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The structures of two polymorphs, both monoclinic P21/n [polymorph (I)] and P21/c [polymorph (II)], of di-μ-thiocyanato-κ2N:S2S:N-bis[bis(tri-p-fluorophenylphosphine-κP)silver(I)] complexes have been determined at 100 K. In both polymorphs the complex has a dinuclear structure where the silver(I) coordinates to two phosphine ligands and two bridging thiocyanate anions to form complexes with distorted tetrahedral geometry. Polymorph (I) has just one half of the [Ag2(SCN)2{P(4-FC6H4)3}4] molecule at (0, ½, 0) from the origin in the asymmetric unit. Polymorph (II) has one and a half molecules of [Ag2(SCN)2{P(4-FC6H4)3}4] in the asymmetric unit; the half molecule is situated at (0, 1, ½), while the full molecule is located at (1/3, ½, 1/3) from the origin. The Ag—P bond distances range from 2.4437 (4) to 2.4956 (7) Å in both polymorphs. The Ag—S distances are 2.5773 (7) Å in (I) and 2.5457 (5), 2.5576 (5) and 2.5576 (5) Å in (II). The full molecule in polymorph (II) has slightly shorter Ag—N bond distances [2.375 (1) and 2.367 (2) Å] compared with the half molecules in both polymorphs [2.409 (2) Å in (II) and 2.395 (2) Å in (I)]. The two polymorphs are compared using r.m.s. overlay calculations as well as half-normal probability plot analysis.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S0108768109048769/zb5008sup1.cif
Contains datablocks global, I, II

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S0108768109048769/zb5008Isup2.hkl
Contains datablock I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S0108768109048769/zb5008IIsup3.hkl
Contains datablock 6frm28_0m

CCDC references: 774095; 774096

Computing details top

For both structures, data collection: Apex2 (Bruker, 2005); cell refinement: SAINT-Plus (Bruker, 2004); data reduction: SAINT-Plus and XPREP (Bruker 2004); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: DIAMOND 3.0c (Brandenburg & Putz, 2004); software used to prepare material for publication: WinGX (Farrugia, 1999).

(I) top
Crystal data top
C74H48Ag2F12N2P4S2F(000) = 1600
Mr = 1596.88Dx = 1.597 Mg m3
Monoclinic, P21/nMo Kα radiation, λ = 0.71069 Å
a = 8.7406 (3) ÅCell parameters from 31007 reflections
b = 15.4925 (6) Åθ = 1.7–28.3°
c = 24.5352 (10) ŵ = 0.83 mm1
β = 91.200 (1)°T = 100 K
V = 3321.7 (2) Å3Cuboid, colourless
Z = 20.26 × 0.2 × 0.1 mm
Data collection top
Bruker SMART CCD area detector
diffractometer
6764 reflections with I > 2σ(I)
π and ω scansRint = 0.052
Absorption correction: multi-scanθmax = 28.3°, θmin = 1.7°
Tmin = 0.813, Tmax = 0.922h = 711
30208 measured reflectionsk = 2019
8264 independent reflectionsl = 3232
Refinement top
Refinement on F20 restraints
Least-squares matrix: fullH-atom parameters constrained
R[F2 > 2σ(F2)] = 0.037 w = 1/[σ2(Fo2) + (0.047P)2]
where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.096(Δ/σ)max = 0.001
S = 1.05Δρmax = 0.61 e Å3
8264 reflectionsΔρmin = 0.66 e Å3
433 parameters
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.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Ag0.24731 (2)0.387087 (12)0.029580 (7)0.01305 (7)
P10.34755 (7)0.25819 (4)0.01573 (3)0.01212 (14)
P20.23004 (7)0.38734 (4)0.13098 (3)0.01256 (14)
N0.0244 (3)0.38592 (14)0.01490 (10)0.0203 (5)
C0.1435 (3)0.58143 (17)0.01444 (10)0.0152 (5)
S0.31401 (7)0.53404 (4)0.01305 (3)0.01801 (15)
C1110.4705 (3)0.26721 (16)0.07451 (9)0.0124 (5)
C1120.4597 (3)0.34029 (17)0.10668 (10)0.0160 (5)
H1120.38830.38420.0980.019*
C1130.5522 (3)0.35029 (18)0.15167 (10)0.0183 (6)
H1130.5440.39990.17430.022*
C1140.6557 (3)0.28632 (18)0.16226 (10)0.0162 (5)
C1150.6714 (3)0.21308 (18)0.13115 (11)0.0205 (6)
H1150.74410.16990.13990.025*
C1160.5782 (3)0.20397 (18)0.08660 (11)0.0186 (6)
H1160.58760.15430.06410.022*
C1210.1933 (3)0.18497 (16)0.03642 (10)0.0130 (5)
C1220.1929 (3)0.13466 (17)0.08364 (10)0.0171 (5)
H1220.2770.13750.10750.021*
C1230.0709 (3)0.08080 (18)0.09600 (11)0.0196 (6)
H1230.07030.04640.12810.024*
C1240.0488 (3)0.07822 (18)0.06103 (11)0.0203 (6)
C1250.0545 (3)0.12601 (18)0.01395 (11)0.0201 (6)
H1250.13870.12180.00980.024*
C1260.0679 (3)0.18076 (18)0.00240 (10)0.0177 (6)
H1260.06590.2160.02930.021*
C1310.4625 (3)0.19282 (17)0.03139 (10)0.0134 (5)
C1320.4348 (3)0.10602 (17)0.04152 (11)0.0168 (5)
H1320.35760.07640.02110.02*
C1330.5196 (3)0.06210 (18)0.08154 (11)0.0205 (6)
H1330.50090.00290.08890.025*
C1340.6307 (3)0.10675 (18)0.11007 (11)0.0197 (6)
C1350.6639 (3)0.19188 (19)0.10049 (11)0.0207 (6)
H1350.74330.22030.12050.025*
C1360.5785 (3)0.23531 (18)0.06095 (10)0.0172 (5)
H1360.59890.29440.05390.021*
C2110.1404 (3)0.28925 (17)0.15688 (10)0.0140 (5)
C2120.2142 (3)0.21129 (18)0.14624 (10)0.0197 (6)
H2120.30360.21130.12490.024*
C2130.1597 (3)0.13449 (18)0.16616 (11)0.0211 (6)
H2130.20960.08150.15860.025*
C2140.0302 (3)0.13664 (18)0.19749 (10)0.0196 (6)
C2150.0473 (3)0.21117 (19)0.20828 (10)0.0201 (6)
H2150.13730.21020.22930.024*
C2160.0084 (3)0.28810 (18)0.18782 (10)0.0172 (5)
H2160.04380.34060.19490.021*
C2210.4035 (3)0.38935 (16)0.17346 (10)0.0134 (5)
C2220.4079 (3)0.35448 (17)0.22591 (10)0.0158 (5)
H2220.31910.32760.23980.019*
C2230.5392 (3)0.35850 (18)0.25791 (11)0.0181 (6)
H2230.54220.33470.29360.022*
C2240.6656 (3)0.39792 (17)0.23667 (11)0.0178 (6)
C2250.6688 (3)0.43144 (18)0.18501 (11)0.0185 (6)
H2250.75920.4570.17140.022*
C2260.5350 (3)0.42682 (17)0.15313 (10)0.0151 (5)
H2260.53370.44950.11720.018*
C2310.1168 (3)0.47667 (17)0.15692 (10)0.0143 (5)
C2320.0969 (3)0.49341 (18)0.21255 (10)0.0192 (6)
H2320.1460.45770.23910.023*
C2330.0066 (3)0.56112 (19)0.22903 (11)0.0229 (6)
H2330.00870.57180.26660.027*
C2340.0608 (3)0.61289 (18)0.18973 (13)0.0231 (6)
C2350.0400 (3)0.60098 (18)0.13505 (12)0.0217 (6)
H2350.08470.63920.1090.026*
C2360.0478 (3)0.53179 (17)0.11893 (11)0.0175 (6)
H2360.06130.52160.08120.021*
F110.74858 (16)0.29620 (10)0.20545 (6)0.0215 (3)
F120.17071 (17)0.02636 (11)0.07358 (7)0.0274 (4)
F130.71066 (18)0.06429 (11)0.14997 (6)0.0270 (4)
F210.02032 (19)0.06108 (11)0.21857 (7)0.0289 (4)
F220.79471 (17)0.40213 (11)0.26891 (7)0.0264 (4)
F230.15038 (19)0.67931 (11)0.20597 (8)0.0345 (4)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ag0.01508 (11)0.01203 (11)0.01215 (10)0.00253 (7)0.00337 (7)0.00062 (7)
P10.0133 (3)0.0115 (3)0.0117 (3)0.0012 (2)0.0029 (2)0.0004 (3)
P20.0143 (3)0.0122 (3)0.0114 (3)0.0000 (2)0.0036 (2)0.0005 (3)
N0.0180 (12)0.0159 (12)0.0269 (13)0.0018 (9)0.0008 (10)0.0011 (10)
C0.0182 (13)0.0124 (13)0.0152 (12)0.0046 (10)0.0030 (10)0.0020 (10)
S0.0132 (3)0.0165 (3)0.0246 (3)0.0015 (2)0.0060 (3)0.0069 (3)
C1110.0133 (12)0.0134 (13)0.0106 (11)0.0019 (10)0.0004 (9)0.0014 (10)
C1120.0185 (13)0.0139 (14)0.0155 (12)0.0030 (10)0.0016 (10)0.0021 (11)
C1130.0226 (14)0.0144 (14)0.0179 (13)0.0005 (11)0.0032 (11)0.0030 (11)
C1140.0139 (12)0.0232 (15)0.0116 (12)0.0043 (10)0.0037 (10)0.0030 (11)
C1150.0177 (13)0.0231 (16)0.0209 (14)0.0075 (11)0.0062 (11)0.0012 (12)
C1160.0217 (13)0.0158 (14)0.0184 (13)0.0048 (11)0.0043 (11)0.0036 (11)
C1210.0123 (12)0.0134 (13)0.0134 (12)0.0009 (10)0.0007 (9)0.0023 (10)
C1220.0168 (13)0.0189 (14)0.0158 (13)0.0015 (10)0.0016 (10)0.0011 (11)
C1230.0250 (14)0.0171 (14)0.0166 (13)0.0003 (11)0.0024 (11)0.0042 (11)
C1240.0194 (13)0.0157 (14)0.0258 (15)0.0039 (11)0.0027 (11)0.0006 (12)
C1250.0182 (13)0.0215 (15)0.0209 (14)0.0011 (11)0.0054 (11)0.0016 (12)
C1260.0178 (13)0.0182 (15)0.0171 (13)0.0005 (10)0.0019 (10)0.0025 (11)
C1310.0155 (12)0.0146 (13)0.0104 (11)0.0018 (10)0.0048 (10)0.0001 (10)
C1320.0178 (13)0.0166 (14)0.0162 (13)0.0001 (10)0.0021 (10)0.0027 (11)
C1330.0250 (14)0.0122 (14)0.0242 (14)0.0029 (11)0.0007 (11)0.0023 (11)
C1340.0188 (14)0.0243 (16)0.0158 (13)0.0090 (11)0.0007 (11)0.0024 (11)
C1350.0197 (13)0.0226 (16)0.0195 (14)0.0024 (11)0.0020 (11)0.0005 (12)
C1360.0171 (13)0.0162 (14)0.0184 (13)0.0017 (10)0.0015 (10)0.0008 (11)
C2110.0164 (12)0.0153 (14)0.0101 (11)0.0040 (10)0.0009 (9)0.0012 (10)
C2120.0235 (14)0.0179 (15)0.0179 (13)0.0016 (11)0.0067 (11)0.0019 (11)
C2130.0316 (15)0.0142 (14)0.0175 (13)0.0021 (11)0.0022 (12)0.0023 (11)
C2140.0260 (14)0.0184 (15)0.0142 (13)0.0102 (11)0.0037 (11)0.0042 (11)
C2150.0140 (13)0.0279 (16)0.0186 (13)0.0065 (11)0.0028 (10)0.0030 (12)
C2160.0170 (13)0.0186 (14)0.0158 (13)0.0024 (10)0.0000 (10)0.0008 (11)
C2210.0173 (12)0.0110 (13)0.0120 (12)0.0021 (10)0.0019 (10)0.0020 (10)
C2220.0158 (12)0.0174 (14)0.0142 (12)0.0021 (10)0.0032 (10)0.0022 (11)
C2230.0226 (14)0.0181 (14)0.0136 (12)0.0015 (11)0.0001 (10)0.0003 (11)
C2240.0136 (12)0.0191 (15)0.0205 (14)0.0029 (10)0.0032 (10)0.0058 (11)
C2250.0159 (13)0.0173 (14)0.0225 (14)0.0021 (11)0.0066 (11)0.0011 (11)
C2260.0187 (13)0.0117 (13)0.0152 (12)0.0013 (10)0.0055 (10)0.0005 (10)
C2310.0112 (12)0.0151 (13)0.0169 (12)0.0028 (10)0.0055 (10)0.0012 (10)
C2320.0197 (13)0.0215 (15)0.0165 (13)0.0041 (11)0.0023 (11)0.0018 (11)
C2330.0253 (14)0.0235 (16)0.0203 (14)0.0084 (12)0.0096 (12)0.0117 (12)
C2340.0144 (13)0.0163 (15)0.0388 (17)0.0022 (11)0.0092 (12)0.0126 (13)
C2350.0176 (13)0.0163 (15)0.0312 (16)0.0005 (10)0.0019 (12)0.0011 (12)
C2360.0156 (13)0.0181 (14)0.0189 (13)0.0017 (10)0.0024 (10)0.0001 (11)
F110.0216 (8)0.0266 (9)0.0167 (8)0.0024 (7)0.0098 (6)0.0016 (7)
F120.0214 (8)0.0270 (10)0.0337 (9)0.0110 (7)0.0008 (7)0.0065 (8)
F130.0298 (9)0.0294 (10)0.0216 (8)0.0065 (7)0.0066 (7)0.0088 (7)
F210.0362 (9)0.0216 (9)0.0289 (9)0.0134 (8)0.0011 (7)0.0097 (8)
F220.0158 (8)0.0372 (11)0.0260 (9)0.0007 (7)0.0038 (7)0.0049 (8)
F230.0287 (9)0.0225 (10)0.0526 (11)0.0054 (7)0.0132 (8)0.0155 (9)
Geometric parameters (Å, º) top
Ag—N2.395 (2)C133—H1330.95
Ag—P12.4560 (7)C134—F131.361 (3)
Ag—P22.4956 (7)C134—C1351.372 (4)
Ag—S2.5773 (7)C135—C1361.386 (4)
P1—C1111.822 (2)C135—H1350.95
P1—C1311.823 (3)C136—H1360.95
P1—C1211.826 (3)C211—C2161.394 (3)
P2—C2211.822 (3)C211—C2121.397 (4)
P2—C2311.824 (3)C212—C2131.375 (4)
P2—C2111.830 (3)C212—H2120.95
N—Ci1.157 (3)C213—C2141.382 (4)
C—Ni1.157 (3)C213—H2130.95
C—S1.661 (3)C214—F211.357 (3)
C111—C1121.382 (4)C214—C2151.367 (4)
C111—C1161.395 (3)C215—C2161.386 (4)
C112—C1131.391 (3)C215—H2150.95
C112—H1120.95C216—H2160.95
C113—C1141.370 (4)C221—C2261.389 (3)
C113—H1130.95C221—C2221.396 (3)
C114—F111.357 (3)C222—C2231.378 (4)
C114—C1151.373 (4)C222—H2220.95
C115—C1161.384 (3)C223—C2241.374 (4)
C115—H1150.95C223—H2230.95
C116—H1160.95C224—F221.366 (3)
C121—C1261.393 (3)C224—C2251.371 (4)
C121—C1221.396 (3)C225—C2261.396 (4)
C122—C1231.382 (4)C225—H2250.95
C122—H1220.95C226—H2260.95
C123—C1241.368 (4)C231—C2361.392 (4)
C123—H1230.95C231—C2321.404 (3)
C124—F121.365 (3)C232—C2331.378 (4)
C124—C1251.374 (4)C232—H2320.95
C125—C1261.389 (4)C233—C2341.377 (4)
C125—H1250.95C233—H2330.95
C126—H1260.95C234—F231.358 (3)
C131—C1321.390 (3)C234—C2351.370 (4)
C131—C1361.399 (4)C235—C2361.381 (4)
C132—C1331.395 (4)C235—H2350.95
C132—H1320.95C236—H2360.95
C133—C1341.372 (4)
N—Ag—P1106.73 (6)C132—C133—H133120.9
N—Ag—P293.98 (6)F13—C134—C135118.8 (2)
P1—Ag—P2118.82 (2)F13—C134—C133118.1 (3)
N—Ag—S100.23 (6)C135—C134—C133123.2 (3)
P1—Ag—S116.66 (2)C134—C135—C136118.3 (3)
P2—Ag—S114.97 (2)C134—C135—H135120.8
C111—P1—C131102.60 (11)C136—C135—H135120.8
C111—P1—C121105.78 (11)C135—C136—C131120.6 (3)
C131—P1—C121103.01 (11)C135—C136—H136119.7
C111—P1—Ag121.18 (9)C131—C136—H136119.7
C131—P1—Ag111.21 (8)C216—C211—C212118.8 (2)
C121—P1—Ag111.26 (8)C216—C211—P2124.4 (2)
C221—P2—C231103.81 (11)C212—C211—P2116.76 (18)
C221—P2—C21199.96 (11)C213—C212—C211121.1 (2)
C231—P2—C211105.63 (11)C213—C212—H212119.4
C221—P2—Ag120.22 (8)C211—C212—H212119.4
C231—P2—Ag113.18 (8)C212—C213—C214118.1 (3)
C211—P2—Ag112.34 (8)C212—C213—H213121
Ci—N—Ag152.5 (2)C214—C213—H213121
Ni—C—S179.3 (3)F21—C214—C215119.2 (2)
C—S—Ag100.86 (9)F21—C214—C213117.9 (3)
C112—C111—C116119.5 (2)C215—C214—C213122.9 (3)
C112—C111—P1118.72 (19)C214—C215—C216118.5 (2)
C116—C111—P1121.76 (19)C214—C215—H215120.7
C111—C112—C113120.7 (2)C216—C215—H215120.7
C111—C112—H112119.7C215—C216—C211120.6 (3)
C113—C112—H112119.7C215—C216—H216119.7
C114—C113—C112117.8 (2)C211—C216—H216119.7
C114—C113—H113121.1C226—C221—C222119.0 (2)
C112—C113—H113121.1C226—C221—P2119.10 (19)
F11—C114—C113118.3 (2)C222—C221—P2121.85 (19)
F11—C114—C115118.2 (2)C223—C222—C221121.0 (2)
C113—C114—C115123.4 (2)C223—C222—H222119.5
C114—C115—C116118.0 (2)C221—C222—H222119.5
C114—C115—H115121C224—C223—C222118.1 (2)
C116—C115—H115121C224—C223—H223121
C115—C116—C111120.5 (2)C222—C223—H223121
C115—C116—H116119.8F22—C224—C225119.0 (2)
C111—C116—H116119.8F22—C224—C223117.6 (2)
C126—C121—C122118.8 (2)C225—C224—C223123.5 (2)
C126—C121—P1116.64 (19)C224—C225—C226117.7 (2)
C122—C121—P1124.52 (19)C224—C225—H225121.1
C123—C122—C121120.5 (2)C226—C225—H225121.1
C123—C122—H122119.7C221—C226—C225120.7 (2)
C121—C122—H122119.7C221—C226—H226119.7
C124—C123—C122118.4 (2)C225—C226—H226119.7
C124—C123—H123120.8C236—C231—C232118.5 (2)
C122—C123—H123120.8C236—C231—P2117.55 (19)
F12—C124—C123118.7 (2)C232—C231—P2124.0 (2)
F12—C124—C125117.7 (2)C233—C232—C231120.6 (3)
C123—C124—C125123.6 (3)C233—C232—H232119.7
C124—C125—C126117.3 (2)C231—C232—H232119.7
C124—C125—H125121.3C234—C233—C232118.5 (2)
C126—C125—H125121.3C234—C233—H233120.8
C125—C126—C121121.2 (2)C232—C233—H233120.8
C125—C126—H126119.4F23—C234—C235118.6 (3)
C121—C126—H126119.4F23—C234—C233118.5 (3)
C132—C131—C136119.3 (2)C235—C234—C233122.9 (3)
C132—C131—P1123.7 (2)C234—C235—C236118.1 (3)
C136—C131—P1116.8 (2)C234—C235—H235121
C131—C132—C133120.4 (2)C236—C235—H235121
C131—C132—H132119.8C235—C236—C231121.3 (3)
C133—C132—H132119.8C235—C236—H236119.3
C134—C133—C132118.2 (3)C231—C236—H236119.3
C134—C133—H133120.9
N—Ag—P1—C111113.91 (11)C121—P1—C131—C136170.67 (18)
P2—Ag—P1—C111141.72 (9)Ag—P1—C131—C13651.4 (2)
S—Ag—P1—C1112.90 (10)C136—C131—C132—C1331.3 (4)
N—Ag—P1—C131125.52 (10)P1—C131—C132—C133174.53 (19)
P2—Ag—P1—C13121.16 (9)C131—C132—C133—C1340.4 (4)
S—Ag—P1—C131123.46 (9)C132—C133—C134—F13178.4 (2)
N—Ag—P1—C12111.31 (10)C132—C133—C134—C1351.1 (4)
P2—Ag—P1—C12193.06 (9)F13—C134—C135—C136178.0 (2)
S—Ag—P1—C121122.32 (9)C133—C134—C135—C1361.6 (4)
N—Ag—P2—C221179.35 (11)C134—C135—C136—C1310.5 (4)
P1—Ag—P2—C22169.08 (10)C132—C131—C136—C1350.9 (4)
S—Ag—P2—C22176.12 (10)P1—C131—C136—C135175.27 (19)
N—Ag—P2—C23155.99 (10)C221—P2—C211—C216110.1 (2)
P1—Ag—P2—C231167.56 (9)C231—P2—C211—C2162.6 (2)
S—Ag—P2—C23147.24 (9)Ag—P2—C211—C216121.3 (2)
N—Ag—P2—C21163.54 (10)C221—P2—C211—C21267.4 (2)
P1—Ag—P2—C21148.03 (9)C231—P2—C211—C212174.86 (19)
S—Ag—P2—C211166.77 (9)Ag—P2—C211—C21261.3 (2)
P1—Ag—N—Ci164.1 (4)C216—C211—C212—C2130.6 (4)
P2—Ag—N—Ci74.1 (5)P2—C211—C212—C213177.0 (2)
S—Ag—N—Ci42.1 (5)C211—C212—C213—C2140.6 (4)
Ni—C—S—Ag4E1 (3)C212—C213—C214—F21177.9 (2)
N—Ag—S—C17.88 (11)C212—C213—C214—C2151.6 (4)
P1—Ag—S—C132.59 (9)F21—C214—C215—C216178.1 (2)
P2—Ag—S—C81.43 (9)C213—C214—C215—C2161.4 (4)
C131—P1—C111—C112150.2 (2)C214—C215—C216—C2110.1 (4)
C121—P1—C111—C112102.2 (2)C212—C211—C216—C2150.9 (4)
Ag—P1—C111—C11225.5 (2)P2—C211—C216—C215176.52 (19)
C131—P1—C111—C11627.6 (2)C231—P2—C221—C226100.3 (2)
C121—P1—C111—C11680.1 (2)C211—P2—C221—C226150.8 (2)
Ag—P1—C111—C116152.21 (18)Ag—P2—C221—C22627.5 (2)
C116—C111—C112—C1131.7 (4)C231—P2—C221—C22279.6 (2)
P1—C111—C112—C113179.43 (19)C211—P2—C221—C22229.4 (2)
C111—C112—C113—C1141.2 (4)Ag—P2—C221—C222152.67 (18)
C112—C113—C114—F11178.8 (2)C226—C221—C222—C2231.4 (4)
C112—C113—C114—C1150.6 (4)P2—C221—C222—C223178.4 (2)
F11—C114—C115—C116178.9 (2)C221—C222—C223—C2240.1 (4)
C113—C114—C115—C1160.4 (4)C222—C223—C224—F22179.5 (2)
C114—C115—C116—C1110.8 (4)C222—C223—C224—C2251.6 (4)
C112—C111—C116—C1151.5 (4)F22—C224—C225—C226179.5 (2)
P1—C111—C116—C115179.2 (2)C223—C224—C225—C2261.6 (4)
C111—P1—C121—C126167.71 (19)C222—C221—C226—C2251.5 (4)
C131—P1—C121—C12685.0 (2)P2—C221—C226—C225178.4 (2)
Ag—P1—C121—C12634.3 (2)C224—C225—C226—C2210.0 (4)
C111—P1—C121—C12211.6 (3)C221—P2—C231—C236134.7 (2)
C131—P1—C121—C12295.7 (2)C211—P2—C231—C236120.6 (2)
Ag—P1—C121—C122145.0 (2)Ag—P2—C231—C2362.7 (2)
C126—C121—C122—C1230.8 (4)C221—P2—C231—C23244.5 (2)
P1—C121—C122—C123179.9 (2)C211—P2—C231—C23260.1 (2)
C121—C122—C123—C1240.1 (4)Ag—P2—C231—C232176.54 (18)
C122—C123—C124—F12178.8 (2)C236—C231—C232—C2332.2 (4)
C122—C123—C124—C1250.3 (4)P2—C231—C232—C233178.5 (2)
F12—C124—C125—C126177.9 (2)C231—C232—C233—C2341.3 (4)
C123—C124—C125—C1261.2 (4)C232—C233—C234—F23179.7 (2)
C124—C125—C126—C1211.9 (4)C232—C233—C234—C2351.2 (4)
C122—C121—C126—C1251.7 (4)F23—C234—C235—C236178.2 (2)
P1—C121—C126—C125178.9 (2)C233—C234—C235—C2362.6 (4)
C111—P1—C131—C132104.5 (2)C234—C235—C236—C2311.6 (4)
C121—P1—C131—C1325.3 (2)C232—C231—C236—C2350.7 (4)
Ag—P1—C131—C132124.6 (2)P2—C231—C236—C235180.0 (2)
C111—P1—C131—C13679.6 (2)
Symmetry code: (i) x, y+1, z.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
C215—H215···F23ii0.952.513.448 (3)168
C216—H216···F22iii0.952.513.275 (3)138
C222—H222···F11iv0.952.433.213 (3)140
Symmetry codes: (ii) x1/2, y1/2, z+1/2; (iii) x1, y, z; (iv) x1/2, y+1/2, z+1/2.
(II) top
Crystal data top
C74H48Ag2F12N2P4S2F(000) = 4800
Mr = 1596.88Dx = 1.6 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
a = 18.5885 (15) ÅCell parameters from 152504 reflections
b = 14.0668 (12) Åθ = 1.1–28.4°
c = 38.275 (3) ŵ = 0.83 mm1
β = 96.551 (4)°T = 100 K
V = 9942.9 (14) Å3Rhombohedral, colourless
Z = 60.4 × 0.36 × 0.32 mm
Data collection top
Bruker SMART CCD area detector
diffractometer
21855 reflections with I > 2σ(I)
π and ω scansRint = 0.032
Absorption correction: multi-scanθmax = 28.4°, θmin = 1.1°
Tmin = 0.732, Tmax = 0.776h = 2424
149189 measured reflectionsk = 1818
24770 independent reflectionsl = 5151
Refinement top
Refinement on F20 restraints
Least-squares matrix: fullH-atom parameters constrained
R[F2 > 2σ(F2)] = 0.026 w = 1/[σ2(Fo2) + (0.0334P)2 + 4.3254P]
where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.071(Δ/σ)max = 0.027
S = 1.09Δρmax = 0.47 e Å3
24770 reflectionsΔρmin = 0.77 e Å3
1297 parameters
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.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Ag10.433114 (6)0.664920 (8)0.333619 (3)0.01445 (3)
Ag20.237804 (6)0.356872 (9)0.336296 (3)0.01486 (3)
Ag30.096687 (6)0.840443 (8)0.505887 (3)0.01478 (3)
P10.46137 (2)0.78882 (3)0.292562 (10)0.01229 (8)
P20.53048 (2)0.60236 (3)0.377513 (11)0.01551 (8)
P30.21740 (2)0.22446 (3)0.375502 (10)0.01259 (8)
P40.13598 (2)0.41292 (3)0.293281 (11)0.01610 (8)
P50.12347 (2)0.71866 (3)0.463342 (10)0.01276 (8)
P60.19458 (2)0.89905 (3)0.550523 (11)0.01511 (8)
S10.31503 (2)0.69372 (3)0.360798 (12)0.02198 (9)
C10.28209 (9)0.58440 (12)0.36163 (4)0.0160 (3)
N10.25862 (8)0.50838 (10)0.36293 (4)0.0192 (3)
S20.35258 (3)0.32939 (3)0.306647 (14)0.02534 (10)
C20.38427 (9)0.43900 (11)0.30682 (4)0.0162 (3)
N20.40729 (8)0.51571 (10)0.30649 (4)0.0208 (3)
S30.02731 (2)0.81760 (3)0.526840 (13)0.02286 (9)
C30.05822 (9)0.92780 (11)0.52323 (4)0.0157 (3)
N30.08072 (8)0.99506 (10)0.47906 (4)0.0199 (3)
C1110.45149 (8)0.75268 (11)0.24656 (4)0.0146 (3)
C1120.42134 (9)0.66374 (11)0.23796 (4)0.0176 (3)
H1120.40930.62360.25570.021*
C1130.40920 (9)0.63470 (12)0.20310 (5)0.0218 (4)
H1130.38850.57580.19720.026*
C1140.42850 (9)0.69498 (13)0.17755 (4)0.0224 (4)
C1150.45830 (10)0.78353 (14)0.18482 (5)0.0241 (4)
H1150.47080.82270.16690.029*
C1160.46908 (9)0.81255 (12)0.21965 (4)0.0203 (3)
H1160.48820.87250.22520.024*
C1210.55482 (9)0.82959 (11)0.30185 (4)0.0149 (3)
C1220.60947 (9)0.79548 (14)0.28330 (5)0.0252 (4)
H1220.59750.75640.26390.03*
C1230.68167 (10)0.81863 (16)0.29320 (5)0.0320 (5)
H1230.7180.79550.28070.038*
C1240.69790 (9)0.87650 (14)0.32194 (5)0.0253 (4)
C1250.64582 (9)0.91180 (12)0.34115 (4)0.0203 (3)
H1250.65840.95070.36050.024*
C1260.57388 (9)0.88797 (11)0.33096 (4)0.0167 (3)
H1260.5380.91120.34370.02*
C1310.40654 (8)0.89673 (11)0.29097 (4)0.0132 (3)
C1320.43346 (9)0.98792 (11)0.28646 (4)0.0170 (3)
H1320.48260.99620.28470.02*
C1330.38796 (9)1.06644 (11)0.28453 (4)0.0196 (3)
H1330.40611.12740.28210.024*
C1340.31513 (9)1.05153 (12)0.28630 (4)0.0188 (3)
C1350.28607 (9)0.96258 (12)0.29026 (4)0.0193 (3)
H1350.23660.95460.2910.023*
C1360.33269 (9)0.88532 (11)0.29316 (4)0.0165 (3)
H1360.31440.82490.29660.02*
C2110.51215 (9)0.48482 (11)0.39424 (4)0.0163 (3)
C2120.44173 (10)0.46387 (13)0.40055 (5)0.0256 (4)
H2120.40540.50880.39540.031*
C2130.42529 (11)0.37662 (15)0.41438 (6)0.0338 (5)
H2130.37830.36240.41870.041*
C2140.47993 (11)0.31161 (13)0.42153 (5)0.0298 (4)
C2150.54983 (11)0.32879 (13)0.41542 (5)0.0269 (4)
H2150.58560.2830.42030.032*
C2160.56578 (10)0.41654 (12)0.40164 (5)0.0215 (4)
H2160.6130.42980.39730.026*
C2210.61302 (9)0.58272 (12)0.35694 (5)0.0191 (3)
C2220.68246 (10)0.60443 (13)0.37212 (5)0.0261 (4)
H2220.68910.63150.39440.031*
C2230.74226 (10)0.58608 (14)0.35433 (6)0.0320 (5)
H2230.78880.6020.36410.038*
C2240.73040 (10)0.54372 (14)0.32186 (5)0.0279 (4)
C2250.66288 (10)0.51912 (14)0.30620 (5)0.0267 (4)
H2250.6570.48880.28450.032*
C2260.60390 (10)0.54065 (13)0.32367 (5)0.0235 (4)
H2260.55750.52690.31310.028*
C2310.55695 (9)0.67034 (12)0.41741 (5)0.0177 (3)
C2320.56587 (11)0.63024 (13)0.45068 (5)0.0278 (4)
H2320.56120.56480.45320.033*
C2330.58172 (12)0.68724 (15)0.48035 (5)0.0344 (5)
H2330.58730.66060.50270.041*
C2340.58885 (10)0.78298 (14)0.47595 (5)0.0288 (4)
C2350.57930 (11)0.82566 (13)0.44359 (6)0.0298 (4)
H2350.58370.89120.44140.036*
C2360.56292 (10)0.76858 (13)0.41436 (5)0.0261 (4)
H2360.55570.79640.39220.031*
C3110.22094 (8)0.25453 (11)0.42195 (4)0.0151 (3)
C3120.21231 (9)0.18707 (12)0.44783 (4)0.0202 (3)
H3120.2030.12410.44140.024*
C3130.21746 (10)0.21266 (13)0.48302 (5)0.0241 (4)
H3130.2110.16810.50030.029*
C3140.23243 (10)0.30614 (14)0.49149 (5)0.0251 (4)
C3150.24280 (10)0.37458 (13)0.46692 (5)0.0248 (4)
H3150.25410.43680.47370.03*
C3160.23595 (9)0.34841 (12)0.43178 (5)0.0195 (3)
H3160.24140.39390.41460.023*
C3210.27906 (9)0.12322 (11)0.37587 (4)0.0153 (3)
C3220.25741 (10)0.02913 (12)0.38006 (4)0.0206 (3)
H3220.2090.01570.38190.025*
C3230.30728 (11)0.04429 (13)0.38144 (5)0.0257 (4)
H3230.29280.1070.38380.031*
C3240.37845 (11)0.02233 (13)0.37926 (5)0.0267 (4)
C3250.40221 (10)0.06902 (14)0.37537 (5)0.0266 (4)
H3250.4510.08170.37420.032*
C3260.35154 (9)0.14232 (13)0.37330 (5)0.0211 (4)
H3260.36640.20460.37020.025*
C3310.12785 (9)0.17386 (11)0.36369 (4)0.0152 (3)
C3320.06966 (9)0.19320 (13)0.38252 (5)0.0236 (4)
H3320.07760.22630.40360.028*
C3330.00001 (10)0.16386 (15)0.37022 (5)0.0299 (4)
H3330.03870.17670.38290.036*
C3340.01025 (10)0.11536 (14)0.33888 (5)0.0255 (4)
C3350.04522 (9)0.09402 (12)0.31951 (5)0.0214 (4)
H3350.03660.06060.29850.026*
C3360.11467 (9)0.12366 (12)0.33205 (4)0.0177 (3)
H3360.1530.10990.31920.021*
C4110.14409 (9)0.53502 (12)0.27813 (4)0.0176 (3)
C4120.21203 (9)0.56763 (13)0.27152 (5)0.0220 (4)
H4120.25170.5270.27470.026*
C4130.22091 (10)0.66015 (13)0.26021 (5)0.0250 (4)
H4130.2660.68180.25540.03*
C4140.16153 (10)0.71926 (12)0.25631 (4)0.0229 (4)
C4150.09342 (10)0.68972 (13)0.26249 (4)0.0232 (4)
H4150.05410.7310.25940.028*
C4160.08506 (9)0.59667 (12)0.27340 (4)0.0205 (3)
H4160.03950.57520.27760.025*
C4210.11226 (9)0.34678 (12)0.25267 (4)0.0183 (3)
C4220.08335 (10)0.38922 (14)0.22147 (5)0.0284 (4)
H4220.07370.45410.2210.034*
C4230.06877 (11)0.33571 (15)0.19102 (5)0.0337 (5)
H4230.04960.36420.17010.04*
C4240.08297 (11)0.24110 (15)0.19232 (5)0.0318 (4)
C4250.11220 (12)0.19582 (15)0.22240 (6)0.0347 (5)
H4250.12150.13090.22250.042*
C4260.12737 (11)0.25012 (13)0.25260 (5)0.0285 (4)
H4260.1480.22120.27320.034*
C4310.05404 (9)0.41934 (12)0.31507 (4)0.0177 (3)
C4320.01169 (10)0.37877 (15)0.30293 (6)0.0337 (5)
H4320.01610.34440.2820.04*
C4330.07141 (11)0.38853 (17)0.32144 (6)0.0404 (5)
H4330.11550.36050.31340.048*
C4340.06356 (10)0.44046 (15)0.35183 (5)0.0272 (4)
C4350.00016 (10)0.48380 (14)0.36441 (5)0.0269 (4)
H4350.00340.5210.38460.032*
C4360.05943 (10)0.47078 (14)0.34624 (5)0.0254 (4)
H4360.10380.49690.3550.03*
C5110.21516 (9)0.67190 (11)0.47318 (4)0.0157 (3)
C5120.27029 (9)0.69043 (13)0.45243 (5)0.0224 (4)
H5120.25990.7240.43150.027*
C5130.34085 (10)0.65959 (14)0.46243 (5)0.0273 (4)
H5130.37760.67220.44850.033*
C5140.35479 (10)0.61007 (13)0.49339 (5)0.0241 (4)
C5150.30217 (10)0.59013 (12)0.51482 (5)0.0217 (4)
H5150.31320.55630.53560.026*
C5160.23205 (9)0.62182 (12)0.50462 (4)0.0178 (3)
H5160.19590.60950.51890.021*
C5210.06568 (9)0.61310 (11)0.45969 (4)0.0150 (3)
C5220.09175 (10)0.52144 (12)0.45504 (4)0.0206 (3)
H5220.14090.51210.45370.025*
C5230.04495 (10)0.44384 (12)0.45233 (5)0.0243 (4)
H5230.06230.38250.44970.029*
C5240.02762 (10)0.46027 (12)0.45359 (4)0.0222 (4)
C5250.05572 (10)0.54949 (13)0.45749 (4)0.0219 (4)
H5250.10520.55840.45780.026*
C5260.00824 (9)0.62620 (12)0.46099 (4)0.0191 (3)
H5260.02610.6870.46420.023*
C5310.11910 (8)0.75983 (11)0.41806 (4)0.0145 (3)
C5320.13101 (9)0.69923 (12)0.39041 (4)0.0198 (3)
H5320.1410.63530.39490.024*
C5330.12804 (10)0.73337 (13)0.35636 (4)0.0226 (4)
H5330.13680.69350.33790.027*
C5340.11184 (10)0.82782 (13)0.35059 (4)0.0214 (4)
C5350.09748 (9)0.88927 (12)0.37681 (4)0.0206 (3)
H5350.08510.95230.37180.025*
C5360.10195 (9)0.85461 (11)0.41093 (4)0.0174 (3)
H5360.09340.89510.42920.021*
C6110.27789 (9)0.90912 (12)0.52990 (4)0.0183 (3)
C6120.26963 (10)0.93692 (14)0.49469 (5)0.0275 (4)
H6120.22340.94750.48330.033*
C6130.32919 (11)0.94899 (16)0.47654 (5)0.0326 (5)
H6130.32370.96880.45320.039*
C6140.39646 (11)0.93107 (14)0.49381 (6)0.0314 (4)
C6150.40779 (10)0.90430 (14)0.52831 (6)0.0318 (4)
H6150.45430.89340.53930.038*
C6160.34756 (10)0.89379 (13)0.54661 (5)0.0250 (4)
H6160.35390.87640.57020.03*
C6210.21997 (9)0.83936 (11)0.59248 (4)0.0167 (3)
C6220.23845 (10)0.74320 (12)0.59262 (5)0.0239 (4)
H6220.24040.71190.57130.029*
C6230.25402 (10)0.69337 (13)0.62379 (5)0.0271 (4)
H6230.26670.62940.62370.033*
C6240.25009 (9)0.74138 (13)0.65484 (5)0.0230 (4)
C6250.23177 (10)0.83502 (14)0.65606 (5)0.0252 (4)
H6250.22930.86520.67750.03*
C6260.21677 (9)0.88474 (12)0.62455 (4)0.0211 (4)
H6260.20450.94880.6250.025*
C6310.17869 (9)1.02058 (11)0.56399 (4)0.0168 (3)
C6320.23525 (10)1.08493 (12)0.57168 (5)0.0223 (4)
H6320.28251.06620.56940.027*
C6330.22209 (11)1.17639 (13)0.58273 (5)0.0274 (4)
H6330.25981.21930.5880.033*
C6340.15193 (11)1.20193 (13)0.58571 (5)0.0270 (4)
C6350.09430 (10)1.14101 (14)0.57856 (5)0.0280 (4)
H6350.04741.16050.58110.034*
C6360.10824 (10)1.04942 (13)0.56740 (5)0.0230 (4)
H6360.07011.00710.56220.028*
F120.76793 (6)0.90062 (10)0.33156 (3)0.0390 (3)
F130.26991 (6)1.12762 (7)0.28392 (3)0.0265 (2)
F160.41845 (6)0.66524 (8)0.14360 (3)0.0322 (3)
F210.46341 (7)0.22628 (9)0.43490 (4)0.0492 (4)
F220.78830 (6)0.52456 (9)0.30436 (3)0.0387 (3)
F230.60406 (7)0.83855 (9)0.50465 (3)0.0425 (3)
F310.23722 (7)0.33293 (9)0.52580 (3)0.0382 (3)
F320.42758 (7)0.09424 (9)0.38095 (3)0.0384 (3)
F330.07822 (6)0.08661 (10)0.32653 (3)0.0392 (3)
F410.17053 (6)0.81066 (7)0.24659 (3)0.0313 (3)
F420.06884 (8)0.18885 (11)0.16266 (3)0.0503 (4)
F430.12149 (6)0.45120 (10)0.37005 (3)0.0401 (3)
F510.42312 (6)0.57855 (9)0.50316 (3)0.0352 (3)
F520.07362 (6)0.38494 (8)0.45069 (3)0.0308 (3)
F530.11009 (7)0.86261 (8)0.31736 (3)0.0316 (3)
F610.45458 (7)0.94065 (10)0.47560 (4)0.0460 (3)
F620.26432 (6)0.69288 (8)0.68540 (3)0.0337 (3)
F630.13851 (7)1.29218 (8)0.59570 (3)0.0413 (3)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ag10.01460 (6)0.01231 (6)0.01667 (6)0.00040 (4)0.00279 (5)0.00305 (4)
Ag20.01311 (6)0.01378 (6)0.01769 (6)0.00073 (4)0.00167 (5)0.00338 (4)
Ag30.01494 (6)0.01343 (6)0.01615 (6)0.00030 (4)0.00256 (5)0.00313 (4)
P10.01301 (18)0.01090 (18)0.01331 (18)0.00047 (14)0.00304 (15)0.00093 (14)
P20.01470 (19)0.01461 (19)0.0171 (2)0.00100 (15)0.00134 (16)0.00256 (15)
P30.01280 (18)0.01169 (18)0.01362 (18)0.00038 (15)0.00300 (15)0.00045 (14)
P40.01415 (19)0.0167 (2)0.0171 (2)0.00078 (15)0.00002 (16)0.00307 (16)
P50.01423 (19)0.01151 (18)0.01276 (18)0.00038 (15)0.00244 (15)0.00116 (14)
P60.0154 (2)0.01504 (19)0.01484 (19)0.00076 (15)0.00147 (16)0.00228 (15)
S10.0243 (2)0.01229 (18)0.0324 (2)0.00140 (16)0.01655 (19)0.00164 (17)
C10.0145 (7)0.0182 (8)0.0159 (8)0.0026 (6)0.0049 (6)0.0001 (6)
N10.0188 (7)0.0160 (7)0.0233 (7)0.0005 (6)0.0040 (6)0.0001 (6)
S20.0276 (2)0.01234 (19)0.0401 (3)0.00399 (17)0.0213 (2)0.00492 (18)
C20.0170 (8)0.0164 (8)0.0164 (8)0.0013 (6)0.0069 (6)0.0006 (6)
N20.0227 (7)0.0166 (7)0.0239 (8)0.0014 (6)0.0058 (6)0.0007 (6)
S30.0236 (2)0.01276 (19)0.0353 (2)0.00249 (16)0.01689 (19)0.00378 (17)
C30.0157 (8)0.0174 (8)0.0149 (7)0.0023 (6)0.0056 (6)0.0017 (6)
N30.0206 (7)0.0180 (7)0.0219 (7)0.0003 (6)0.0049 (6)0.0009 (6)
C1110.0134 (7)0.0158 (7)0.0149 (7)0.0022 (6)0.0026 (6)0.0009 (6)
C1120.0173 (8)0.0153 (8)0.0199 (8)0.0024 (6)0.0015 (7)0.0005 (6)
C1130.0229 (9)0.0181 (8)0.0238 (9)0.0023 (7)0.0005 (7)0.0059 (7)
C1140.0207 (9)0.0305 (10)0.0156 (8)0.0074 (7)0.0011 (7)0.0064 (7)
C1150.0251 (9)0.0313 (10)0.0163 (8)0.0012 (8)0.0046 (7)0.0026 (7)
C1160.0209 (8)0.0207 (8)0.0194 (8)0.0031 (7)0.0032 (7)0.0002 (7)
C1210.0154 (8)0.0139 (7)0.0154 (7)0.0004 (6)0.0024 (6)0.0027 (6)
C1220.0184 (8)0.0330 (10)0.0248 (9)0.0021 (7)0.0052 (7)0.0100 (8)
C1230.0167 (9)0.0483 (12)0.0321 (11)0.0006 (8)0.0082 (8)0.0110 (9)
C1240.0126 (8)0.0333 (10)0.0291 (10)0.0042 (7)0.0012 (7)0.0002 (8)
C1250.0210 (8)0.0207 (8)0.0184 (8)0.0016 (7)0.0008 (7)0.0008 (6)
C1260.0172 (8)0.0155 (8)0.0174 (8)0.0007 (6)0.0026 (6)0.0012 (6)
C1310.0163 (7)0.0121 (7)0.0110 (7)0.0005 (6)0.0006 (6)0.0000 (5)
C1320.0155 (8)0.0164 (8)0.0192 (8)0.0020 (6)0.0027 (6)0.0014 (6)
C1330.0257 (9)0.0119 (7)0.0209 (8)0.0009 (6)0.0016 (7)0.0025 (6)
C1340.0220 (8)0.0173 (8)0.0166 (8)0.0074 (7)0.0001 (7)0.0012 (6)
C1350.0158 (8)0.0205 (8)0.0219 (8)0.0016 (6)0.0032 (7)0.0008 (7)
C1360.0171 (8)0.0153 (8)0.0175 (8)0.0007 (6)0.0035 (6)0.0002 (6)
C2110.0187 (8)0.0149 (7)0.0148 (7)0.0001 (6)0.0003 (6)0.0014 (6)
C2120.0179 (8)0.0250 (9)0.0330 (10)0.0012 (7)0.0013 (7)0.0098 (8)
C2130.0211 (9)0.0352 (11)0.0434 (12)0.0081 (8)0.0031 (9)0.0173 (9)
C2140.0345 (11)0.0191 (9)0.0326 (10)0.0084 (8)0.0104 (9)0.0106 (8)
C2150.0333 (10)0.0181 (8)0.0277 (10)0.0056 (7)0.0036 (8)0.0021 (7)
C2160.0217 (9)0.0197 (8)0.0228 (9)0.0033 (7)0.0018 (7)0.0018 (7)
C2210.0167 (8)0.0162 (8)0.0247 (9)0.0001 (6)0.0035 (7)0.0035 (6)
C2220.0196 (9)0.0228 (9)0.0360 (10)0.0021 (7)0.0030 (8)0.0087 (8)
C2230.0176 (9)0.0306 (10)0.0487 (13)0.0058 (8)0.0079 (9)0.0080 (9)
C2240.0236 (9)0.0252 (9)0.0378 (11)0.0010 (7)0.0162 (8)0.0051 (8)
C2250.0263 (9)0.0339 (10)0.0207 (9)0.0037 (8)0.0064 (7)0.0045 (8)
C2260.0195 (9)0.0311 (10)0.0198 (8)0.0013 (7)0.0022 (7)0.0028 (7)
C2310.0144 (8)0.0166 (8)0.0220 (8)0.0015 (6)0.0016 (6)0.0012 (6)
C2320.0383 (11)0.0188 (9)0.0238 (9)0.0028 (8)0.0070 (8)0.0009 (7)
C2330.0463 (13)0.0302 (10)0.0230 (10)0.0045 (9)0.0112 (9)0.0018 (8)
C2340.0227 (9)0.0299 (10)0.0327 (10)0.0002 (8)0.0011 (8)0.0147 (8)
C2350.0340 (11)0.0177 (9)0.0406 (11)0.0040 (8)0.0165 (9)0.0063 (8)
C2360.0342 (10)0.0191 (9)0.0273 (10)0.0008 (7)0.0135 (8)0.0010 (7)
C3110.0114 (7)0.0177 (8)0.0166 (7)0.0000 (6)0.0028 (6)0.0013 (6)
C3120.0241 (9)0.0187 (8)0.0183 (8)0.0034 (7)0.0045 (7)0.0005 (6)
C3130.0272 (9)0.0290 (10)0.0168 (8)0.0031 (8)0.0051 (7)0.0019 (7)
C3140.0262 (9)0.0330 (10)0.0161 (8)0.0027 (8)0.0030 (7)0.0085 (7)
C3150.0299 (10)0.0193 (9)0.0250 (9)0.0022 (7)0.0018 (8)0.0068 (7)
C3160.0202 (8)0.0163 (8)0.0218 (8)0.0023 (6)0.0017 (7)0.0010 (6)
C3210.0186 (8)0.0154 (7)0.0120 (7)0.0035 (6)0.0025 (6)0.0010 (6)
C3220.0254 (9)0.0166 (8)0.0198 (8)0.0017 (7)0.0019 (7)0.0009 (6)
C3230.0378 (11)0.0179 (8)0.0208 (9)0.0067 (8)0.0003 (8)0.0008 (7)
C3240.0369 (11)0.0281 (10)0.0151 (8)0.0193 (8)0.0032 (8)0.0005 (7)
C3250.0202 (9)0.0362 (11)0.0242 (9)0.0106 (8)0.0055 (7)0.0031 (8)
C3260.0206 (8)0.0220 (8)0.0209 (8)0.0032 (7)0.0033 (7)0.0024 (7)
C3310.0149 (7)0.0142 (7)0.0167 (8)0.0020 (6)0.0024 (6)0.0014 (6)
C3320.0186 (8)0.0301 (10)0.0227 (9)0.0047 (7)0.0050 (7)0.0077 (7)
C3330.0178 (9)0.0409 (12)0.0320 (10)0.0059 (8)0.0079 (8)0.0100 (9)
C3340.0174 (8)0.0280 (10)0.0305 (10)0.0062 (7)0.0001 (7)0.0034 (8)
C3350.0225 (9)0.0218 (9)0.0191 (8)0.0028 (7)0.0010 (7)0.0034 (7)
C3360.0191 (8)0.0174 (8)0.0172 (8)0.0010 (6)0.0038 (6)0.0001 (6)
C4110.0189 (8)0.0180 (8)0.0151 (7)0.0002 (6)0.0014 (6)0.0023 (6)
C4120.0198 (8)0.0238 (9)0.0220 (9)0.0007 (7)0.0005 (7)0.0033 (7)
C4130.0253 (9)0.0276 (10)0.0217 (9)0.0061 (7)0.0014 (7)0.0031 (7)
C4140.0351 (10)0.0179 (8)0.0147 (8)0.0053 (7)0.0007 (7)0.0030 (6)
C4150.0279 (9)0.0211 (9)0.0201 (8)0.0052 (7)0.0001 (7)0.0049 (7)
C4160.0192 (8)0.0233 (9)0.0185 (8)0.0003 (7)0.0005 (7)0.0039 (7)
C4210.0148 (8)0.0204 (8)0.0200 (8)0.0011 (6)0.0027 (6)0.0005 (6)
C4220.0302 (10)0.0258 (9)0.0268 (10)0.0042 (8)0.0074 (8)0.0017 (8)
C4230.0329 (11)0.0413 (12)0.0243 (10)0.0006 (9)0.0083 (8)0.0040 (8)
C4240.0288 (10)0.0383 (11)0.0290 (10)0.0030 (9)0.0069 (8)0.0150 (9)
C4250.0437 (12)0.0250 (10)0.0374 (11)0.0069 (9)0.0133 (10)0.0083 (9)
C4260.0365 (11)0.0250 (9)0.0252 (9)0.0087 (8)0.0092 (8)0.0024 (7)
C4310.0166 (8)0.0176 (8)0.0188 (8)0.0011 (6)0.0013 (6)0.0036 (6)
C4320.0211 (9)0.0440 (12)0.0365 (11)0.0077 (9)0.0058 (8)0.0192 (9)
C4330.0206 (10)0.0589 (15)0.0425 (12)0.0125 (10)0.0070 (9)0.0201 (11)
C4340.0185 (9)0.0399 (11)0.0246 (9)0.0024 (8)0.0084 (7)0.0004 (8)
C4350.0304 (10)0.0353 (10)0.0154 (8)0.0028 (8)0.0044 (7)0.0012 (7)
C4360.0223 (9)0.0355 (10)0.0183 (8)0.0088 (8)0.0020 (7)0.0010 (7)
C5110.0173 (8)0.0136 (7)0.0160 (8)0.0001 (6)0.0015 (6)0.0031 (6)
C5120.0201 (9)0.0269 (9)0.0204 (8)0.0045 (7)0.0036 (7)0.0052 (7)
C5130.0190 (9)0.0360 (11)0.0279 (10)0.0053 (8)0.0069 (8)0.0065 (8)
C5140.0187 (8)0.0247 (9)0.0277 (9)0.0057 (7)0.0021 (7)0.0019 (7)
C5150.0252 (9)0.0192 (8)0.0195 (8)0.0022 (7)0.0029 (7)0.0007 (7)
C5160.0208 (8)0.0172 (8)0.0155 (8)0.0008 (6)0.0022 (6)0.0013 (6)
C5210.0208 (8)0.0136 (7)0.0107 (7)0.0020 (6)0.0022 (6)0.0006 (6)
C5220.0229 (9)0.0176 (8)0.0209 (8)0.0008 (7)0.0017 (7)0.0021 (6)
C5230.0336 (10)0.0146 (8)0.0238 (9)0.0028 (7)0.0003 (8)0.0007 (7)
C5240.0301 (10)0.0206 (8)0.0153 (8)0.0111 (7)0.0006 (7)0.0024 (6)
C5250.0192 (8)0.0271 (9)0.0198 (8)0.0050 (7)0.0041 (7)0.0000 (7)
C5260.0217 (8)0.0178 (8)0.0180 (8)0.0010 (7)0.0037 (7)0.0006 (6)
C5310.0139 (7)0.0164 (7)0.0132 (7)0.0010 (6)0.0012 (6)0.0016 (6)
C5320.0234 (9)0.0186 (8)0.0173 (8)0.0036 (7)0.0021 (7)0.0005 (6)
C5330.0253 (9)0.0279 (9)0.0149 (8)0.0041 (7)0.0036 (7)0.0023 (7)
C5340.0213 (9)0.0276 (9)0.0155 (8)0.0024 (7)0.0026 (7)0.0061 (7)
C5350.0234 (9)0.0163 (8)0.0219 (8)0.0006 (7)0.0025 (7)0.0035 (6)
C5360.0185 (8)0.0158 (8)0.0182 (8)0.0021 (6)0.0038 (6)0.0017 (6)
C6110.0177 (8)0.0154 (8)0.0224 (8)0.0012 (6)0.0046 (7)0.0023 (6)
C6120.0221 (9)0.0392 (11)0.0212 (9)0.0048 (8)0.0028 (7)0.0022 (8)
C6130.0302 (10)0.0460 (12)0.0228 (9)0.0059 (9)0.0090 (8)0.0030 (9)
C6140.0272 (10)0.0286 (10)0.0422 (12)0.0007 (8)0.0198 (9)0.0021 (9)
C6150.0185 (9)0.0300 (10)0.0480 (12)0.0058 (8)0.0077 (9)0.0105 (9)
C6160.0215 (9)0.0224 (9)0.0313 (10)0.0035 (7)0.0041 (8)0.0080 (7)
C6210.0145 (8)0.0175 (8)0.0180 (8)0.0027 (6)0.0018 (6)0.0004 (6)
C6220.0316 (10)0.0190 (8)0.0224 (9)0.0004 (7)0.0085 (8)0.0003 (7)
C6230.0317 (10)0.0192 (9)0.0319 (10)0.0033 (8)0.0101 (8)0.0050 (7)
C6240.0183 (8)0.0302 (10)0.0209 (8)0.0005 (7)0.0037 (7)0.0084 (7)
C6250.0260 (9)0.0326 (10)0.0166 (8)0.0021 (8)0.0007 (7)0.0013 (7)
C6260.0234 (9)0.0203 (8)0.0191 (8)0.0016 (7)0.0008 (7)0.0017 (7)
C6310.0196 (8)0.0166 (8)0.0136 (7)0.0008 (6)0.0001 (6)0.0010 (6)
C6320.0227 (9)0.0202 (8)0.0229 (9)0.0006 (7)0.0026 (7)0.0015 (7)
C6330.0333 (10)0.0187 (9)0.0281 (10)0.0037 (8)0.0061 (8)0.0031 (7)
C6340.0393 (11)0.0175 (8)0.0219 (9)0.0072 (8)0.0066 (8)0.0051 (7)
C6350.0241 (9)0.0289 (10)0.0304 (10)0.0094 (8)0.0002 (8)0.0074 (8)
C6360.0212 (9)0.0227 (9)0.0245 (9)0.0000 (7)0.0002 (7)0.0047 (7)
F120.0139 (5)0.0583 (8)0.0439 (7)0.0075 (5)0.0014 (5)0.0121 (6)
F130.0265 (6)0.0181 (5)0.0346 (6)0.0109 (4)0.0022 (5)0.0007 (4)
F160.0370 (7)0.0432 (7)0.0160 (5)0.0031 (5)0.0006 (5)0.0105 (5)
F210.0472 (8)0.0297 (7)0.0655 (9)0.0158 (6)0.0161 (7)0.0280 (6)
F220.0255 (6)0.0460 (7)0.0490 (8)0.0004 (5)0.0230 (6)0.0022 (6)
F230.0468 (8)0.0383 (7)0.0402 (7)0.0018 (6)0.0043 (6)0.0217 (6)
F310.0537 (8)0.0444 (7)0.0169 (5)0.0012 (6)0.0051 (5)0.0113 (5)
F320.0459 (7)0.0371 (7)0.0329 (6)0.0294 (6)0.0084 (5)0.0037 (5)
F330.0166 (5)0.0555 (8)0.0446 (7)0.0115 (5)0.0001 (5)0.0180 (6)
F410.0458 (7)0.0188 (5)0.0289 (6)0.0058 (5)0.0023 (5)0.0066 (4)
F420.0576 (9)0.0544 (9)0.0386 (7)0.0029 (7)0.0051 (7)0.0277 (6)
F430.0220 (6)0.0667 (9)0.0339 (7)0.0005 (6)0.0125 (5)0.0054 (6)
F510.0184 (5)0.0466 (7)0.0392 (7)0.0116 (5)0.0029 (5)0.0083 (6)
F520.0377 (6)0.0241 (6)0.0301 (6)0.0178 (5)0.0024 (5)0.0000 (5)
F530.0464 (7)0.0337 (6)0.0155 (5)0.0016 (5)0.0065 (5)0.0083 (4)
F610.0308 (7)0.0560 (8)0.0569 (8)0.0005 (6)0.0294 (6)0.0006 (7)
F620.0367 (6)0.0384 (7)0.0267 (6)0.0068 (5)0.0069 (5)0.0153 (5)
F630.0524 (8)0.0225 (6)0.0449 (7)0.0129 (5)0.0117 (6)0.0151 (5)
Geometric parameters (Å, º) top
Ag1—N22.3665 (14)C323—C3241.370 (3)
Ag1—P12.4437 (4)C323—H3230.93
Ag1—P22.4858 (5)C324—F321.359 (2)
Ag1—S12.5662 (5)C324—C3251.372 (3)
Ag2—N12.3750 (14)C325—C3261.393 (2)
Ag2—P32.4485 (4)C325—H3250.93
Ag2—P42.4907 (4)C326—H3260.93
Ag2—S22.5576 (5)C331—C3321.393 (2)
Ag3—N32.4090 (15)C331—C3361.399 (2)
Ag3—P52.4534 (4)C332—C3331.389 (2)
Ag3—P62.4901 (4)C332—H3320.93
Ag3—S32.5457 (5)C333—C3341.374 (3)
P1—C1111.8217 (16)C333—H3330.93
P1—C1211.8252 (17)C334—F331.359 (2)
P1—C1311.8254 (16)C334—C3351.370 (3)
P2—C2111.8191 (17)C335—C3361.389 (2)
P2—C2311.8212 (17)C335—H3350.93
P2—C2211.8237 (18)C336—H3360.93
P3—C3311.8193 (16)C411—C4121.394 (2)
P3—C3111.8214 (16)C411—C4161.394 (2)
P3—C3211.8271 (16)C412—C4131.387 (2)
P4—C4311.8204 (17)C412—H4120.93
P4—C4211.8219 (17)C413—C4141.376 (3)
P4—C4111.8246 (17)C413—H4130.93
P5—C5311.8204 (16)C414—F411.3543 (19)
P5—C5111.8256 (17)C414—C4151.378 (3)
P5—C5211.8287 (16)C415—C4161.388 (2)
P6—C6311.8194 (17)C415—H4150.93
P6—C6111.8222 (17)C416—H4160.93
P6—C6211.8257 (17)C421—C4221.388 (2)
S1—C11.6567 (17)C421—C4261.388 (2)
C1—N11.158 (2)C422—C4231.388 (3)
S2—C21.6504 (17)C422—H4220.93
C2—N21.161 (2)C423—C4241.357 (3)
S3—C31.6535 (17)C423—H4230.93
C3—N3i1.163 (2)C424—F421.353 (2)
N3—C3i1.163 (2)C424—C4251.372 (3)
C111—C1121.395 (2)C425—C4261.387 (3)
C111—C1161.398 (2)C425—H4250.93
C112—C1131.389 (2)C426—H4260.93
C112—H1120.93C431—C4321.380 (2)
C113—C1141.372 (3)C431—C4361.389 (2)
C113—H1130.93C432—C4331.390 (3)
C114—F161.3577 (19)C432—H4320.93
C114—C1151.379 (3)C433—C4341.367 (3)
C115—C1161.387 (2)C433—H4330.93
C115—H1150.93C434—F431.356 (2)
C116—H1160.93C434—C4351.370 (3)
C121—C1221.390 (2)C435—C4361.381 (3)
C121—C1261.397 (2)C435—H4350.93
C122—C1231.391 (3)C436—H4360.93
C122—H1220.93C511—C5121.391 (2)
C123—C1241.374 (3)C511—C5161.399 (2)
C123—H1230.93C512—C5131.393 (2)
C124—F121.3551 (19)C512—H5120.93
C124—C1251.374 (3)C513—C5141.374 (3)
C125—C1261.391 (2)C513—H5130.93
C125—H1250.93C514—F511.357 (2)
C126—H1260.93C514—C5151.375 (3)
C131—C1361.394 (2)C515—C5161.391 (2)
C131—C1321.395 (2)C515—H5150.93
C132—C1331.388 (2)C516—H5160.93
C132—H1320.93C521—C5261.393 (2)
C133—C1341.379 (2)C521—C5221.396 (2)
C133—H1330.93C522—C5231.392 (2)
C134—F131.3575 (18)C522—H5220.93
C134—C1351.378 (2)C523—C5241.375 (3)
C135—C1361.387 (2)C523—H5230.93
C135—H1350.93C524—F521.3583 (19)
C136—H1360.93C524—C5251.374 (3)
C211—C2121.390 (2)C525—C5261.391 (2)
C211—C2161.390 (2)C525—H5250.93
C212—C2131.384 (3)C526—H5260.93
C212—H2120.93C531—C5361.391 (2)
C213—C2141.371 (3)C531—C5321.396 (2)
C213—H2130.93C532—C5331.384 (2)
C214—F211.354 (2)C532—H5320.93
C214—C2151.368 (3)C533—C5341.375 (3)
C215—C2161.388 (2)C533—H5330.93
C215—H2150.93C534—F531.3596 (19)
C216—H2160.93C534—C5351.374 (2)
C221—C2221.388 (2)C535—C5361.387 (2)
C221—C2261.397 (2)C535—H5350.93
C222—C2231.392 (3)C536—H5360.93
C222—H2220.93C611—C6161.394 (2)
C223—C2241.373 (3)C611—C6121.395 (2)
C223—H2230.93C612—C6131.383 (3)
C224—F221.358 (2)C612—H6120.93
C224—C2251.372 (3)C613—C6141.369 (3)
C225—C2261.381 (3)C613—H6130.93
C225—H2250.93C614—F611.357 (2)
C226—H2260.93C614—C6151.366 (3)
C231—C2321.386 (2)C615—C6161.395 (3)
C231—C2361.392 (2)C615—H6150.93
C232—C2331.394 (3)C616—H6160.93
C232—H2320.93C621—C6261.391 (2)
C233—C2341.366 (3)C621—C6221.395 (2)
C233—H2330.93C622—C6231.386 (2)
C234—F231.352 (2)C622—H6220.93
C234—C2351.369 (3)C623—C6241.376 (3)
C235—C2361.383 (3)C623—H6230.93
C235—H2350.93C624—F621.354 (2)
C236—H2360.93C624—C6251.363 (3)
C311—C3161.393 (2)C625—C6261.394 (2)
C311—C3121.394 (2)C625—H6250.93
C312—C3131.387 (2)C626—H6260.93
C312—H3120.93C631—C6361.391 (2)
C313—C3141.375 (3)C631—C6321.393 (2)
C313—H3130.93C632—C6331.385 (2)
C314—F311.3595 (19)C632—H6320.93
C314—C3151.375 (3)C633—C6341.370 (3)
C315—C3161.386 (2)C633—H6330.93
C315—H3150.93C634—F631.357 (2)
C316—H3160.93C634—C6351.375 (3)
C321—C3261.388 (2)C635—C6361.391 (2)
C321—C3221.398 (2)C635—H6350.93
C322—C3231.385 (2)C636—H6360.93
C322—H3220.93
N2—Ag1—P1113.46 (4)C321—C322—H322119.7
N2—Ag1—P294.48 (4)C324—C323—C322118.44 (17)
P1—Ag1—P2119.589 (15)C324—C323—H323120.8
N2—Ag1—S1100.24 (4)C322—C323—H323120.8
P1—Ag1—S1113.870 (15)F32—C324—C323118.51 (18)
P2—Ag1—S1111.867 (16)F32—C324—C325118.64 (18)
N1—Ag2—P3116.66 (4)C323—C324—C325122.85 (17)
N1—Ag2—P494.24 (4)C324—C325—C326118.39 (17)
P3—Ag2—P4119.127 (15)C324—C325—H325120.8
N1—Ag2—S2102.87 (4)C326—C325—H325120.8
P3—Ag2—S2110.631 (15)C321—C326—C325120.55 (17)
P4—Ag2—S2111.345 (17)C321—C326—H326119.7
N3—Ag3—P5111.84 (4)C325—C326—H326119.7
N3—Ag3—P692.20 (4)C332—C331—C336118.47 (15)
P5—Ag3—P6119.923 (15)C332—C331—P3122.50 (13)
N3—Ag3—S3100.15 (4)C336—C331—P3118.52 (12)
P5—Ag3—S3112.366 (15)C333—C332—C331121.03 (17)
P6—Ag3—S3116.275 (17)C333—C332—H332119.5
C111—P1—C121105.35 (7)C331—C332—H332119.5
C111—P1—C131101.85 (7)C334—C333—C332118.30 (17)
C121—P1—C131105.11 (7)C334—C333—H333120.8
C111—P1—Ag1114.65 (5)C332—C333—H333120.8
C121—P1—Ag1111.62 (5)F33—C334—C335118.28 (16)
C131—P1—Ag1117.03 (5)F33—C334—C333118.82 (17)
C211—P2—C231103.05 (8)C335—C334—C333122.90 (17)
C211—P2—C221102.41 (8)C334—C335—C336118.32 (16)
C231—P2—C221106.35 (8)C334—C335—H335120.8
C211—P2—Ag1114.11 (5)C336—C335—H335120.8
C231—P2—Ag1119.14 (5)C335—C336—C331120.97 (16)
C221—P2—Ag1110.20 (6)C335—C336—H336119.5
C331—P3—C311105.29 (7)C331—C336—H336119.5
C331—P3—C321104.62 (7)C412—C411—C416119.20 (16)
C311—P3—C321102.75 (7)C412—C411—P4118.49 (13)
C331—P3—Ag2110.28 (5)C416—C411—P4122.31 (13)
C311—P3—Ag2115.51 (5)C413—C412—C411120.52 (17)
C321—P3—Ag2117.17 (5)C413—C412—H412119.7
C431—P4—C421106.40 (8)C411—C412—H412119.7
C431—P4—C411101.69 (8)C414—C413—C412118.56 (17)
C421—P4—C411103.32 (8)C414—C413—H413120.7
C431—P4—Ag2108.98 (5)C412—C413—H413120.7
C421—P4—Ag2119.60 (6)F41—C414—C413118.73 (17)
C411—P4—Ag2115.09 (5)F41—C414—C415118.56 (16)
C531—P5—C511104.49 (7)C413—C414—C415122.70 (16)
C531—P5—C521102.92 (7)C414—C415—C416118.20 (16)
C511—P5—C521104.46 (7)C414—C415—H415120.9
C531—P5—Ag3114.80 (5)C416—C415—H415120.9
C511—P5—Ag3111.71 (5)C415—C416—C411120.81 (17)
C521—P5—Ag3117.12 (5)C415—C416—H416119.6
C631—P6—C611102.89 (8)C411—C416—H416119.6
C631—P6—C621102.53 (7)C422—C421—C426118.56 (17)
C611—P6—C621105.64 (8)C422—C421—P4123.15 (13)
C631—P6—Ag3112.08 (5)C426—C421—P4118.20 (13)
C611—P6—Ag3108.61 (6)C421—C422—C423120.58 (18)
C621—P6—Ag3123.13 (5)C421—C422—H422119.7
C1—S1—Ag1101.32 (6)C423—C422—H422119.7
N1—C1—S1178.51 (16)C424—C423—C422118.87 (19)
C1—N1—Ag2148.63 (13)C424—C423—H423120.6
C2—S2—Ag299.93 (6)C422—C423—H423120.6
N2—C2—S2178.82 (17)F42—C424—C423118.94 (19)
C2—N2—Ag1151.14 (13)F42—C424—C425118.18 (19)
C3—S3—Ag3100.01 (6)C423—C424—C425122.88 (18)
N3i—C3—S3179.08 (17)C424—C425—C426117.83 (18)
C3i—N3—Ag3154.23 (13)C424—C425—H425121.1
C112—C111—C116119.21 (15)C426—C425—H425121.1
C112—C111—P1118.17 (12)C425—C426—C421121.26 (18)
C116—C111—P1122.52 (12)C425—C426—H426119.4
C113—C112—C111120.49 (16)C421—C426—H426119.4
C113—C112—H112119.8C432—C431—C436118.62 (17)
C111—C112—H112119.8C432—C431—P4125.45 (14)
C114—C113—C112118.39 (16)C436—C431—P4115.92 (13)
C114—C113—H113120.8C431—C432—C433121.00 (18)
C112—C113—H113120.8C431—C432—H432119.5
F16—C114—C113118.22 (16)C433—C432—H432119.5
F16—C114—C115118.67 (16)C434—C433—C432118.20 (18)
C113—C114—C115123.10 (16)C434—C433—H433120.9
C114—C115—C116118.08 (17)C432—C433—H433120.9
C114—C115—H115121F43—C434—C433118.88 (17)
C116—C115—H115121F43—C434—C435118.37 (17)
C115—C116—C111120.70 (16)C433—C434—C435122.74 (18)
C115—C116—H116119.6C434—C435—C436118.14 (17)
C111—C116—H116119.6C434—C435—H435120.9
C122—C121—C126118.49 (15)C436—C435—H435120.9
C122—C121—P1121.79 (13)C435—C436—C431121.21 (17)
C126—C121—P1119.29 (12)C435—C436—H436119.4
C121—C122—C123121.25 (17)C431—C436—H436119.4
C121—C122—H122119.4C512—C511—C516118.55 (15)
C123—C122—H122119.4C512—C511—P5123.09 (13)
C124—C123—C122118.27 (17)C516—C511—P5118.14 (13)
C124—C123—H123120.9C511—C512—C513121.11 (16)
C122—C123—H123120.9C511—C512—H512119.4
F12—C124—C125118.55 (16)C513—C512—H512119.4
F12—C124—C123118.83 (17)C514—C513—C512118.30 (17)
C125—C124—C123122.62 (16)C514—C513—H513120.9
C124—C125—C126118.46 (16)C512—C513—H513120.9
C124—C125—H125120.8F51—C514—C513118.81 (17)
C126—C125—H125120.8F51—C514—C515118.44 (16)
C125—C126—C121120.92 (16)C513—C514—C515122.74 (17)
C125—C126—H126119.5C514—C515—C516118.36 (16)
C121—C126—H126119.5C514—C515—H515120.8
C136—C131—C132118.87 (14)C516—C515—H515120.8
C136—C131—P1116.88 (12)C515—C516—C511120.93 (16)
C132—C131—P1124.20 (12)C515—C516—H516119.5
C133—C132—C131120.90 (15)C511—C516—H516119.5
C133—C132—H132119.6C526—C521—C522119.01 (15)
C131—C132—H132119.6C526—C521—P5117.59 (12)
C134—C133—C132118.16 (15)C522—C521—P5123.39 (13)
C134—C133—H133120.9C523—C522—C521120.71 (17)
C132—C133—H133120.9C523—C522—H522119.6
F13—C134—C135118.41 (15)C521—C522—H522119.6
F13—C134—C133118.72 (15)C524—C523—C522118.21 (17)
C135—C134—C133122.87 (15)C524—C523—H523120.9
C134—C135—C136118.11 (16)C522—C523—H523120.9
C134—C135—H135120.9F52—C524—C525118.54 (16)
C136—C135—H135120.9F52—C524—C523118.50 (16)
C135—C136—C131121.04 (15)C525—C524—C523122.96 (16)
C135—C136—H136119.5C524—C525—C526118.31 (16)
C131—C136—H136119.5C524—C525—H525120.8
C212—C211—C216119.07 (16)C526—C525—H525120.8
C212—C211—P2118.17 (13)C525—C526—C521120.77 (16)
C216—C211—P2122.75 (13)C525—C526—H526119.6
C213—C212—C211120.53 (17)C521—C526—H526119.6
C213—C212—H212119.7C536—C531—C532119.29 (15)
C211—C212—H212119.7C536—C531—P5118.44 (12)
C214—C213—C212118.48 (18)C532—C531—P5122.26 (12)
C214—C213—H213120.8C533—C532—C531120.61 (16)
C212—C213—H213120.8C533—C532—H532119.7
F21—C214—C215118.83 (17)C531—C532—H532119.7
F21—C214—C213118.16 (18)C534—C533—C532118.09 (16)
C215—C214—C213123.00 (17)C534—C533—H533121
C214—C215—C216118.07 (17)C532—C533—H533121
C214—C215—H215121F53—C534—C535118.09 (16)
C216—C215—H215121F53—C534—C533118.65 (16)
C215—C216—C211120.85 (17)C535—C534—C533123.25 (16)
C215—C216—H216119.6C534—C535—C536118.08 (16)
C211—C216—H216119.6C534—C535—H535121
C222—C221—C226119.03 (16)C536—C535—H535121
C222—C221—P2125.03 (14)C535—C536—C531120.63 (15)
C226—C221—P2115.93 (13)C535—C536—H536119.7
C221—C222—C223120.72 (18)C531—C536—H536119.7
C221—C222—H222119.6C616—C611—C612118.73 (16)
C223—C222—H222119.6C616—C611—P6125.46 (14)
C224—C223—C222117.92 (18)C612—C611—P6115.79 (13)
C224—C223—H223121C613—C612—C611120.90 (18)
C222—C223—H223121C613—C612—H612119.6
F22—C224—C225118.13 (18)C611—C612—H612119.6
F22—C224—C223118.56 (17)C614—C613—C612118.31 (19)
C225—C224—C223123.32 (18)C614—C613—H613120.8
C224—C225—C226118.04 (18)C612—C613—H613120.8
C224—C225—H225121F61—C614—C615118.66 (18)
C226—C225—H225121F61—C614—C613118.06 (19)
C225—C226—C221120.91 (17)C615—C614—C613123.28 (18)
C225—C226—H226119.5C614—C615—C616118.08 (18)
C221—C226—H226119.5C614—C615—H615121
C232—C231—C236118.62 (16)C616—C615—H615121
C232—C231—P2123.33 (13)C611—C616—C615120.67 (18)
C236—C231—P2117.86 (14)C611—C616—H616119.7
C231—C232—C233120.44 (17)C615—C616—H616119.7
C231—C232—H232119.8C626—C621—C622118.46 (16)
C233—C232—H232119.8C626—C621—P6122.17 (13)
C234—C233—C232118.77 (19)C622—C621—P6119.21 (13)
C234—C233—H233120.6C623—C622—C621121.39 (17)
C232—C233—H233120.6C623—C622—H622119.3
F23—C234—C233118.96 (19)C621—C622—H622119.3
F23—C234—C235118.36 (18)C624—C623—C622117.96 (17)
C233—C234—C235122.65 (18)C624—C623—H623121
C234—C235—C236118.11 (17)C622—C623—H623121
C234—C235—H235120.9F62—C624—C625118.83 (17)
C236—C235—H235120.9F62—C624—C623118.33 (17)
C235—C236—C231121.38 (18)C625—C624—C623122.84 (17)
C235—C236—H236119.3C624—C625—C626118.76 (17)
C231—C236—H236119.3C624—C625—H625120.6
C316—C311—C312119.30 (15)C626—C625—H625120.6
C316—C311—P3117.89 (13)C621—C626—C625120.58 (16)
C312—C311—P3122.76 (13)C621—C626—H626119.7
C313—C312—C311120.83 (16)C625—C626—H626119.7
C313—C312—H312119.6C636—C631—C632119.11 (16)
C311—C312—H312119.6C636—C631—P6119.05 (13)
C314—C313—C312117.84 (17)C632—C631—P6121.83 (13)
C314—C313—H313121.1C633—C632—C631120.86 (17)
C312—C313—H313121.1C633—C632—H632119.6
F31—C314—C315117.89 (17)C631—C632—H632119.6
F31—C314—C313118.82 (17)C634—C633—C632118.17 (17)
C315—C314—C313123.29 (16)C634—C633—H633120.9
C314—C315—C316118.23 (16)C632—C633—H633120.9
C314—C315—H315120.9F63—C634—C633118.44 (17)
C316—C315—H315120.9F63—C634—C635118.36 (18)
C315—C316—C311120.49 (16)C633—C634—C635123.19 (17)
C315—C316—H316119.8C634—C635—C636118.06 (17)
C311—C316—H316119.8C634—C635—H635121
C326—C321—C322119.06 (15)C636—C635—H635121
C326—C321—P3117.50 (12)C635—C636—C631120.61 (17)
C322—C321—P3123.39 (13)C635—C636—H636119.7
C323—C322—C321120.69 (17)C631—C636—H636119.7
C323—C322—H322119.7
N2—Ag1—P1—C1114.84 (7)C312—C313—C314—C3150.4 (3)
P2—Ag1—P1—C111114.98 (6)F31—C314—C315—C316178.18 (16)
S1—Ag1—P1—C111108.99 (6)C313—C314—C315—C3161.7 (3)
N2—Ag1—P1—C121114.84 (7)C314—C315—C316—C3111.8 (3)
P2—Ag1—P1—C1214.70 (6)C312—C311—C316—C3150.5 (2)
S1—Ag1—P1—C121131.33 (6)P3—C311—C316—C315176.87 (13)
N2—Ag1—P1—C131124.04 (7)C331—P3—C321—C326160.56 (13)
P2—Ag1—P1—C131125.82 (6)C311—P3—C321—C32689.66 (14)
S1—Ag1—P1—C13110.21 (6)Ag2—P3—C321—C32638.11 (14)
N2—Ag1—P2—C21137.66 (7)C331—P3—C321—C32222.22 (16)
P1—Ag1—P2—C211157.92 (6)C311—P3—C321—C32287.56 (15)
S1—Ag1—P2—C21165.26 (6)Ag2—P3—C321—C322144.67 (12)
N2—Ag1—P2—C231159.85 (7)C326—C321—C322—C3230.4 (2)
P1—Ag1—P2—C23179.90 (7)P3—C321—C322—C323177.55 (13)
S1—Ag1—P2—C23156.92 (7)C321—C322—C323—C3241.2 (3)
N2—Ag1—P2—C22176.89 (7)C322—C323—C324—F32179.37 (15)
P1—Ag1—P2—C22143.36 (6)C322—C323—C324—C3250.7 (3)
S1—Ag1—P2—C221179.81 (6)F32—C324—C325—C326179.38 (15)
N1—Ag2—P3—C331118.64 (7)C323—C324—C325—C3260.5 (3)
P4—Ag2—P3—C3316.65 (6)C322—C321—C326—C3250.9 (3)
S2—Ag2—P3—C331124.27 (6)P3—C321—C326—C325176.43 (13)
N1—Ag2—P3—C3110.55 (7)C324—C325—C326—C3211.3 (3)
P4—Ag2—P3—C311112.54 (6)C311—P3—C331—C33223.13 (16)
S2—Ag2—P3—C311116.54 (6)C321—P3—C331—C332131.06 (15)
N1—Ag2—P3—C321121.88 (7)Ag2—P3—C331—C332102.11 (14)
P4—Ag2—P3—C321126.13 (6)C311—P3—C331—C336165.21 (13)
S2—Ag2—P3—C3214.79 (6)C321—P3—C331—C33657.29 (14)
N1—Ag2—P4—C43180.15 (7)Ag2—P3—C331—C33669.55 (13)
P3—Ag2—P4—C43143.65 (6)C336—C331—C332—C3330.3 (3)
S2—Ag2—P4—C431174.26 (6)P3—C331—C332—C333171.39 (15)
N1—Ag2—P4—C421157.24 (7)C331—C332—C333—C3340.2 (3)
P3—Ag2—P4—C42178.96 (7)C332—C333—C334—F33179.76 (18)
S2—Ag2—P4—C42151.65 (7)C332—C333—C334—C3350.6 (3)
N1—Ag2—P4—C41133.29 (7)F33—C334—C335—C336179.78 (16)
P3—Ag2—P4—C411157.09 (6)C333—C334—C335—C3360.6 (3)
S2—Ag2—P4—C41172.31 (6)C334—C335—C336—C3310.1 (3)
N3—Ag3—P5—C5315.34 (7)C332—C331—C336—C3350.3 (2)
P6—Ag3—P5—C531111.50 (6)P3—C331—C336—C335171.70 (13)
S3—Ag3—P5—C531106.39 (6)C431—P4—C411—C412157.16 (14)
N3—Ag3—P5—C511113.39 (7)C421—P4—C411—C41292.64 (14)
P6—Ag3—P5—C5117.22 (6)Ag2—P4—C411—C41239.53 (15)
S3—Ag3—P5—C511134.88 (6)C431—P4—C411—C41622.05 (16)
N3—Ag3—P5—C521126.22 (7)C421—P4—C411—C41688.15 (15)
P6—Ag3—P5—C521127.62 (6)Ag2—P4—C411—C416139.68 (13)
S3—Ag3—P5—C52114.49 (6)C416—C411—C412—C4130.3 (3)
N3—Ag3—P6—C63135.04 (7)P4—C411—C412—C413179.52 (14)
P5—Ag3—P6—C631151.89 (6)C411—C412—C413—C4141.2 (3)
S3—Ag3—P6—C63167.41 (6)C412—C413—C414—F41177.49 (15)
N3—Ag3—P6—C61177.96 (7)C412—C413—C414—C4151.4 (3)
P5—Ag3—P6—C61138.89 (6)F41—C414—C415—C416178.22 (15)
S3—Ag3—P6—C611179.59 (6)C413—C414—C415—C4160.6 (3)
N3—Ag3—P6—C621158.03 (7)C414—C415—C416—C4110.3 (3)
P5—Ag3—P6—C62185.13 (7)C412—C411—C416—C4150.5 (3)
S3—Ag3—P6—C62155.57 (7)P4—C411—C416—C415178.75 (13)
N2—Ag1—S1—C120.02 (7)C431—P4—C421—C42286.90 (17)
P1—Ag1—S1—C1141.52 (6)C411—P4—C421—C42219.77 (17)
P2—Ag1—S1—C179.07 (6)Ag2—P4—C421—C422149.24 (14)
Ag1—S1—C1—N1139 (7)C431—P4—C421—C42696.53 (15)
S1—C1—N1—Ag218E1 (10)C411—P4—C421—C426156.80 (15)
P3—Ag2—N1—C1157.9 (2)Ag2—P4—C421—C42627.34 (17)
P4—Ag2—N1—C176.4 (2)C426—C421—C422—C4231.1 (3)
S2—Ag2—N1—C136.6 (3)P4—C421—C422—C423177.64 (16)
N1—Ag2—S2—C216.83 (7)C421—C422—C423—C4240.3 (3)
P3—Ag2—S2—C2142.13 (6)C422—C423—C424—F42179.95 (19)
P4—Ag2—S2—C283.00 (6)C422—C423—C424—C4251.0 (3)
Ag2—S2—C2—N216E1 (6)F42—C424—C425—C426179.22 (18)
S2—C2—N2—Ag1159 (11)C423—C424—C425—C4260.2 (3)
P1—Ag1—N2—C2164.9 (3)C424—C425—C426—C4211.2 (3)
P2—Ag1—N2—C270.1 (3)C422—C421—C426—C4251.8 (3)
S1—Ag1—N2—C243.1 (3)P4—C421—C426—C425178.58 (16)
N3—Ag3—S3—C314.74 (7)C421—P4—C431—C4321.70 (19)
P5—Ag3—S3—C3133.58 (6)C411—P4—C431—C432109.53 (17)
P6—Ag3—S3—C382.84 (6)Ag2—P4—C431—C432128.53 (16)
Ag3—S3—C3—N3i17E1 (8)C421—P4—C431—C436177.46 (13)
P5—Ag3—N3—C3i154.8 (3)C411—P4—C431—C43669.63 (15)
P6—Ag3—N3—C3i81.6 (3)Ag2—P4—C431—C43652.31 (14)
S3—Ag3—N3—C3i35.6 (3)C436—C431—C432—C4330.3 (3)
C121—P1—C111—C112130.37 (13)P4—C431—C432—C433179.42 (18)
C131—P1—C111—C112120.14 (13)C431—C432—C433—C4340.8 (4)
Ag1—P1—C111—C1127.25 (14)C432—C433—C434—F43179.5 (2)
C121—P1—C111—C11653.33 (15)C432—C433—C434—C4350.8 (4)
C131—P1—C111—C11656.17 (15)F43—C434—C435—C436178.47 (17)
Ag1—P1—C111—C116176.45 (12)C433—C434—C435—C4362.8 (3)
C116—C111—C112—C1130.3 (2)C434—C435—C436—C4313.3 (3)
P1—C111—C112—C113176.72 (13)C432—C431—C436—C4351.8 (3)
C111—C112—C113—C1140.9 (2)P4—C431—C436—C435177.42 (15)
C112—C113—C114—F16178.16 (15)C531—P5—C511—C51214.81 (16)
C112—C113—C114—C1151.1 (3)C521—P5—C511—C512122.57 (15)
F16—C114—C115—C116179.23 (16)Ag3—P5—C511—C512109.88 (14)
C113—C114—C115—C1160.0 (3)C531—P5—C511—C516170.69 (12)
C114—C115—C116—C1111.3 (3)C521—P5—C511—C51662.92 (14)
C112—C111—C116—C1151.4 (2)Ag3—P5—C511—C51664.62 (13)
P1—C111—C116—C115177.66 (13)C516—C511—C512—C5130.4 (3)
C111—P1—C121—C12226.92 (16)P5—C511—C512—C513174.84 (15)
C131—P1—C121—C122134.06 (14)C511—C512—C513—C5140.1 (3)
Ag1—P1—C121—C12298.12 (14)C512—C513—C514—F51179.11 (17)
C111—P1—C121—C126160.73 (13)C512—C513—C514—C5150.2 (3)
C131—P1—C121—C12653.59 (14)F51—C514—C515—C516179.48 (15)
Ag1—P1—C121—C12674.24 (13)C513—C514—C515—C5160.2 (3)
C126—C121—C122—C1230.1 (3)C514—C515—C516—C5110.7 (3)
P1—C121—C122—C123172.54 (16)C512—C511—C516—C5150.7 (2)
C121—C122—C123—C1240.1 (3)P5—C511—C516—C515175.50 (13)
C122—C123—C124—F12179.11 (18)C531—P5—C521—C52686.78 (14)
C122—C123—C124—C1250.2 (3)C511—P5—C521—C526164.30 (13)
F12—C124—C125—C126179.17 (16)Ag3—P5—C521—C52640.16 (14)
C123—C124—C125—C1260.1 (3)C531—P5—C521—C52291.96 (15)
C124—C125—C126—C1210.1 (2)C511—P5—C521—C52216.96 (16)
C122—C121—C126—C1250.2 (2)Ag3—P5—C521—C522141.11 (12)
P1—C121—C126—C125172.80 (13)C526—C521—C522—C5231.1 (2)
C111—P1—C131—C13686.18 (13)P5—C521—C522—C523179.80 (13)
C121—P1—C131—C136164.13 (12)C521—C522—C523—C5241.4 (3)
Ag1—P1—C131—C13639.65 (14)C522—C523—C524—F52179.50 (15)
C111—P1—C131—C13291.39 (14)C522—C523—C524—C5250.2 (3)
C121—P1—C131—C13218.29 (15)F52—C524—C525—C526179.02 (15)
Ag1—P1—C131—C132142.77 (12)C523—C524—C525—C5261.3 (3)
C136—C131—C132—C1330.7 (2)C524—C525—C526—C5211.6 (3)
P1—C131—C132—C133178.20 (13)C522—C521—C526—C5250.4 (2)
C131—C132—C133—C1341.6 (2)P5—C521—C526—C525178.36 (13)
C132—C133—C134—F13179.03 (14)C511—P5—C531—C536122.27 (13)
C132—C133—C134—C1350.7 (3)C521—P5—C531—C536128.83 (13)
F13—C134—C135—C136179.13 (14)Ag3—P5—C531—C5360.44 (15)
C133—C134—C135—C1361.1 (3)C511—P5—C531—C53258.96 (15)
C134—C135—C136—C1312.1 (2)C521—P5—C531—C53249.94 (15)
C132—C131—C136—C1351.2 (2)Ag3—P5—C531—C532178.33 (12)
P1—C131—C136—C135176.47 (13)C536—C531—C532—C5332.0 (3)
C231—P2—C211—C21291.92 (15)P5—C531—C532—C533179.26 (13)
C221—P2—C211—C212157.79 (14)C531—C532—C533—C5341.1 (3)
Ag1—P2—C211—C21238.72 (15)C532—C533—C534—F53178.79 (16)
C231—P2—C211—C21686.57 (15)C532—C533—C534—C5351.0 (3)
C221—P2—C211—C21623.72 (16)F53—C534—C535—C536177.62 (15)
Ag1—P2—C211—C216142.79 (13)C533—C534—C535—C5362.2 (3)
C216—C211—C212—C2130.7 (3)C534—C535—C536—C5311.2 (3)
P2—C211—C212—C213177.85 (16)C532—C531—C536—C5350.8 (2)
C211—C212—C213—C2140.2 (3)P5—C531—C536—C535179.57 (13)
C212—C213—C214—F21179.71 (18)C631—P6—C611—C61694.21 (16)
C212—C213—C214—C2150.4 (3)C621—P6—C611—C61612.96 (17)
F21—C214—C215—C216179.87 (17)Ag3—P6—C611—C616146.84 (14)
C213—C214—C215—C2160.6 (3)C631—P6—C611—C61284.10 (15)
C214—C215—C216—C2110.1 (3)C621—P6—C611—C612168.73 (14)
C212—C211—C216—C2150.5 (3)Ag3—P6—C611—C61234.85 (15)
P2—C211—C216—C215177.95 (14)C616—C611—C612—C6130.1 (3)
C211—P2—C221—C22299.50 (16)P6—C611—C612—C613178.54 (16)
C231—P2—C221—C2228.29 (18)C611—C612—C613—C6141.3 (3)
Ag1—P2—C221—C222138.73 (14)C612—C613—C614—F61178.32 (18)
C211—P2—C221—C22679.09 (14)C612—C613—C614—C6151.8 (3)
C231—P2—C221—C226173.13 (13)F61—C614—C615—C616179.37 (17)
Ag1—P2—C221—C22642.69 (14)C613—C614—C615—C6160.8 (3)
C226—C221—C222—C2231.0 (3)C612—C611—C616—C6151.2 (3)
P2—C221—C222—C223179.54 (15)P6—C611—C616—C615179.44 (15)
C221—C222—C223—C2241.7 (3)C614—C615—C616—C6110.8 (3)
C222—C223—C224—F22179.37 (17)C631—P6—C621—C6266.22 (16)
C222—C223—C224—C2250.2 (3)C611—P6—C621—C626113.66 (15)
F22—C224—C225—C226178.53 (16)Ag3—P6—C621—C626121.00 (13)
C223—C224—C225—C2261.9 (3)C631—P6—C621—C622178.29 (14)
C224—C225—C226—C2212.6 (3)C611—P6—C621—C62270.86 (15)
C222—C221—C226—C2251.2 (3)Ag3—P6—C621—C62254.48 (16)
P2—C221—C226—C225177.50 (14)C626—C621—C622—C6230.6 (3)
C211—P2—C231—C2325.65 (17)P6—C621—C622—C623176.20 (14)
C221—P2—C231—C232101.69 (16)C621—C622—C623—C6240.6 (3)
Ag1—P2—C231—C232133.18 (14)C622—C623—C624—F62179.17 (16)
C211—P2—C231—C236169.19 (14)C622—C623—C624—C6250.1 (3)
C221—P2—C231—C23683.48 (15)F62—C624—C625—C626179.68 (16)
Ag1—P2—C231—C23641.66 (16)C623—C624—C625—C6260.4 (3)
C236—C231—C232—C2331.1 (3)C622—C621—C626—C6250.0 (3)
P2—C231—C232—C233175.91 (16)P6—C621—C626—C625175.54 (14)
C231—C232—C233—C2340.5 (3)C624—C625—C626—C6210.5 (3)
C232—C233—C234—F23179.85 (18)C611—P6—C631—C636153.90 (14)
C232—C233—C234—C2351.6 (3)C621—P6—C631—C63696.58 (14)
F23—C234—C235—C236179.26 (17)Ag3—P6—C631—C63637.40 (15)
C233—C234—C235—C2361.0 (3)C611—P6—C631—C63227.46 (16)
C234—C235—C236—C2310.7 (3)C621—P6—C631—C63282.06 (15)
C232—C231—C236—C2351.7 (3)Ag3—P6—C631—C632143.96 (13)
P2—C231—C236—C235176.83 (15)C636—C631—C632—C6330.3 (3)
C331—P3—C311—C316122.99 (13)P6—C631—C632—C633178.37 (14)
C321—P3—C311—C316127.74 (13)C631—C632—C633—C6340.3 (3)
Ag2—P3—C311—C3161.08 (15)C632—C633—C634—F63178.41 (16)
C331—P3—C311—C31259.76 (15)C632—C633—C634—C6350.6 (3)
C321—P3—C311—C31249.52 (15)F63—C634—C635—C636178.26 (17)
Ag2—P3—C311—C312178.34 (12)C633—C634—C635—C6360.7 (3)
C316—C311—C312—C3130.9 (3)C634—C635—C636—C6310.6 (3)
P3—C311—C312—C313178.15 (14)C632—C631—C636—C6350.4 (3)
C311—C312—C313—C3141.0 (3)P6—C631—C636—C635178.25 (14)
C312—C313—C314—F31179.55 (16)
Symmetry code: (i) x, y+2, z+1.
 

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