31107.9 (10)Na22—Na2A—Na12iv94 (7)
O13—Si5—Na12iv38.3 (8)OV2—Na2A—Na12iv130.3 (19)
O21—Si5—Na12iv76.0 (8)O15iii—Na2A—Na12iv47.9 (12)
O44—Si5—Na12iv141.8 (8)V2A—Na2A—Na12iv75.8 (14)
O31—Si5—Na12iv108.1 (9)O13—Na2A—Na12iv45.6 (10)
O14—Si6—O32108.3 (11)OW6—Na2A—Na12iv128.9 (19)
O14—Si6—O24116.4 (11)OW4—Na2A—Na12iv114.9 (17)
O32—Si6—O24109.1 (10)OW2iv—Na2A—Na12iv43.8 (10)
O14—Si6—O44112.9 (10)V2—Na2A—Na12iv59.9 (9)
O32—Si6—O44107.1 (11)Si8iii—Na2A—Na12iv63.7 (9)
O24—Si6—O44102.7 (10)Na22—Na2A—V2x113 (7)
O14—Si6—Na12iii38.7 (8)OV2—Na2A—V2x16.0 (11)
O32—Si6—Na12iii108.2 (9)O15iii—Na2A—V2x112.4 (17)
O24—Si6—Na12iii81.1 (8)V2A—Na2A—V2x71.0 (13)
O44—Si6—Na12iii140.9 (8)O13—Na2A—V2x105.0 (14)
O16—Si7—O21ix110.5 (11)OW6—Na2A—V2x81.2 (15)
O16—Si7—O33viii115.4 (10)OW4—Na2A—V2x81.4 (14)
O21ix—Si7—O33viii105.9 (9)OW2iv—Na2A—V2x166.9 (16)
O16—Si7—O41109.4 (9)V2—Na2A—V2x87.3 (10)
O21ix—Si7—O41100.7 (9)Si8iii—Na2A—V2x110.3 (12)
O33viii—Si7—O41113.8 (9)Na12iv—Na2A—V2x146.4 (13)
O16—Si7—Na1237.9 (8)Si4—O11—V1vii128.1 (12)
O21ix—Si7—Na1279.4 (8)Si4—O11—Na21vii132.9 (12)
O33viii—Si7—Na12105.9 (8)V1vii—O11—Na21vii96.0 (7)
O41—Si7—Na12138.3 (7)Si4—O11—Na11viii111.4 (11)
O34—Si8—O15112.4 (11)V1vii—O11—Na11viii85.2 (7)
O34—Si8—O41105.6 (10)Na21vii—O11—Na11viii84.8 (8)
O15—Si8—O41110.2 (10)Si3—O12—V1vii135.5 (12)
O34—Si8—O24110.8 (10)Si3—O12—Na11vii117.4 (12)
O15—Si8—O24114.3 (11)V1vii—O12—Na11vii102.3 (8)
O41—Si8—O24102.8 (10)Si5—O13—V2A134.3 (13)
O34—Si8—Na2Ax82.2 (11)Si5—O13—V2128.8 (12)
O15—Si8—Na2Ax32.0 (11)V2A—O13—V234.3 (5)
O41—Si8—Na2Ax110.7 (11)Si5—O13—Na12iv117.1 (11)
O24—Si8—Na2Ax139.3 (12)V2A—O13—Na12iv107.2 (8)
O34—Si8—Na12iii108.3 (9)V2—O13—Na12iv92.6 (8)
O15—Si8—Na12iii40.4 (9)Si5—O13—Na2A133.9 (15)
O41—Si8—Na12iii142.2 (7)V2A—O13—Na2A57.2 (11)
O24—Si8—Na12iii80.2 (8)V2—O13—Na2A85.5 (11)
Na2Ax—Si8—Na12iii59.1 (9)Na12iv—O13—Na2A85.8 (13)
O12i—Na11—OW1142.5 (11)Si5—O13—Na22124.7 (12)
O12i—Na11—O1868.4 (7)V2A—O13—Na2269.1 (9)
OW1—Na11—O18128.9 (11)V2—O13—Na2297.6 (9)
O12i—Na11—O17xi95.5 (8)Na12iv—O13—Na2283.7 (9)
OW1—Na11—O17xi89.4 (10)Na2A—O13—Na2212.2 (10)
O18—Na11—O17xi135.9 (9)Si6—O14—V2133.8 (12)
O12i—Na11—O11v134.6 (10)Si6—O14—V2A121.4 (11)
OW1—Na11—O11v80.4 (10)V2—O14—V2A32.8 (5)
O18—Na11—O11v97.8 (8)Si6—O14—Na12iii116.8 (11)
O17xi—Na11—O11v63.8 (6)V2—O14—Na12iii98.8 (8)
O12i—Na11—V1xi97.9 (7)V2A—O14—Na12iii82.1 (8)
OW1—Na11—V1xi108.3 (9)Si8—O15—V2Ax138.2 (13)
O18—Na11—V1xi101.5 (6)Si8—O15—Na2Ax123.4 (16)
O17xi—Na11—V1xi38.0 (5)V2Ax—O15—Na2Ax65.9 (14)
O11v—Na11—V1xi40.6 (5)Si8—O15—V2x129.0 (11)
O12i—Na11—Na21xi143.2 (8)V2Ax—O15—V2x34.1 (5)
OW1—Na11—Na21xi46.7 (8)Na2Ax—O15—V2x97.0 (14)
O18—Na11—Na21xi141.8 (7)Si8—O15—Na12iii114.5 (12)
O17xi—Na11—Na21xi49.1 (6)V2Ax—O15—Na12iii104.4 (9)
O11v—Na11—Na21xi46.2 (6)Na2Ax—O15—Na12iii93.8 (15)
V1xi—Na11—Na21xi61.8 (3)V2x—O15—Na12iii89.5 (8)
O12i—Na11—V134.8 (4)Si8—O15—Na22x121.4 (12)
OW1—Na11—V1160.3 (10)V2Ax—O15—Na22x74.1 (9)
O18—Na11—V136.8 (5)Na2Ax—O15—Na22x9.8 (15)
O17xi—Na11—V1109.8 (7)V2x—O15—Na22x103.5 (10)
O11v—Na11—V1111.6 (7)Na12iii—O15—Na22x86.4 (10)
V1xi—Na11—V190.3 (4)Si7—O16—V2x136.3 (12)
Na21xi—Na11—V1152.1 (5)Si7—O16—V2Ax133.4 (11)
O12i—Na11—Si3i24.5 (5)V2x—O16—V2Ax36.0 (5)
OW1—Na11—Si3i125.1 (9)Si7—O16—Na12115.3 (12)
O18—Na11—Si3i92.9 (6)V2x—O16—Na12107.9 (8)
O17xi—Na11—Si3i77.3 (6)V2Ax—O16—Na1291.5 (8)
O11v—Na11—Si3i133.7 (7)Si2—O17—V1127.8 (11)
V1xi—Na11—Si3i93.1 (4)Si2—O17—Na11ii115.2 (12)
Na21xi—Na11—Si3i120.6 (5)V1—O17—Na11ii90.3 (8)
V1—Na11—Si3i58.3 (3)Si2—O17—Na21129.9 (11)
O12i—Na11—Si192.1 (6)V1—O17—Na2195.5 (8)
OW1—Na11—Si1112.2 (9)Na11ii—O17—Na2184.3 (7)
O18—Na11—Si124.3 (4)Si1—O18—V1134.1 (11)
O17xi—Na11—Si1131.3 (7)Si1—O18—Na11116.0 (11)
O11v—Na11—Si177.0 (6)V1—O18—Na1196.9 (7)
V1xi—Na11—Si193.3 (4)Si5—O21—Si7iv147.5 (13)
Na21xi—Na11—Si1117.9 (5)Si3—O22—Si2xii151.8 (15)
V1—Na11—Si158.5 (3)Si1viii—O23—Si4151.5 (14)
Si3i—Na11—Si1116.4 (4)Si8—O24—Si6143.9 (13)
O12i—Na11—Si4v132.6 (7)Si3—O31—Si5136.0 (13)
OW1—Na11—Si4v84.5 (9)Si4v—O32—Si6137.5 (14)
O18—Na11—Si4v76.0 (6)Si2—O33—Si7v134.3 (12)
O17xi—Na11—Si4v88.7 (6)Si1—O34—Si8136.8 (13)
O11v—Na11—Si4v25.3 (4)Si8—O41—Si7129.4 (11)
V1xi—Na11—Si4v59.4 (3)Si1—O42—Si2127.6 (11)
Na21xi—Na11—Si4v65.8 (4)Si3—O43—Si4128.9 (12)
V1—Na11—Si4v99.9 (4)Si5—O44—Si6128.4 (11)
Si3i—Na11—Si4v146.4 (5)V1—OV1—Na21ii152.3 (12)
Si1—Na11—Si4v53.1 (3)V2x—OV2—V2A147.3 (15)
O12i—Na11—Si2xi75.6 (6)V2x—OV2—Na2A145 (2)
OW1—Na11—Si2xi96.0 (9)V2A—OV2—Na2A65.7 (16)
O18—Na11—Si2xi135.1 (7)V2x—OV2—Na22136.7 (16)
O17xi—Na11—Si2xi25.1 (5)V2A—OV2—Na2275.5 (13)
O11v—Na11—Si2xi88.8 (5)Na2A—OV2—Na2211.6 (14)
V1xi—Na11—Si2xi57.6 (3)Na21xi—OW1—Na1186.6 (12)
Na21xi—Na11—Si2xi67.6 (4)Na12—OW2—Na22ix83.9 (12)
V1—Na11—Si2xi99.7 (4)Na12—OW2—Na2Aix74.9 (12)
Si3i—Na11—Si2xi54.1 (3)Na22ix—OW2—Na2Aix10.3 (10)
Si1—Na11—Si2xi145.3 (5)Na22—OW4—Na2A9.1 (12)
Si4v—Na11—Si2xi113.4 (4)Na22—OW6—Na2A13.5 (10)
O16—Na12—O13ix95.7 (9)
Symmetry codes: (i) x, y+1/2, z+1; (ii) x, y+1/2, z; (iii) x+1, y1/2, z+1; (iv) x, y1, z; (v) x, y, z1; (vi) x, y+1, z1; (vii) x, y1/2, z+1; (viii) x, y, z+1; (ix) x, y+1, z; (x) x+1, y+1/2, z+1; (xi) x, y1/2, z; (xii) x, y1, z+1.
(II) top
Crystal data top
H0Na2O14Si4VF(000) = 852
Mr = 433.28Dx = 2.115 Mg m3
Monoclinic, P21Mo Kα radiation, λ = 0.71073 Å
a = 14.364 (4) ÅCell parameters from 5566 reflections
b = 9.134 (3) Åθ = 1.6–21.0°
c = 10.373 (3) ŵ = 1.21 mm1
β = 90.056 (7)°T = 304 K
V = 1360.9 (7) Å3Prismatic, blue
Z = 40.10 × 0.05 × 0.03 mm
Data collection top
Bruker D8 Venture
diffractometer
Rint = 0.048
Absorption correction: multi-scan
(SADABS; Bruker, 2003)
θmax = 21.0°, θmin = 2.2°
h = 1414
5566 measured reflectionsk = 79
1997 independent reflectionsl = 1010
1679 reflections with I > 2σ(I)
Refinement top
Refinement on F2H-atom parameters not defined
Least-squares matrix: full w = 1/[σ2(Fo2) + (0.1458P)2 + 32.8662P]
where P = (Fo2 + 2Fc2)/3
R[F2 > 2σ(F2)] = 0.094(Δ/σ)max = 0.088
wR(F2) = 0.263Δρmax = 1.34 e Å3
S = 1.05Δρmin = 0.98 e Å3
1997 reflectionsExtinction correction: SHELXL-2018/3 (Sheldrick 2018), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4
159 parametersExtinction coefficient: 0.029 (5)
81 restraintsAbsolute structure: Twinning involves inversion, so Flack parameter cannot be determined
Special details top

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

Refinement. Refined as a 2-component inversion twin.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
V10.0017 (6)0.7444 (7)0.0283 (6)0.0206 (12)*
V20.5004 (8)0.1211 (12)0.4615 (9)0.0206 (12)*0.622
V2A0.4953 (14)0.2346 (19)0.5195 (13)0.0206 (12)*0.378
Si10.2082 (8)0.6186 (13)0.1202 (11)0.0237 (10)*
Si20.1974 (8)0.7789 (14)0.1248 (11)0.0237 (10)*
Si30.1950 (8)0.1191 (13)0.8536 (11)0.0237 (10)*
Si40.2048 (8)0.2810 (13)1.0963 (12)0.0237 (10)*
Si50.2931 (8)0.1011 (13)0.6009 (12)0.0237 (10)*
Si60.3049 (8)0.2589 (13)0.3520 (11)0.0237 (10)*
Si70.2988 (8)0.7581 (13)0.6155 (11)0.0237 (10)*
Si80.3080 (8)0.6002 (13)0.3711 (11)0.0237 (10)*
Na110.0122 (14)0.4463 (15)0.2055 (15)0.036 (2)*
Na120.4934 (15)0.9255 (15)0.7259 (15)0.036 (2)*
Na210.0054 (15)0.5880 (19)0.2583 (19)0.050 (4)*
Na220.479 (2)0.312 (3)0.774 (3)0.050 (4)*0.622
Na2A0.511 (4)0.281 (5)0.731 (5)0.050 (4)*0.378
O110.0953 (13)0.251 (3)1.103 (2)0.0264 (17)*
O120.0875 (13)0.146 (3)0.860 (2)0.0264 (17)*
O130.4008 (13)0.129 (3)0.614 (2)0.0264 (17)*
O140.4142 (13)0.237 (3)0.355 (2)0.0264 (17)*
O150.4155 (13)0.612 (3)0.382 (2)0.0264 (17)*
O160.4097 (12)0.738 (3)0.622 (2)0.0264 (17)*
O170.0864 (13)0.745 (3)0.128 (2)0.0264 (17)*
O180.1021 (13)0.644 (3)0.139 (2)0.0264 (17)*
O210.2695 (16)0.0685 (16)0.600 (2)0.028 (2)*
O220.2205 (16)0.0461 (17)0.871 (2)0.028 (2)*
O230.2318 (16)0.4521 (16)1.093 (2)0.028 (2)*
O240.2749 (16)0.4313 (16)0.375 (2)0.028 (2)*
O310.2374 (14)0.172 (3)0.7208 (17)0.034 (3)*
O320.2590 (13)0.205 (3)0.2177 (17)0.034 (3)*
O330.2492 (13)0.698 (2)0.2500 (16)0.034 (3)*
O340.2672 (13)0.672 (2)0.2456 (17)0.034 (3)*
O410.2559 (14)0.673 (2)0.4915 (16)0.026 (2)*
O420.2484 (14)0.716 (2)0.0076 (16)0.026 (2)*
O430.2464 (14)0.206 (2)0.9647 (18)0.026 (2)*
O440.2539 (14)0.169 (2)0.4703 (18)0.026 (2)*
OV10.009 (2)0.905 (3)0.088 (2)0.026 (7)*
OV20.502 (3)0.440 (3)0.571 (3)0.050 (10)*
OW10.036 (3)0.294 (5)0.412 (5)0.118 (18)*
OW20.493 (3)1.049 (4)0.915 (3)0.064 (10)*
OW30.112 (4)0.396 (7)0.359 (6)0.13 (2)*
OW40.392 (3)0.424 (5)0.873 (4)0.072 (13)*
OW50.124 (3)0.440 (5)0.360 (4)0.067 (14)*
OW60.611 (3)0.445 (4)0.864 (4)0.051 (12)*
Geometric parameters (Å, º) top
V1—OV11.59 (3)Si5—O311.614 (18)
V1—O12i1.95 (2)Si5—Na12iv3.54 (2)
V1—O11i1.95 (2)Si6—O141.584 (19)
V1—O172.02 (2)Si6—O321.616 (18)
V1—O182.06 (2)Si6—O441.648 (18)
V1—Na11ii3.053 (16)Si6—O241.650 (18)
V1—Na113.288 (16)Si6—Na12iii3.37 (2)
V1—Na213.30 (2)Si7—O161.605 (19)
V2—V2A1.20 (2)Si7—O21ix1.647 (18)
V2—OV2iii1.69 (3)Si7—O411.625 (18)
V2—O16iii1.89 (3)Si7—O33viii1.660 (17)
V2—O141.97 (3)Si7—Na123.39 (2)
V2—O15iii2.02 (2)Si8—O151.552 (18)
V2—O132.14 (2)Si8—O411.600 (18)
V2—Na2A3.16 (5)Si8—O341.571 (18)
V2—Na12iv3.275 (18)Si8—O241.614 (18)
V2—Na12iii3.394 (18)Si8—Na2Ax3.26 (6)
V2—Na223.69 (3)Si8—Na12iii3.42 (2)
V2A—O131.93 (3)Na11—O182.32 (3)
V2A—O15iii1.98 (3)Na11—O12i2.41 (3)
V2A—OV21.95 (3)Na11—O17xi2.46 (3)
V2A—O16iii2.01 (3)Na11—O11v2.39 (3)
V2A—O142.06 (3)Na11—OW12.57 (5)
V2A—Na2A2.25 (6)Na11—Na21xi3.32 (2)
V2A—Na222.74 (3)Na12—O162.35 (3)
V2A—Na12iii3.09 (2)Na12—OW22.26 (4)
V2A—Na12iv3.54 (2)Na12—O14x2.33 (3)
Si1—O181.554 (19)Na12—O15x2.42 (3)
Si1—O421.577 (18)Na12—O13ix2.56 (3)
Si1—O23v1.582 (18)Na12—Na2Aix3.25 (5)
Si1—O341.627 (17)Na21—O172.37 (3)
Si1—Na113.34 (2)Na21—OV1xi2.44 (3)
Si2—O22vi1.633 (18)Na21—OW1ii2.51 (5)
Si2—O171.625 (19)Na21—OW52.54 (5)
Si2—O331.669 (17)Na21—O11i2.55 (3)
Si2—O421.659 (18)Na21—OW32.55 (6)
Si2—Na11ii3.48 (2)Na22—Na2A0.70 (6)
Si3—O221.563 (19)Na22—OW41.92 (5)
Si3—O311.583 (18)Na22—OV22.43 (5)
Si3—O121.564 (19)Na22—OW62.43 (5)
Si3—O431.584 (19)Na22—O132.61 (4)
Si3—Na11vii3.42 (2)Na22—OW2iv2.83 (4)
Si4—O111.599 (19)Na22—O15iii2.87 (4)
Si4—O231.610 (17)Na2A—OV22.21 (6)
Si4—O32viii1.632 (18)Na2A—O15iii2.21 (6)
Si4—O431.639 (18)Na2A—O132.42 (6)
Si4—Na11viii3.35 (2)Na2A—OW62.50 (6)
Si5—O131.574 (19)Na2A—OW42.61 (7)
Si5—O211.586 (18)Na2A—OW2iv2.86 (6)
Si5—O441.593 (18)
OV1—V1—O12i103.8 (13)O14x—Na12—O15x92.5 (11)
OV1—V1—O11i106.8 (14)O16—Na12—O13ix93.3 (10)
O12i—V1—O11i87.8 (10)OW2—Na12—O13ix91.7 (12)
OV1—V1—O17105.6 (13)O14x—Na12—O13ix131.9 (11)
O12i—V1—O17150.6 (10)O15x—Na12—O13ix63.9 (7)
O11i—V1—O1782.6 (8)O16—Na12—V2Ax40.5 (6)
OV1—V1—O1898.5 (13)OW2—Na12—V2Ax174.6 (12)
O12i—V1—O1885.5 (8)O14x—Na12—V2Ax41.9 (7)
O11i—V1—O18154.7 (10)O15x—Na12—V2Ax89.3 (8)
O17—V1—O1891.5 (9)O13ix—Na12—V2Ax93.7 (8)
OV1—V1—Na11ii75.9 (10)O16—Na12—V2ix91.8 (8)
O12i—V1—Na11ii135.1 (8)OW2—Na12—V2ix117.1 (10)
O11i—V1—Na11ii51.6 (8)O14x—Na12—V2ix94.7 (8)
O17—V1—Na11ii53.4 (8)O15x—Na12—V2ix38.0 (6)
O18—V1—Na11ii139.3 (8)O13ix—Na12—V2ix40.7 (6)
OV1—V1—Na11122.9 (10)V2Ax—Na12—V2ix67.4 (5)
O12i—V1—Na1146.8 (8)O16—Na12—Na2Aix140.6 (15)
O11i—V1—Na11116.7 (9)OW2—Na12—Na2Aix59.3 (13)
O17—V1—Na11114.8 (8)O14x—Na12—Na2Aix134.3 (15)
O18—V1—Na1144.5 (7)O15x—Na12—Na2Aix42.7 (11)
Na11ii—V1—Na11161.3 (4)O13ix—Na12—Na2Aix47.4 (12)
OV1—V1—Na21138.5 (10)V2Ax—Na12—Na2Aix124.9 (12)
O12i—V1—Na21108.4 (8)V2ix—Na12—Na2Aix57.8 (10)
O11i—V1—Na2150.3 (7)O16—Na12—Si6x90.1 (7)
O17—V1—Na2145.5 (7)OW2—Na12—Si6x115.7 (12)
O18—V1—Na21109.4 (8)O14x—Na12—Si6x24.6 (6)
Na11ii—V1—Na2162.9 (5)O15x—Na12—Si6x75.1 (8)
Na11—V1—Na2198.4 (4)O13ix—Na12—Si6x131.7 (8)
V2A—V2—OV2iii160.9 (16)V2Ax—Na12—Si6x60.1 (5)
V2A—V2—O16iii77.6 (13)V2ix—Na12—Si6x91.1 (5)
OV2iii—V2—O16iii118.2 (15)Na2Aix—Na12—Si6x112.9 (13)
V2A—V2—O1477.0 (12)O16—Na12—Si725.1 (6)
OV2iii—V2—O14114.0 (16)OW2—Na12—Si7121.1 (12)
O16iii—V2—O1482.3 (9)O14x—Na12—Si790.9 (7)
V2A—V2—O15iii70.7 (12)O15x—Na12—Si7127.4 (8)
OV2iii—V2—O15iii97.5 (15)O13ix—Na12—Si775.4 (7)
O16iii—V2—O15iii89.1 (10)V2Ax—Na12—Si760.7 (5)
O14—V2—O15iii147.7 (11)V2ix—Na12—Si789.4 (5)
V2A—V2—O1363.7 (12)Na2Aix—Na12—Si7121.2 (13)
OV2iii—V2—O1399.8 (14)Si6x—Na12—Si7115.1 (5)
O16iii—V2—O13141.3 (11)O16—Na12—V2x32.4 (6)
O14—V2—O1388.6 (10)OW2—Na12—V2x154.8 (11)
O15iii—V2—O1378.8 (8)O14x—Na12—V2x34.2 (6)
V2A—V2—Na2A33.0 (12)O15x—Na12—V2x107.3 (8)
OV2iii—V2—Na2A129.0 (15)O13ix—Na12—V2x110.5 (8)
O16iii—V2—Na2A96.7 (12)V2Ax—Na12—V2x20.7 (4)
O14—V2—Na2A106.0 (13)V2ix—Na12—V2x88.1 (4)
O15iii—V2—Na2A44.0 (12)Na2Aix—Na12—V2x145.5 (11)
O13—V2—Na2A50.0 (12)Si6x—Na12—V2x58.0 (4)
V2A—V2—Na12iv92.9 (9)Si7—Na12—V2x57.2 (4)
OV2iii—V2—Na12iv68.4 (11)O16—Na12—Si8x129.2 (8)
O16iii—V2—Na12iv135.7 (9)OW2—Na12—Si8x91.4 (11)
O14—V2—Na12iv138.1 (8)O14x—Na12—Si8x76.3 (8)
O15iii—V2—Na12iv47.6 (8)O15x—Na12—Si8x23.9 (6)
O13—V2—Na12iv51.5 (7)O13ix—Na12—Si8x87.7 (7)
Na2A—V2—Na12iv60.7 (9)V2Ax—Na12—Si8x88.6 (6)
V2A—V2—Na12iii65.2 (9)V2ix—Na12—Si8x58.2 (4)
OV2iii—V2—Na12iii133.6 (12)Na2Aix—Na12—Si8x58.4 (11)
O16iii—V2—Na12iii41.8 (8)Si6x—Na12—Si8x54.8 (5)
O14—V2—Na12iii41.7 (8)Si7—Na12—Si8x143.1 (6)
O15iii—V2—Na12iii118.4 (9)V2x—Na12—Si8x101.0 (6)
O13—V2—Na12iii114.5 (8)O17—Na21—OV1xi90.6 (11)
Na2A—V2—Na12iii97.4 (9)O17—Na21—OW1ii90.3 (14)
Na12iv—V2—Na12iii158.1 (5)OV1xi—Na21—OW1ii167.0 (16)
V2A—V2—Na2231.5 (9)O17—Na21—OW598.7 (13)
OV2iii—V2—Na22129.5 (13)OV1xi—Na21—OW587.2 (13)
O16iii—V2—Na22101.2 (9)OW1ii—Na21—OW5105.4 (17)
O14—V2—Na22100.6 (10)O17—Na21—O11i64.4 (8)
O15iii—V2—Na2250.6 (9)OV1xi—Na21—O11i86.1 (11)
O13—V2—Na2243.7 (8)OW1ii—Na21—O11i82.7 (14)
Na2A—V2—Na227.5 (12)OW5—Na21—O11i161.7 (14)
Na12iv—V2—Na2261.4 (6)O17—Na21—OW3169.2 (17)
Na12iii—V2—Na2296.7 (6)OV1xi—Na21—OW379.2 (16)
V2—V2A—O1382.4 (13)OW1ii—Na21—OW398.8 (18)
V2—V2A—O15iii74.4 (13)OW5—Na21—OW384.6 (16)
O13—V2A—O15iii84.9 (10)O11i—Na21—OW3110.7 (16)
V2—V2A—OV2164.5 (17)O17—Na21—Na11ii47.7 (7)
O13—V2A—OV2111.8 (15)OV1xi—Na21—Na11ii123.8 (10)
O15iii—V2A—OV2111.8 (16)OW1ii—Na21—Na11ii50.1 (12)
V2—V2A—O16iii66.7 (12)OW5—Na21—Na11ii128.1 (12)
O13—V2A—O16iii149.1 (13)O11i—Na21—Na11ii45.8 (7)
O15iii—V2A—O16iii87.0 (12)OW3—Na21—Na11ii136.5 (16)
OV2—V2A—O16iii98.9 (15)O17—Na21—V137.5 (6)
V2—V2A—O1468.4 (11)OV1xi—Na21—V169.1 (8)
O13—V2A—O1491.7 (12)OW1ii—Na21—V1104.6 (13)
O15iii—V2A—O14142.8 (13)OW5—Na21—V1125.8 (12)
OV2—V2A—O14103.9 (16)O11i—Na21—V136.1 (6)
O16iii—V2A—O1477.2 (9)OW3—Na21—V1133.1 (15)
V2—V2A—Na2A130.1 (18)Na11ii—Na21—V154.9 (4)
O13—V2A—Na2A70.4 (17)Na2A—Na22—OW4171 (6)
O15iii—V2A—Na2A62.6 (17)Na2A—Na22—OV264 (5)
OV2—V2A—Na2A63.2 (16)OW4—Na22—OV2107 (2)
O16iii—V2A—Na2A130 (2)Na2A—Na22—OW687 (5)
O14—V2A—Na2A149 (2)OW4—Na22—OW692.2 (17)
V2—V2A—Na22135.3 (13)OV2—Na22—OW689.4 (16)
O13—V2A—Na2265.1 (11)Na2A—Na22—O1367 (5)
O15iii—V2A—Na2272.9 (11)OW4—Na22—O13113 (2)
OV2—V2A—Na2259.5 (12)OV2—Na22—O1379.3 (13)
O16iii—V2A—Na22139.4 (13)OW6—Na22—O13154.0 (18)
O14—V2A—Na22138.0 (13)Na2A—Na22—V2A39 (5)
Na2A—V2A—Na2211.3 (17)OW4—Na22—V2A135 (2)
V2—V2A—Na12iii94.1 (9)OV2—Na22—V2A43.8 (9)
O13—V2A—Na12iii137.5 (11)OW6—Na22—V2A115.6 (16)
O15iii—V2A—Na12iii135.1 (11)O13—Na22—V2A42.3 (8)
OV2—V2A—Na12iii71.4 (11)Na2A—Na22—OW2iv86 (6)
O16iii—V2A—Na12iii49.6 (9)OW4—Na22—OW2iv102.7 (19)
O14—V2A—Na12iii48.9 (8)OV2—Na22—OW2iv148.1 (16)
Na2A—V2A—Na12iii134.0 (15)OW6—Na22—OW2iv99.8 (17)
Na22—V2A—Na12iii130.6 (9)O13—Na22—OW2iv79.3 (11)
V2—V2A—Na12iv67.4 (9)V2A—Na22—OW2iv105.8 (12)
O13—V2A—Na12iv44.8 (8)Na2A—Na22—O15iii15 (5)
O15iii—V2A—Na12iv40.9 (8)OW4—Na22—O15iii170 (2)
OV2—V2A—Na12iv126.9 (11)OV2—Na22—O15iii75.3 (12)
O16iii—V2A—Na12iv117.4 (10)OW6—Na22—O15iii97.1 (15)
O14—V2A—Na12iv120.3 (11)O13—Na22—O15iii57.4 (9)
Na2A—V2A—Na12iv63.8 (13)V2A—Na22—O15iii41.3 (8)
Na22—V2A—Na12iv67.9 (8)OW2iv—Na22—O15iii73.3 (11)
Na12iii—V2A—Na12iv161.4 (6)Na2A—Na22—Na12iv57 (5)
O18—Si1—O42111.7 (12)OW4—Na22—Na12iv129.6 (19)
O18—Si1—O23v112.1 (11)OV2—Na22—Na12iv110.2 (12)
O42—Si1—O23v109.4 (11)OW6—Na22—Na12iv120.1 (17)
O18—Si1—O34111.3 (11)O13—Na22—Na12iv45.8 (8)
O42—Si1—O34103.4 (10)V2A—Na22—Na12iv66.8 (8)
O23v—Si1—O34108.5 (11)OW2iv—Na22—Na12iv39.3 (8)
O18—Si1—Na1137.9 (10)O15iii—Na22—Na12iv42.5 (7)
O42—Si1—Na11140.3 (9)Na2A—Na22—V236 (5)
O23v—Si1—Na1177.0 (9)OW4—Na22—V2141 (2)
O34—Si1—Na11111.6 (9)OV2—Na22—V257.0 (9)
O22vi—Si2—O17112.8 (11)OW6—Na22—V2120.6 (15)
O22vi—Si2—O33108.9 (11)O13—Na22—V234.5 (7)
O17—Si2—O33109.8 (11)V2A—Na22—V213.2 (5)
O22vi—Si2—O42105.7 (11)OW2iv—Na22—V292.6 (10)
O17—Si2—O42112.3 (11)O15iii—Na22—V233.0 (6)
O33—Si2—O42107.1 (10)Na12iv—Na22—V253.5 (5)
O22vi—Si2—Na11ii74.9 (9)Na22—Na2A—OV2100 (6)
O17—Si2—Na11ii39.8 (10)Na22—Na2A—O15iii160 (6)
O33—Si2—Na11ii113.2 (9)OV2—Na2A—O15iii95 (2)
O42—Si2—Na11ii137.1 (9)Na22—Na2A—V2A129 (7)
O22—Si3—O31107.9 (11)OV2—Na2A—V2A51.9 (14)
O22—Si3—O12112.1 (11)O15iii—Na2A—V2A52.9 (15)
O31—Si3—O12111.7 (12)Na22—Na2A—O1398 (6)
O22—Si3—O43106.9 (11)OV2—Na2A—O1388 (2)
O31—Si3—O43107.5 (11)O15iii—Na2A—O1369.5 (16)
O12—Si3—O43110.5 (11)V2A—Na2A—O1348.7 (14)
O22—Si3—Na11vii77.3 (9)Na22—Na2A—OW677 (5)
O31—Si3—Na11vii108.7 (9)OV2—Na2A—OW693 (2)
O12—Si3—Na11vii38.9 (10)O15iii—Na2A—OW6116 (3)
O43—Si3—Na11vii140.1 (9)V2A—Na2A—OW6135 (3)
O11—Si4—O23113.7 (11)O13—Na2A—OW6175 (3)
O11—Si4—O32viii111.2 (11)Na22—Na2A—OW46 (5)
O23—Si4—O32viii108.1 (11)OV2—Na2A—OW493 (2)
O11—Si4—O43109.1 (11)O15iii—Na2A—OW4165 (3)
O23—Si4—O43107.4 (11)V2A—Na2A—OW4126 (3)
O32viii—Si4—O43107.0 (10)O13—Na2A—OW498 (2)
O11—Si4—Na11viii41.3 (10)OW6—Na2A—OW476.4 (17)
O23—Si4—Na11viii76.6 (9)Na22—Na2A—OW2iv80 (6)
O32viii—Si4—Na11viii108.8 (9)OV2—Na2A—OW2iv169 (3)
O43—Si4—Na11viii140.4 (10)O15iii—Na2A—OW2iv83.2 (18)
O13—Si5—O21111.8 (12)V2A—Na2A—OW2iv120 (2)
O13—Si5—O44110.9 (12)O13—Na2A—OW2iv81.7 (17)
O21—Si5—O44107.4 (11)OW6—Na2A—OW2iv97 (2)
O13—Si5—O31110.8 (12)OW4—Na2A—OW2iv86.4 (19)
O21—Si5—O31107.0 (11)Na22—Na2A—V2136 (6)
O44—Si5—O31108.9 (11)OV2—Na2A—V268.6 (16)
O13—Si5—Na12iv40.9 (10)O15iii—Na2A—V239.6 (10)
O21—Si5—Na12iv74.6 (9)V2A—Na2A—V216.9 (7)
O44—Si5—Na12iv140.8 (9)O13—Na2A—V242.5 (10)
O31—Si5—Na12iv107.6 (9)OW6—Na2A—V2142 (2)
O14—Si6—O32112.7 (11)OW4—Na2A—V2134 (2)
O14—Si6—O44111.3 (11)OW2iv—Na2A—V2104.2 (16)
O32—Si6—O44108.1 (11)Na22—Na2A—Si8iii160 (7)
O14—Si6—O24111.9 (11)OV2—Na2A—Si8iii98 (2)
O32—Si6—O24107.8 (11)O15iii—Na2A—Si8iii24.5 (9)
O44—Si6—O24104.6 (10)V2A—Na2A—Si8iii70.4 (16)
O14—Si6—Na12iii37.7 (10)O13—Na2A—Si8iii93.9 (17)
O32—Si6—Na12iii106.2 (9)OW6—Na2A—Si8iii91 (2)
O44—Si6—Na12iii141.7 (9)OW4—Na2A—Si8iii164 (2)
O24—Si6—Na12iii80.1 (9)OW2iv—Na2A—Si8iii85.0 (16)
O16—Si7—O21ix111.6 (11)V2—Na2A—Si8iii61.0 (10)
O16—Si7—O41110.9 (11)Na22—Na2A—Na12iv112 (6)
O21ix—Si7—O41106.6 (10)OV2—Na2A—Na12iv130 (2)
O16—Si7—O33viii110.6 (11)O15iii—Na2A—Na12iv48.2 (11)
O21ix—Si7—O33viii107.0 (10)V2A—Na2A—Na12iv77.9 (15)
O41—Si7—O33viii110.1 (10)O13—Na2A—Na12iv51.2 (11)
O16—Si7—Na1238.5 (10)OW6—Na2A—Na12iv131 (2)
O21ix—Si7—Na1279.1 (9)OW4—Na2A—Na12iv117 (2)
O41—Si7—Na12142.8 (9)OW2iv—Na2A—Na12iv42.8 (10)
O33viii—Si7—Na12102.7 (8)V2—Na2A—Na12iv61.4 (9)
O15—Si8—O41112.3 (11)Si8iii—Na2A—Na12iv63.3 (11)
O15—Si8—O34113.7 (12)Si4—O11—V1vii132.6 (14)
O41—Si8—O34107.4 (11)Si4—O11—Na11viii112.6 (14)
O15—Si8—O24111.0 (12)V1vii—O11—Na11viii88.7 (10)
O41—Si8—O24103.8 (10)Si4—O11—Na21vii128.9 (14)
O34—Si8—O24108.0 (11)V1vii—O11—Na21vii93.5 (9)
O15—Si8—Na2Ax36.2 (13)Na11viii—O11—Na21vii84.4 (9)
O41—Si8—Na2Ax114.8 (12)Si3—O12—V1vii138.3 (15)
O34—Si8—Na2Ax79.4 (12)Si3—O12—Na11vii117.1 (13)
O24—Si8—Na2Ax136.5 (13)V1vii—O12—Na11vii97.2 (10)
O15—Si8—Na12iii39.2 (10)Si5—O13—V2A136.7 (16)
O41—Si8—Na12iii144.4 (9)Si5—O13—V2126.0 (14)
O34—Si8—Na12iii105.2 (9)V2A—O13—V233.9 (7)
O24—Si8—Na12iii78.9 (9)Si5—O13—Na2A141 (2)
Na2Ax—Si8—Na12iii58.2 (9)V2A—O13—Na2A60.9 (15)
O18—Na11—O12i70.1 (8)V2—O13—Na2A87.5 (15)
O18—Na11—O17xi143.6 (10)Si5—O13—Na12iv115.5 (13)
O12i—Na11—O17xi97.6 (10)V2A—O13—Na12iv103.1 (11)
O18—Na11—O11v99.8 (11)V2—O13—Na12iv87.8 (9)
O12i—Na11—O11v137.2 (11)Na2A—O13—Na12iv81.4 (14)
O17xi—Na11—O11v65.4 (7)Si5—O13—Na22125.7 (15)
O18—Na11—OW1126.3 (15)V2A—O13—Na2272.6 (10)
O12i—Na11—OW1135.9 (15)V2—O13—Na22101.8 (11)
O17xi—Na11—OW186.8 (14)Na2A—O13—Na2215.3 (14)
O11v—Na11—OW184.4 (14)Na12iv—O13—Na2287.4 (10)
O18—Na11—V1xi105.7 (8)Si6—O14—V2134.6 (15)
O12i—Na11—V1xi101.2 (8)Si6—O14—V2A125.4 (14)
O17xi—Na11—V1xi41.4 (6)V2—O14—V2A34.6 (7)
O11v—Na11—V1xi39.7 (6)Si6—O14—Na12iii117.8 (15)
OW1—Na11—V1xi110.1 (13)V2—O14—Na12iii104.1 (10)
O18—Na11—V138.4 (6)V2A—O14—Na12iii89.2 (11)
O12i—Na11—V136.0 (6)Si8—O15—V2Ax136.0 (16)
O17xi—Na11—V1114.3 (8)Si8—O15—V2x130.9 (14)
O11v—Na11—V1113.1 (8)V2Ax—O15—V2x34.9 (7)
OW1—Na11—V1156.5 (13)Si8—O15—Na2Ax119.3 (19)
V1xi—Na11—V193.1 (4)V2Ax—O15—Na2Ax64.6 (17)
O18—Na11—Na21xi146.2 (10)V2x—O15—Na2Ax96.4 (17)
O12i—Na11—Na21xi140.6 (10)Si8—O15—Na12iii117.0 (14)
O17xi—Na11—Na21xi45.5 (7)V2Ax—O15—Na12iii106.6 (11)
O11v—Na11—Na21xi49.7 (7)V2x—O15—Na12iii94.4 (9)
OW1—Na11—Na21xi48.3 (12)Na2Ax—O15—Na12iii89.1 (15)
V1xi—Na11—Na21xi62.2 (5)Si8—O15—Na22x121.9 (14)
V1—Na11—Na21xi155.1 (6)V2Ax—O15—Na22x65.8 (10)
O18—Na11—Si124.3 (6)V2x—O15—Na22x96.4 (11)
O12i—Na11—Si194.0 (7)Na2Ax—O15—Na22x4.7 (16)
O17xi—Na11—Si1138.6 (8)Na12iii—O15—Na22x84.4 (10)
O11v—Na11—Si179.2 (8)Si7—O16—V2x136.3 (15)
OW1—Na11—Si1111.3 (13)Si7—O16—V2Ax130.1 (14)
V1xi—Na11—Si197.4 (5)V2x—O16—V2Ax35.7 (7)
V1—Na11—Si160.0 (4)Si7—O16—Na12116.4 (14)
Na21xi—Na11—Si1122.2 (7)V2x—O16—Na12105.8 (10)
O18—Na11—Si4v78.0 (8)V2Ax—O16—Na1289.9 (10)
O12i—Na11—Si4v137.3 (9)Si2—O17—V1125.2 (13)
O17xi—Na11—Si4v91.5 (7)Si2—O17—Na21132.2 (14)
O11v—Na11—Si4v26.1 (5)V1—O17—Na2197.0 (9)
OW1—Na11—Si4v86.0 (12)Si2—O17—Na11ii115.2 (13)
V1xi—Na11—Si4v60.8 (4)V1—O17—Na11ii85.2 (9)
V1—Na11—Si4v102.8 (5)Na21—O17—Na11ii86.8 (9)
Na21xi—Na11—Si4v68.7 (5)Si1—O18—V1133.0 (14)
Si1—Na11—Si4v55.0 (4)Si1—O18—Na11117.8 (14)
O18—Na11—Si3i94.1 (7)V1—O18—Na1197.0 (9)
O12i—Na11—Si3i24.0 (5)Si5—O21—Si7iv152.1 (16)
O17xi—Na11—Si3i77.7 (8)Si3—O22—Si2xii154.2 (16)
O11v—Na11—Si3i134.2 (9)Si1viii—O23—Si4151.4 (16)
OW1—Na11—Si3i120.7 (13)Si8—O24—Si6146.3 (15)
V1xi—Na11—Si3i94.6 (5)Si3—O31—Si5137.8 (16)
V1—Na11—Si3i58.6 (4)Si6—O32—Si4v137.0 (16)
Na21xi—Na11—Si3i117.3 (7)Si2—O33—Si7v134.5 (15)
Si1—Na11—Si3i117.9 (5)Si8—O34—Si1136.9 (15)
Si4v—Na11—Si3i149.9 (6)Si8—O41—Si7129.7 (14)
O18—Na11—Si2xi138.7 (9)Si1—O42—Si2130.4 (14)
O12i—Na11—Si2xi75.6 (8)Si3—O43—Si4130.2 (14)
O17xi—Na11—Si2xi25.0 (5)Si5—O44—Si6132.1 (14)
O11v—Na11—Si2xi89.9 (7)V1—OV1—Na21ii155.7 (16)
OW1—Na11—Si2xi94.4 (13)V2x—OV2—V2A152 (2)
V1xi—Na11—Si2xi59.2 (4)V2x—OV2—Na2A143 (2)
V1—Na11—Si2xi101.0 (5)V2A—OV2—Na2A65.0 (16)
Na21xi—Na11—Si2xi65.2 (5)V2x—OV2—Na22129.8 (18)
Si1—Na11—Si2xi150.7 (6)V2A—OV2—Na2276.7 (13)
Si4v—Na11—Si2xi115.8 (5)Na2A—OV2—Na2216.4 (15)
Si3i—Na11—Si2xi53.7 (4)Na21xi—OW1—Na1181.6 (16)
O16—Na12—OW2139.2 (14)Na12—OW2—Na22ix88.5 (13)
O16—Na12—O14x65.7 (8)Na12—OW2—Na2Aix77.9 (14)
OW2—Na12—O14x133.0 (14)Na22ix—OW2—Na2Aix14.0 (11)
O16—Na12—O15x125.3 (10)Na22—OW4—Na2A2.3 (17)
OW2—Na12—O15x93.0 (12)Na22—OW6—Na2A16.2 (14)
Symmetry codes: (i) x, y+1/2, z+1; (ii) x, y+1/2, z; (iii) x+1, y1/2, z+1; (iv) x, y1, z; (v) x, y, z1; (vi) x, y+1, z1; (vii) x, y1/2, z+1; (viii) x, y, z+1; (ix) x, y+1, z; (x) x+1, y+1/2, z+1; (xi) x, y1/2, z; (xii) x, y1, z+1.
(III) top
Crystal data top
H0Na2O11Si4VF(000) = 756
Mr = 385.28Dx = 2.202 Mg m3
Monoclinic, P21Mo Kα radiation, λ = 0.71073 Å
a = 12.584 (16) ÅCell parameters from 1536 reflections
b = 9.525 (13) Åθ = 1.6–21.0°
c = 9.696 (14) ŵ = 1.39 mm1
β = 90.10 (4)°T = 398 K
V = 1162 (3) Å3Prismatic, blue
Z = 40.10 × 0.05 × 0.03 mm
Data collection top
Bruker D8 Venture
diffractometer
Rint = 0.082
Absorption correction: multi-scan
(SADABS; Bruker, 2003)
θmax = 21.0°, θmin = 2.7°
h = 711
1536 measured reflectionsk = 95
1081 independent reflectionsl = 99
610 reflections with I > 2σ(I)
Refinement top
Refinement on F283 restraints
Least-squares matrix: fullH-atom parameters not defined
R[F2 > 2σ(F2)] = 0.113 w = 1/[σ2(Fo2) + (0.2P)2]
where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.322(Δ/σ)max = 0.110
S = 1.06Δρmax = 1.02 e Å3
1081 reflectionsΔρmin = 1.02 e Å3
137 parametersAbsolute structure: Twinning involves inversion, so Flack parameter cannot be determined
Special details top

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

Refinement. Refined as a 2-component inversion twin.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
V10.014 (2)0.6867 (19)0.0266 (19)0.047 (3)*
V20.485 (3)0.279 (3)0.476 (3)0.047 (3)*0.622
V2A0.507 (3)0.204 (4)0.536 (4)0.047 (3)*0.378
Si10.247 (2)0.3311 (18)0.026 (2)0.0443 (18)*
Si20.1601 (19)0.151 (2)0.244 (2)0.0443 (18)*
Si30.164 (2)0.822 (2)0.247 (2)0.0443 (18)*
Si40.247 (2)0.6525 (18)0.023 (2)0.0443 (18)*
Si50.256 (2)0.8339 (17)0.517 (2)0.0443 (18)*
Si60.337 (2)0.651 (2)0.747 (2)0.0443 (18)*
Si70.249 (2)0.1485 (18)0.519 (2)0.0443 (18)*
Si80.333 (2)0.322 (2)0.746 (2)0.0443 (18)*
Na110.085 (4)0.491 (3)0.210 (6)0.064 (5)*
Na120.417 (4)0.002 (4)0.286 (5)0.064 (5)*
Na210.099 (4)0.371 (4)0.225 (6)0.077 (10)*
Na220.586 (8)0.130 (9)0.741 (10)0.077 (10)*0.622
Na2A0.622 (11)0.127 (15)0.715 (17)0.077 (10)*0.378
O110.124 (3)0.665 (4)0.033 (5)0.041 (3)*
O120.054 (3)0.790 (4)0.189 (4)0.041 (3)*
O130.370 (3)0.820 (4)0.457 (5)0.041 (3)*
O140.455 (3)0.669 (4)0.683 (4)0.041 (3)*
O150.447 (3)0.303 (4)0.681 (5)0.041 (3)*
O160.364 (3)0.165 (4)0.449 (4)0.041 (3)*
O170.046 (3)0.175 (5)0.169 (4)0.041 (3)*
O180.129 (3)0.326 (4)0.041 (5)0.041 (3)*
O210.226 (3)0.985 (2)0.563 (3)0.042 (5)*
O220.192 (3)0.983 (2)0.240 (3)0.042 (5)*
O230.281 (3)0.491 (2)0.061 (3)0.042 (5)*
O240.299 (3)0.487 (2)0.751 (3)0.042 (5)*
O310.170 (3)0.778 (3)0.407 (3)0.033 (5)*
O320.331 (3)0.716 (3)0.907 (3)0.033 (5)*
O330.156 (3)0.198 (3)0.410 (3)0.033 (5)*
O340.332 (3)0.269 (3)0.091 (3)0.033 (5)*
O410.242 (3)0.240 (3)0.662 (3)0.041 (5)*
O420.255 (3)0.240 (3)0.167 (3)0.041 (5)*
O430.257 (3)0.743 (3)0.169 (3)0.041 (5)*
O440.247 (3)0.737 (3)0.652 (3)0.041 (5)*
OV10.050 (4)0.545 (4)0.099 (5)0.018 (12)*
OV20.469 (10)0.447 (7)0.448 (12)0.10 (4)*0.622
OV2A0.495 (18)0.127 (17)0.690 (13)0.10 (4)*0.378
Geometric parameters (Å, º) top
V1—OV11.59 (4)Si5—O131.56 (3)
V1—O111.84 (4)Si5—O441.61 (3)
V1—O17i1.94 (5)Si5—O311.60 (3)
V1—O18i1.97 (5)Si5—Na21vii3.21 (6)
V1—O122.05 (4)Si5—Na2Aiii3.36 (14)
V1—Na113.21 (5)Si5—Na12viii3.40 (6)
V1—Na21i3.32 (6)Si6—O141.62 (3)
V1—Na11i3.52 (4)Si6—O241.64 (3)
V2—V2A0.96 (4)Si6—O441.67 (3)
V2—OV21.64 (7)Si6—O321.68 (3)
V2—O161.89 (5)Si6—Na12iii3.44 (5)
V2—O13ii1.98 (5)Si7—O161.61 (3)
V2—O14ii2.01 (5)Si7—O411.64 (3)
V2—O152.05 (5)Si7—O21iv1.64 (3)
V2—Na223.20 (11)Si7—O331.65 (3)
V2—Na2A3.23 (16)Si7—Na123.41 (6)
V2—Na123.36 (5)Si8—O151.58 (3)
V2—Na12iii3.35 (5)Si8—O411.61 (3)
V2A—OV2A1.67 (8)Si8—O241.63 (3)
V2A—O151.85 (6)Si8—O34ix1.66 (3)
V2A—O13ii1.90 (5)Na11—O182.33 (6)
V2A—O162.02 (5)Na11—O112.44 (6)
V2A—O14ii2.20 (6)Na11—O17i2.44 (6)
V2A—Na222.33 (11)Na11—O12v2.60 (6)
V2A—Na2A2.37 (16)Na11—O24vi2.73 (7)
V2A—Na123.32 (6)Na11—Na21i3.63 (5)
V2A—Na12iii3.42 (5)Na12—O14ii2.31 (6)
Si1—O181.62 (3)Na12—O162.33 (6)
Si1—O231.62 (3)Na12—O13iv2.45 (6)
Si1—O421.62 (3)Na12—O15ii2.55 (6)
Si1—O341.66 (3)Na12—O22iv2.86 (7)
Si1—Na113.42 (6)Na21—OV12.15 (6)
Si2—O171.62 (3)Na21—O44x2.56 (6)
Si2—O421.64 (3)Na21—O172.66 (6)
Si2—O22iv1.65 (3)Na21—O11v2.72 (6)
Si2—O331.67 (3)Na21—O21x2.82 (7)
Si2—Na11v3.46 (5)Na22—Na2A0.53 (18)
Si3—O121.52 (3)Na22—OV2A1.25 (19)
Si3—O431.58 (3)Na22—O43ii2.42 (11)
Si3—O221.58 (3)Na22—O152.47 (10)
Si3—O311.60 (3)Na22—OV2ii2.62 (12)
Si3—Na2Aiii3.29 (14)Na22—O13ii2.70 (10)
Si4—O231.63 (3)Na22—O23ii2.87 (11)
Si4—O111.64 (3)Na2A—OV2A1.6 (3)
Si4—O32vi1.66 (3)Na2A—O43ii2.19 (16)
Si4—O431.66 (3)Na2A—O13ii2.48 (15)
Si4—Na2Aiii3.03 (17)Na2A—OV2ii2.60 (18)
Si4—Na22iii3.11 (11)Na2A—O152.79 (16)
Si4—Na113.41 (6)Na2A—O23ii2.81 (16)
Si5—O211.56 (3)O15—OV2A1.78 (18)
OV1—V1—O11109 (2)O22iv—Na12—V2ii116.1 (17)
OV1—V1—O17i109 (2)V2A—Na12—V2ii74.9 (13)
O11—V1—O17i83 (2)V2—Na12—V2ii91.4 (12)
OV1—V1—O18i109 (2)O14ii—Na12—Si792.9 (17)
O11—V1—O18i142.2 (19)O16—Na12—Si724.5 (10)
O17i—V1—O18i87 (2)O13iv—Na12—Si772.1 (18)
OV1—V1—O12101 (2)O15ii—Na12—Si7130 (2)
O11—V1—O1285 (2)O22iv—Na12—Si760.9 (13)
O17i—V1—O12150.2 (19)V2A—Na12—Si758.6 (11)
O18i—V1—O1285.7 (19)V2—Na12—Si757.4 (11)
OV1—V1—Na1186.3 (18)V2ii—Na12—Si791.9 (14)
O11—V1—Na1149.1 (16)O14ii—Na12—Si5iv131 (2)
O17i—V1—Na1149.5 (16)O16—Na12—Si5iv72.4 (18)
O18i—V1—Na11136.6 (19)O13iv—Na12—Si5iv24.6 (10)
O12—V1—Na11132.3 (19)O15ii—Na12—Si5iv88.9 (15)
OV1—V1—Na21i154 (2)O22iv—Na12—Si5iv59.5 (13)
O11—V1—Na21i55.0 (16)V2A—Na12—Si5iv89.7 (15)
O17i—V1—Na21i53.3 (16)V2—Na12—Si5iv99.0 (15)
O18i—V1—Na21i90.4 (16)V2ii—Na12—Si5iv58.6 (10)
O12—V1—Na21i97.8 (17)Si7—Na12—Si5iv52.2 (10)
Na11—V1—Na21i67.5 (11)O14ii—Na12—Si6ii23.8 (10)
OV1—V1—Na11i114 (2)O16—Na12—Si6ii91.8 (17)
O11—V1—Na11i119.4 (17)O13iv—Na12—Si6ii125 (2)
O17i—V1—Na11i119.1 (17)O15ii—Na12—Si6ii73.4 (15)
O18i—V1—Na11i38.9 (15)O22iv—Na12—Si6ii153.6 (16)
O12—V1—Na11i47.0 (15)V2A—Na12—Si6ii60.6 (12)
Na11—V1—Na11i160.1 (10)V2—Na12—Si6ii58.9 (10)
Na21i—V1—Na11i92.6 (11)V2ii—Na12—Si6ii89.7 (14)
V2A—V2—OV2149 (5)Si7—Na12—Si6ii116.3 (14)
V2A—V2—O1684 (3)Si5iv—Na12—Si6ii142.4 (17)
OV2—V2—O16116 (5)O14ii—Na12—V2Aii108 (2)
V2A—V2—O13ii71 (3)O16—Na12—V2Aii107 (2)
OV2—V2—O13ii88 (4)O13iv—Na12—V2Aii32.7 (12)
O16—V2—O13ii155 (2)O15ii—Na12—V2Aii32.0 (13)
V2A—V2—O14ii88 (3)O22iv—Na12—V2Aii108.3 (16)
OV2—V2—O14ii115 (5)V2A—Na12—V2Aii91.2 (12)
O16—V2—O14ii84 (2)V2—Na12—V2Aii107.7 (15)
O13ii—V2—O14ii90 (2)V2ii—Na12—V2Aii16.3 (7)
V2A—V2—O1564 (3)Si7—Na12—V2Aii100.5 (15)
OV2—V2—O1591 (5)Si5iv—Na12—V2Aii57.3 (10)
O16—V2—O1591 (2)Si6ii—Na12—V2Aii98.1 (14)
O13ii—V2—O1582.8 (19)OV1—Na21—O44x149 (3)
O14ii—V2—O15152 (2)OV1—Na21—O17103 (3)
V2A—V2—Na2221 (3)O44x—Na21—O17104.3 (17)
OV2—V2—Na22128 (4)OV1—Na21—O11v101 (2)
O16—V2—Na22100 (2)O44x—Na21—O11v82.8 (18)
O13ii—V2—Na2257 (2)O17—Na21—O11v55.7 (15)
O14ii—V2—Na22104 (2)OV1—Na21—O21x106.0 (18)
O15—V2—Na2250.6 (18)O44x—Na21—O21x55.8 (15)
V2A—V2—Na2A23 (3)O17—Na21—O21x144 (2)
OV2—V2—Na2A128 (5)O11v—Na21—O21x135 (2)
O16—V2—Na2A106 (3)OV1—Na21—Si5x135 (2)
O13ii—V2—Na2A50 (3)O44x—Na21—Si5x29.7 (9)
O14ii—V2—Na2A97 (3)O17—Na21—Si5x120.3 (18)
O15—V2—Na2A59 (3)O11v—Na21—Si5x112.5 (18)
Na22—V2—Na2A9 (3)O21x—Na21—Si5x29.0 (8)
V2A—V2—Na1280 (3)OV1—Na21—V1v83 (2)
OV2—V2—Na12131 (4)O44x—Na21—V1v113.0 (15)
O16—V2—Na1242.2 (16)O17—Na21—V1v35.8 (12)
O13ii—V2—Na12124.9 (18)O11v—Na21—V1v33.5 (10)
O14ii—V2—Na1242.3 (15)O21x—Na21—V1v168.4 (19)
O15—V2—Na12124.1 (18)Si5x—Na21—V1v141.0 (13)
Na22—V2—Na12100.9 (18)OV1—Na21—Na11v137 (3)
Na2A—V2—Na12100 (3)O44x—Na21—Na11v63.6 (14)
V2A—V2—Na12iii86 (3)O17—Na21—Na11v42.3 (14)
OV2—V2—Na12iii63 (4)O11v—Na21—Na11v42.3 (13)
O16—V2—Na12iii139 (2)O21x—Na21—Na11v116.2 (19)
O13ii—V2—Na12iii46.4 (15)Si5x—Na21—Na11v87.2 (14)
O14ii—V2—Na12iii136 (2)V1v—Na21—Na11v54.8 (12)
O15—V2—Na12iii49.5 (15)Na2A—Na22—OV2A127 (10)
Na22—V2—Na12iii65.0 (18)Na2A—Na22—V2A88 (10)
Na2A—V2—Na12iii66 (3)OV2A—Na22—V2A44 (6)
Na12—V2—Na12iii165.7 (15)Na2A—Na22—O43ii58 (10)
V2—V2A—OV2A147 (8)OV2A—Na22—O43ii155 (10)
V2—V2A—O1588 (4)V2A—Na22—O43ii121 (4)
OV2A—V2A—O1561 (7)Na2A—Na22—O15122 (10)
V2—V2A—O13ii80 (3)OV2A—Na22—O1543 (9)
OV2A—V2A—O13ii108 (8)V2A—Na22—O1545 (2)
O15—V2A—O13ii91 (2)O43ii—Na22—O15111 (4)
V2—V2A—O1668 (3)Na2A—Na22—OV2ii82 (10)
OV2A—V2A—O16102 (8)OV2A—Na22—OV2ii58 (10)
O15—V2A—O1693 (3)V2A—Na22—OV2ii60 (3)
O13ii—V2A—O16148 (3)O43ii—Na22—OV2ii140 (4)
V2—V2A—O14ii66 (3)O15—Na22—OV2ii95 (4)
OV2A—V2A—O14ii145 (6)Na2A—Na22—O13ii60 (10)
O15—V2A—O14ii154 (3)OV2A—Na22—O13ii85 (8)
O13ii—V2A—O14ii87 (2)V2A—Na22—O13ii44 (2)
O16—V2A—O14ii76 (2)O43ii—Na22—O13ii78 (3)
V2—V2A—Na22150 (4)O15—Na22—O13ii62 (3)
OV2A—V2A—Na2231 (7)OV2ii—Na22—O13ii90 (4)
O15—V2A—Na2272 (3)Na2A—Na22—O23ii78 (10)
O13ii—V2A—Na2279 (3)OV2A—Na22—O23ii143 (9)
O16—V2A—Na22133 (3)V2A—Na22—O23ii163 (4)
O14ii—V2A—Na22133 (3)O43ii—Na22—O23ii59 (2)
V2—V2A—Na2A148 (5)O15—Na22—O23ii152 (3)
OV2A—V2A—Na2A43 (8)OV2ii—Na22—O23ii108 (4)
O15—V2A—Na2A82 (4)O13ii—Na22—O23ii131 (4)
O13ii—V2A—Na2A70 (4)Na2A—Na22—Si4ii77 (10)
O16—V2A—Na2A142 (4)OV2A—Na22—Si4ii156 (8)
O14ii—V2A—Na2A122 (4)V2A—Na22—Si4ii153 (4)
Na22—V2A—Na2A13 (4)O43ii—Na22—Si4ii32.0 (15)
V2—V2A—Na1284 (3)O15—Na22—Si4ii127 (3)
OV2A—V2A—Na12111 (7)OV2ii—Na22—Si4ii138 (4)
O15—V2A—Na12136 (2)O13ii—Na22—Si4ii110 (3)
O13ii—V2A—Na12130 (2)O23ii—Na22—Si4ii31.4 (12)
O16—V2A—Na1243.9 (16)Na2A—Na22—V289 (10)
O14ii—V2A—Na1243.8 (15)OV2A—Na22—V248 (7)
Na22—V2A—Na12126 (3)V2A—Na22—V28.6 (11)
Na2A—V2A—Na12124 (4)O43ii—Na22—V2114 (3)
V2—V2A—Na12iii77 (3)O15—Na22—V239.9 (19)
OV2A—V2A—Na12iii86 (7)OV2ii—Na22—V268 (3)
O15—V2A—Na12iii46.9 (17)O13ii—Na22—V238.0 (17)
O13ii—V2A—Na12iii44.1 (16)O23ii—Na22—V2167 (3)
O16—V2A—Na12iii128 (2)Si4ii—Na22—V2146 (3)
O14ii—V2A—Na12iii123.4 (19)Na2A—Na22—Na12iii91 (10)
Na22—V2A—Na12iii73 (2)OV2A—Na22—Na12iii89 (10)
Na2A—V2A—Na12iii73 (4)V2A—Na22—Na12iii68 (3)
Na12—V2A—Na12iii161.1 (17)O43ii—Na22—Na12iii66 (2)
O18—Si1—O23110.3 (15)O15—Na22—Na12iii46.4 (18)
O18—Si1—O42111.8 (16)OV2ii—Na22—Na12iii127 (4)
O23—Si1—O42108.1 (14)O13ii—Na22—Na12iii43.9 (19)
O18—Si1—O34107.9 (15)O23ii—Na22—Na12iii121 (3)
O23—Si1—O34108.4 (15)Si4ii—Na22—Na12iii90 (2)
O42—Si1—O34110.2 (15)V2—Na22—Na12iii59.6 (19)
O18—Si1—Na1136.9 (17)Na22—Na2A—OV2A38 (10)
O23—Si1—Na1182.9 (15)Na22—Na2A—O43ii110 (10)
O42—Si1—Na11146.7 (19)OV2A—Na2A—O43ii140 (10)
O34—Si1—Na1194.9 (17)Na22—Na2A—V2A79 (10)
O17—Si2—O42111.2 (15)OV2A—Na2A—V2A45 (5)
O17—Si2—O22iv109.8 (15)O43ii—Na2A—V2A130 (6)
O42—Si2—O22iv107.8 (15)Na22—Na2A—O13ii109 (10)
O17—Si2—O33111.5 (16)OV2A—Na2A—O13ii87 (7)
O42—Si2—O33109.3 (15)O43ii—Na2A—O13ii87 (5)
O22iv—Si2—O33107.1 (14)V2A—Na2A—O13ii46 (3)
O17—Si2—Na11v39.8 (17)Na22—Na2A—OV2ii86 (10)
O42—Si2—Na11v146.0 (17)OV2A—Na2A—OV2ii58 (8)
O22iv—Si2—Na11v77.7 (15)O43ii—Na2A—OV2ii162 (7)
O33—Si2—Na11v100.4 (16)V2A—Na2A—OV2ii59 (4)
O12—Si3—O43113.6 (16)O13ii—Na2A—OV2ii96 (6)
O12—Si3—O22112.3 (17)Na22—Na2A—O1549 (10)
O43—Si3—O22105.8 (15)OV2A—Na2A—O1537 (6)
O12—Si3—O31110.5 (17)O43ii—Na2A—O15108 (6)
O43—Si3—O31107.4 (16)V2A—Na2A—O1541 (3)
O22—Si3—O31106.7 (15)O13ii—Na2A—O1560 (4)
O12—Si3—Na2Aiii132 (3)OV2ii—Na2A—O1588 (5)
O43—Si3—Na2Aiii35 (3)Na22—Na2A—O23ii91 (10)
O22—Si3—Na2Aiii112 (3)OV2A—Na2A—O23ii123 (8)
O31—Si3—Na2Aiii73 (3)O43ii—Na2A—O23ii62 (4)
O23—Si4—O11112.9 (16)V2A—Na2A—O23ii166 (6)
O23—Si4—O32vi109.1 (15)O13ii—Na2A—O23ii148 (6)
O11—Si4—O32vi110.5 (15)OV2ii—Na2A—O23ii111 (5)
O23—Si4—O43106.0 (14)O15—Na2A—O23ii136 (6)
O11—Si4—O43108.2 (15)Na22—Na2A—Si4ii94 (10)
O32vi—Si4—O43110.1 (14)OV2A—Na2A—Si4ii131 (9)
O23—Si4—Na2Aiii66 (3)O43ii—Na2A—Si4ii32 (3)
O11—Si4—Na2Aiii142 (3)V2A—Na2A—Si4ii156 (6)
O32vi—Si4—Na2Aiii104 (3)O13ii—Na2A—Si4ii119 (5)
O43—Si4—Na2Aiii45 (3)OV2ii—Na2A—Si4ii143 (6)
O23—Si4—Na22iii66 (2)O15—Na2A—Si4ii119 (6)
O11—Si4—Na22iii152 (2)O23ii—Na2A—Si4ii32.2 (19)
O32vi—Si4—Na22iii95.2 (19)Na22—Na2A—V282 (10)
O43—Si4—Na22iii50 (2)OV2A—Na2A—V251 (5)
Na2Aiii—Si4—Na22iii10 (3)O43ii—Na2A—V2121 (5)
O23—Si4—Na1183.1 (15)V2A—Na2A—V29.1 (14)
O11—Si4—Na1141.7 (18)O13ii—Na2A—V238 (2)
O32vi—Si4—Na1195.5 (17)OV2ii—Na2A—V268 (4)
O43—Si4—Na11147 (2)O15—Na2A—V239 (2)
Na2Aiii—Si4—Na11147 (3)O23ii—Na2A—V2173 (5)
Na22iii—Si4—Na11149.1 (18)Si4ii—Na2A—V2149 (5)
O21—Si5—O13114.3 (17)Na22—Na2A—Si5ii134 (10)
O21—Si5—O44106.2 (15)OV2A—Na2A—Si5ii111 (7)
O13—Si5—O44108.5 (16)O43ii—Na2A—Si5ii74 (4)
O21—Si5—O31109.9 (15)V2A—Na2A—Si5ii67 (4)
O13—Si5—O31109.8 (16)O13ii—Na2A—Si5ii25.7 (16)
O44—Si5—O31107.9 (14)OV2ii—Na2A—Si5ii100 (6)
O21—Si5—Na21vii61.6 (14)O15—Na2A—Si5ii86 (4)
O13—Si5—Na21vii150.5 (19)O23ii—Na2A—Si5ii126 (5)
O44—Si5—Na21vii52.1 (15)Si4ii—Na2A—Si5ii105 (4)
O31—Si5—Na21vii98.3 (17)V2—Na2A—Si5ii60 (3)
O21—Si5—Na2Aiii148 (3)Na22—Na2A—Si3ii130 (10)
O13—Si5—Na2Aiii44 (3)OV2A—Na2A—Si3ii146 (9)
O44—Si5—Na2Aiii104 (3)O43ii—Na2A—Si3ii24.5 (18)
O31—Si5—Na2Aiii70 (3)V2A—Na2A—Si3ii114 (5)
Na21vii—Si5—Na2Aiii150 (3)O13ii—Na2A—Si3ii68 (3)
O21—Si5—Na12viii84.7 (16)OV2ii—Na2A—Si3ii143 (6)
O13—Si5—Na12viii40.9 (17)O15—Na2A—Si3ii109 (4)
O44—Si5—Na12viii147.3 (19)O23ii—Na2A—Si3ii80 (4)
O31—Si5—Na12viii96.5 (17)Si4ii—Na2A—Si3ii55 (3)
Na21vii—Si5—Na12viii146.1 (12)V2—Na2A—Si3ii105 (4)
Na2Aiii—Si5—Na12viii64 (3)Si5ii—Na2A—Si3ii51 (2)
O14—Si6—O24112.0 (16)Si4—O11—V1142 (3)
O14—Si6—O44111.2 (16)Si4—O11—Na11112 (2)
O24—Si6—O44106.7 (14)V1—O11—Na1196 (2)
O14—Si6—O32111.0 (16)Si4—O11—Na21i113 (2)
O24—Si6—O32108.5 (14)V1—O11—Na21i91.4 (19)
O44—Si6—O32107.2 (14)Na11—O11—Na21i89.1 (17)
O14—Si6—Na12iii35.0 (17)Si3—O12—V1139 (3)
O24—Si6—Na12iii81.9 (15)Si3—O12—Na11i116 (2)
O44—Si6—Na12iii140.2 (17)V1—O12—Na11i98 (2)
O32—Si6—Na12iii106.5 (16)Si5—O13—V2Aiii142 (3)
O16—Si7—O41111.0 (16)Si5—O13—V2iii138 (3)
O16—Si7—O21iv111.1 (16)V2Aiii—O13—V2iii28.7 (14)
O41—Si7—O21iv106.1 (14)Si5—O13—Na2Aiii111 (4)
O16—Si7—O33109.9 (15)V2Aiii—O13—Na2Aiii64 (4)
O41—Si7—O33110.3 (14)V2iii—O13—Na2Aiii92 (4)
O21iv—Si7—O33108.4 (14)Si5—O13—Na12viii115 (2)
O16—Si7—Na1236.9 (17)V2Aiii—O13—Na12viii103 (2)
O41—Si7—Na12144.9 (18)V2iii—O13—Na12viii98 (2)
O21iv—Si7—Na1283.4 (15)Na2Aiii—O13—Na12viii93 (4)
O33—Si7—Na1297.8 (16)Si5—O13—Na22iii121 (3)
O15—Si8—O41113.0 (16)V2Aiii—O13—Na22iii58 (3)
O15—Si8—O24110.9 (16)V2iii—O13—Na22iii85 (3)
O41—Si8—O24107.0 (15)Na2Aiii—O13—Na22iii11 (4)
O15—Si8—O34ix111.1 (16)Na12viii—O13—Na22iii86 (2)
O41—Si8—O34ix109.0 (15)Si6—O14—V2iii134 (3)
O24—Si8—O34ix105.5 (14)Si6—O14—V2Aiii126 (2)
O18—Na11—O1185 (2)V2iii—O14—V2Aiii25.9 (12)
O18—Na11—O17i122 (3)Si6—O14—Na12iii121 (2)
O11—Na11—O17i62.0 (17)V2iii—O14—Na12iii102 (2)
O18—Na11—O12v67.1 (16)V2Aiii—O14—Na12iii95 (2)
O11—Na11—O12v126 (3)Si8—O15—OV2A113 (7)
O17i—Na11—O12v94 (2)Si8—O15—V2A137 (3)
O18—Na11—O24vi81.7 (19)OV2A—O15—V2A55 (4)
O11—Na11—O24vi85 (2)Si8—O15—V2128 (2)
O17i—Na11—O24vi134.6 (18)OV2A—O15—V282 (4)
O12v—Na11—O24vi131.8 (17)V2A—O15—V228.0 (15)
O18—Na11—V189 (2)Si8—O15—Na22128 (3)
O11—Na11—V134.7 (12)OV2A—O15—Na2229 (7)
O17i—Na11—V137.2 (13)V2A—O15—Na2263 (3)
O12v—Na11—V196.4 (19)V2—O15—Na2290 (2)
O24vi—Na11—V1119.5 (18)Si8—O15—Na12iii118 (2)
O18—Na11—Si472.3 (18)OV2A—O15—Na12iii117 (8)
O11—Na11—Si426.6 (9)V2A—O15—Na12iii101 (2)
O17i—Na11—Si488.3 (15)V2—O15—Na12iii93 (2)
O12v—Na11—Si4133 (2)Na22—O15—Na12iii89 (3)
O24vi—Na11—Si460.6 (14)Si8—O15—Na2A138 (4)
V1—Na11—Si459.6 (10)OV2A—O15—Na2A33 (8)
O18—Na11—Si124.6 (10)V2A—O15—Na2A57 (4)
O11—Na11—Si173.4 (17)V2—O15—Na2A82 (4)
O17i—Na11—Si1128 (2)Na22—O15—Na2A9 (4)
O12v—Na11—Si191.3 (15)Na12iii—O15—Na2A84 (3)
O24vi—Na11—Si159.8 (13)Si7—O16—V2136 (3)
V1—Na11—Si190.7 (15)Si7—O16—V2A130 (3)
Si4—Na11—Si153.3 (10)V2—O16—V2A28.3 (13)
O18—Na11—Si2i125 (2)Si7—O16—Na12119 (2)
O11—Na11—Si2i86.8 (16)V2—O16—Na12105 (2)
O17i—Na11—Si2i25.2 (9)V2A—O16—Na1299 (2)
O12v—Na11—Si2i74.5 (15)Si2—O17—V1v129 (3)
O24vi—Na11—Si2i151.1 (17)Si2—O17—Na11v115 (2)
V1—Na11—Si2i57.7 (10)V1v—O17—Na11v93 (2)
Si4—Na11—Si2i113.3 (13)Si2—O17—Na21128 (2)
Si1—Na11—Si2i142.4 (18)V1v—O17—Na2190.9 (19)
O18—Na11—V1v32.0 (12)Na11v—O17—Na2190.5 (16)
O11—Na11—V1v105 (2)Si1—O18—V1v132 (2)
O17i—Na11—V1v109.7 (19)Si1—O18—Na11118 (2)
O12v—Na11—V1v35.2 (11)V1v—O18—Na11109 (2)
O24vi—Na11—V1v108.3 (15)Si5—O21—Si7viii140 (2)
V1—Na11—V1v91.0 (14)Si5—O21—Na21vii89.4 (16)
Si4—Na11—V1v101.0 (14)Si7viii—O21—Na21vii131.0 (18)
Si1—Na11—V1v56.5 (9)Si3—O22—Si2viii152 (2)
Si2i—Na11—V1v100.6 (14)Si3—O22—Na12viii105.3 (17)
O18—Na11—Na21i133 (2)Si2viii—O22—Na12viii100.9 (17)
O11—Na11—Na21i48.6 (14)Si4—O23—Si1140 (2)
O17i—Na11—Na21i47.2 (13)Si4—O23—Na2Aiii82 (3)
O12v—Na11—Na21i140 (2)Si1—O23—Na2Aiii135 (4)
O24vi—Na11—Na21i87.8 (17)Si4—O23—Na22iii83 (2)
V1—Na11—Na21i57.8 (11)Si1—O23—Na22iii137 (2)
Si4—Na11—Na21i63.1 (12)Na2Aiii—O23—Na22iii11 (4)
Si1—Na11—Na21i116.3 (18)Si8—O24—Si6148 (2)
Si2i—Na11—Na21i66.2 (13)Si8—O24—Na11ix106.0 (17)
V1v—Na11—Na21i149 (2)Si6—O24—Na11ix106.1 (17)
O14ii—Na12—O1668.4 (18)Si3—O31—Si5126 (2)
O14ii—Na12—O13iv125 (3)Si4ix—O32—Si6122 (2)
O16—Na12—O13iv87 (2)Si7—O33—Si2121 (2)
O14ii—Na12—O15ii92 (2)Si8vi—O34—Si1123 (2)
O16—Na12—O15ii127 (3)Si8—O41—Si7130 (2)
O13iv—Na12—O15ii64.5 (16)Si1—O42—Si2128 (2)
O14ii—Na12—O22iv138.1 (19)Si3—O43—Si4127 (2)
O16—Na12—O22iv82 (2)Si3—O43—Na2Aiii121 (4)
O13iv—Na12—O22iv80.4 (19)Si4—O43—Na2Aiii103 (4)
O15ii—Na12—O22iv130.3 (17)Si3—O43—Na22iii130 (3)
O14ii—Na12—V2A41.4 (15)Si4—O43—Na22iii98 (3)
O16—Na12—V2A37.0 (14)Na2Aiii—O43—Na22iii12 (5)
O13iv—Na12—V2A90 (2)Si5—O44—Si6133 (2)
O15ii—Na12—V2A96.2 (19)Si5—O44—Na21vii98.2 (18)
O22iv—Na12—V2A118.8 (19)Si6—O44—Na21vii119.0 (19)
O14ii—Na12—V235.9 (14)V1—OV1—Na21172 (3)
O16—Na12—V232.9 (13)V2—OV2—Na2Aiii143 (7)
O13iv—Na12—V2104 (2)V2—OV2—Na22iii143 (7)
O15ii—Na12—V2109.9 (19)Na2Aiii—OV2—Na22iii12 (4)
O22iv—Na12—V2112.2 (17)Na22—OV2A—Na2A15 (9)
V2A—Na12—V216.6 (7)Na22—OV2A—V2A105 (10)
O14ii—Na12—V2ii95.3 (19)Na2A—OV2A—V2A92 (10)
O16—Na12—V2ii94 (2)Na22—OV2A—O15108 (10)
O13iv—Na12—V2ii35.8 (13)Na2A—OV2A—O15110 (10)
O15ii—Na12—V2ii37.8 (14)V2A—OV2A—O1565 (5)
Symmetry codes: (i) x, y+1/2, z; (ii) x+1, y1/2, z+1; (iii) x+1, y+1/2, z+1; (iv) x, y1, z; (v) x, y1/2, z; (vi) x, y, z1; (vii) x, y+1/2, z+1; (viii) x, y+1, z; (ix) x, y, z+1; (x) x, y1/2, z+1.
 

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