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The title compound, (C6H5)2GeS2C2(CN)2, crystallizes with two mol­ecules in the asymmetric unit. Each five-membered ring has an envelope conformation.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536803016325/wn6173sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536803016325/wn6173Isup2.hkl
Contains datablock I

CCDC reference: 221654

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.007 Å
  • R factor = 0.045
  • wR factor = 0.100
  • Data-to-parameter ratio = 21.0

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


Yellow Alert Alert Level C:
PLAT_371 Alert C Long C(sp2)-C(sp1) Bond C13A - C14A = 1.44 Ang. PLAT_371 Alert C Long C(sp2)-C(sp1) Bond C15A - C16A = 1.43 Ang. PLAT_371 Alert C Long C(sp2)-C(sp1) Bond C13B - C14B = 1.44 Ang. PLAT_371 Alert C Long C(sp2)-C(sp1) Bond C15B - C16B = 1.43 Ang.
0 Alert Level A = Potentially serious problem
0 Alert Level B = Potential problem
4 Alert Level C = Please check

Computing details top

Data collection: SMART (Siemens, 1996); cell refinement: SAINT (Siemens,1996); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEP-3 for Windows (Farrugia, 1997); software used to prepare material for publication: WinGX (Farrugia, 1999).

2,2-Diphenyl-1,3,2-dithiagermole-4,5-dicarbonitrile top
Crystal data top
C16H10GeN2S2F(000) = 1472
Mr = 367.01Dx = 1.495 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybcCell parameters from 5356 reflections
a = 15.3121 (11) Åθ = 2.4–24.7°
b = 14.0064 (10) ŵ = 2.13 mm1
c = 15.7730 (11) ÅT = 293 K
β = 105.390 (1)°Slab, light brown
V = 3261.5 (4) Å30.40 × 0.40 × 0.20 mm
Z = 8
Data collection top
Siemens SMART CCD area-detector
diffractometer
7949 independent reflections
Radiation source: fine-focus sealed tube4421 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.046
Detector resolution: 8.33 pixels mm-1θmax = 28.3°, θmin = 2.2°
ω scansh = 1620
Absorption correction: multi-scan
(SADABS; Sheldrick, 1996)
k = 1813
Tmin = 0.469, Tmax = 0.656l = 2021
19939 measured reflections
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.045Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.100H-atom parameters constrained
S = 1.04 w = 1/[σ2(Fo2) + (0.0286P)2 + 1.6083P]
where P = (Fo2 + 2Fc2)/3
7949 reflections(Δ/σ)max < 0.001
379 parametersΔρmax = 0.39 e Å3
0 restraintsΔρmin = 0.34 e Å3
Special details top

Geometry. Bond distances, angles etc. have been calculated using the rounded fractional coordinates. All e.s.d.'s are estimated from the variances of the (full) variance-covariance matrix. The cell e.s.d.'s are taken into account in the estimation of distances, angles and torsion angles

Refinement. Refinement on F2 for ALL reflections except those flagged by the user for potential systematic errors. Weighted R-factors wR and all goodnesses of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The observed criterion of F2 > σ(F2) is used only for calculating -R-factor-obs etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R-factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Ge1A0.26299 (3)0.37156 (3)0.06723 (3)0.0433 (1)
S1A0.29231 (6)0.29402 (7)0.04698 (7)0.0500 (3)
S2A0.12875 (7)0.29841 (7)0.05615 (6)0.0498 (4)
N1A0.1635 (2)0.1645 (3)0.2393 (2)0.0631 (14)
N2A0.0377 (2)0.1721 (3)0.1142 (2)0.0588 (12)
C1A0.3485 (2)0.3417 (3)0.1776 (2)0.0478 (14)
C2A0.3720 (3)0.4108 (4)0.2411 (3)0.0657 (17)
C3A0.4311 (3)0.3933 (5)0.3211 (3)0.087 (2)
C4A0.4651 (4)0.3042 (5)0.3390 (4)0.095 (3)
C5A0.4440 (4)0.2325 (4)0.2776 (4)0.101 (3)
C6A0.3840 (3)0.2521 (4)0.1947 (3)0.0761 (19)
C7A0.2421 (3)0.5066 (3)0.0469 (2)0.0448 (12)
C8A0.1560 (3)0.5436 (3)0.0202 (3)0.0652 (17)
C9A0.1416 (4)0.6400 (4)0.0074 (3)0.080 (2)
C10A0.2125 (4)0.7017 (4)0.0210 (3)0.083 (2)
C11A0.2980 (4)0.6673 (4)0.0473 (4)0.089 (2)
C12A0.3134 (3)0.5709 (3)0.0613 (3)0.0711 (19)
C13A0.1845 (2)0.2462 (2)0.0891 (2)0.0386 (12)
C14A0.1714 (3)0.2006 (3)0.1732 (3)0.0471 (14)
C15A0.1175 (2)0.2490 (2)0.0482 (2)0.0387 (12)
C16A0.0315 (3)0.2055 (3)0.0864 (2)0.0442 (12)
Ge1B0.20841 (3)0.95399 (3)0.21895 (3)0.0463 (2)
S1B0.33172 (8)1.00175 (8)0.32352 (8)0.0622 (4)
S2B0.22458 (7)0.79810 (7)0.25345 (7)0.0579 (4)
N1B0.5319 (3)0.8919 (3)0.4642 (3)0.0830 (16)
N2B0.4113 (3)0.6455 (3)0.3733 (4)0.109 (2)
C1B0.1026 (2)1.0115 (3)0.2410 (2)0.0464 (12)
C2B0.0738 (3)1.0991 (3)0.2062 (3)0.0609 (17)
C3B0.0006 (3)1.1433 (3)0.2240 (3)0.0752 (19)
C4B0.0460 (3)1.0976 (4)0.2760 (4)0.076 (2)
C5B0.0188 (4)1.0101 (4)0.3103 (3)0.080 (2)
C6B0.0549 (3)0.9680 (3)0.2926 (3)0.0669 (19)
C7B0.2270 (3)0.9781 (3)0.1048 (3)0.0497 (14)
C8B0.3132 (3)0.9811 (4)0.0953 (3)0.082 (2)
C9B0.3286 (4)0.9922 (5)0.0131 (4)0.103 (3)
C10B0.2559 (4)0.9985 (4)0.0595 (3)0.087 (3)
C11B0.1699 (4)0.9973 (3)0.0515 (3)0.0690 (19)
C12B0.1553 (3)0.9862 (3)0.0312 (3)0.0575 (17)
C13B0.3762 (2)0.8887 (3)0.3527 (2)0.0448 (12)
C14B0.4637 (3)0.8891 (3)0.4152 (3)0.0559 (17)
C15B0.3330 (3)0.8061 (3)0.3244 (3)0.0481 (14)
C16B0.3767 (3)0.7166 (3)0.3522 (3)0.0681 (19)
H2A0.347000.471400.229300.0780*
H3A0.447600.441800.362600.1040*
H4A0.503600.291300.394200.1140*
H5A0.468900.172000.290400.1210*
H6A0.368800.204500.152300.0910*
H8A0.106500.502600.010700.0780*
H9A0.082700.663200.010700.0950*
H10A0.202300.766900.012300.1000*
H11A0.346900.709000.055900.1070*
H12A0.372500.548700.080700.0850*
H2B0.104401.129400.170200.0730*
H3B0.019301.203300.200900.0910*
H4B0.096001.126600.288000.0910*
H5B0.050100.979300.345400.0960*
H6B0.073300.908200.316300.0800*
H8B0.362200.975500.144600.0990*
H9B0.387400.995500.007300.1240*
H10B0.265701.003500.115000.1040*
H11B0.121101.003900.100900.0830*
H12B0.096400.984200.036800.0690*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ge1A0.0375 (2)0.0471 (2)0.0421 (2)0.0047 (2)0.0047 (2)0.0039 (2)
S1A0.0398 (6)0.0590 (6)0.0532 (6)0.0093 (5)0.0159 (5)0.0087 (5)
S2A0.0442 (6)0.0628 (7)0.0439 (6)0.0142 (5)0.0145 (5)0.0113 (5)
N1A0.064 (2)0.083 (3)0.043 (2)0.005 (2)0.0152 (18)0.0035 (19)
N2A0.047 (2)0.067 (2)0.060 (2)0.0105 (18)0.0101 (18)0.0121 (18)
C1A0.033 (2)0.062 (3)0.044 (2)0.0022 (19)0.0027 (17)0.003 (2)
C2A0.044 (3)0.090 (3)0.055 (3)0.008 (2)0.001 (2)0.009 (3)
C3A0.063 (3)0.127 (5)0.060 (3)0.009 (3)0.001 (3)0.011 (3)
C4A0.073 (4)0.137 (6)0.061 (4)0.004 (4)0.005 (3)0.020 (4)
C5A0.080 (4)0.086 (4)0.121 (5)0.012 (3)0.001 (4)0.040 (4)
C6A0.064 (3)0.074 (3)0.080 (4)0.001 (3)0.001 (3)0.012 (3)
C7A0.046 (2)0.044 (2)0.044 (2)0.0028 (19)0.0115 (18)0.0044 (18)
C8A0.058 (3)0.065 (3)0.066 (3)0.003 (2)0.005 (2)0.011 (2)
C9A0.075 (4)0.071 (4)0.088 (4)0.021 (3)0.013 (3)0.002 (3)
C10A0.121 (5)0.052 (3)0.077 (4)0.015 (3)0.028 (4)0.007 (3)
C11A0.093 (4)0.050 (3)0.125 (5)0.015 (3)0.029 (4)0.014 (3)
C12A0.048 (3)0.058 (3)0.107 (4)0.005 (2)0.020 (3)0.013 (3)
C13A0.039 (2)0.038 (2)0.037 (2)0.0023 (16)0.0071 (17)0.0001 (16)
C14A0.041 (2)0.059 (3)0.041 (2)0.0028 (19)0.0105 (18)0.005 (2)
C15A0.037 (2)0.041 (2)0.036 (2)0.0030 (16)0.0059 (16)0.0002 (16)
C16A0.043 (2)0.048 (2)0.041 (2)0.0059 (19)0.0102 (18)0.0036 (18)
Ge1B0.0468 (3)0.0480 (3)0.0405 (2)0.0073 (2)0.0054 (2)0.0007 (2)
S1B0.0624 (7)0.0429 (6)0.0669 (7)0.0016 (5)0.0081 (6)0.0090 (5)
S2B0.0545 (7)0.0439 (6)0.0653 (7)0.0056 (5)0.0014 (5)0.0032 (5)
N1B0.052 (2)0.088 (3)0.094 (3)0.012 (2)0.007 (2)0.006 (2)
N2B0.085 (3)0.060 (3)0.181 (5)0.023 (3)0.035 (3)0.037 (3)
C1B0.043 (2)0.050 (2)0.041 (2)0.0004 (19)0.0019 (18)0.0104 (18)
C2B0.060 (3)0.052 (3)0.070 (3)0.007 (2)0.016 (2)0.001 (2)
C3B0.072 (3)0.057 (3)0.091 (4)0.021 (3)0.012 (3)0.005 (3)
C4B0.052 (3)0.086 (4)0.089 (4)0.004 (3)0.015 (3)0.036 (3)
C5B0.090 (4)0.083 (4)0.082 (4)0.010 (3)0.050 (3)0.022 (3)
C6B0.088 (4)0.061 (3)0.060 (3)0.008 (3)0.034 (3)0.002 (2)
C7B0.055 (3)0.048 (2)0.047 (2)0.0071 (19)0.015 (2)0.0013 (19)
C8B0.063 (3)0.124 (5)0.064 (3)0.023 (3)0.024 (3)0.019 (3)
C9B0.078 (4)0.155 (6)0.090 (4)0.037 (4)0.046 (4)0.031 (4)
C10B0.115 (5)0.092 (4)0.067 (4)0.034 (4)0.048 (4)0.016 (3)
C11B0.096 (4)0.055 (3)0.051 (3)0.009 (3)0.011 (3)0.007 (2)
C12B0.070 (3)0.052 (3)0.049 (3)0.004 (2)0.013 (2)0.004 (2)
C13B0.040 (2)0.048 (2)0.045 (2)0.0063 (18)0.0088 (18)0.0006 (18)
C14B0.047 (3)0.058 (3)0.062 (3)0.003 (2)0.013 (2)0.006 (2)
C15B0.046 (2)0.043 (2)0.055 (3)0.0033 (19)0.0128 (19)0.0061 (19)
C16B0.057 (3)0.048 (3)0.102 (4)0.008 (2)0.026 (3)0.015 (3)
Geometric parameters (Å, º) top
Ge1A—S1A2.2484 (11)C4A—H4A0.9305
Ge1A—S2A2.2616 (12)C5A—H5A0.9292
Ge1A—C1A1.926 (3)C6A—H6A0.9291
Ge1A—C7A1.931 (4)C8A—H8A0.9308
Ge1B—C1B1.922 (3)C9A—H9A0.9294
Ge1B—C7B1.926 (5)C10A—H10A0.9305
Ge1B—S2B2.2480 (11)C11A—H11A0.9307
Ge1B—S1B2.2539 (13)C12A—H12A0.9286
S1A—C13A1.742 (3)C1B—C2B1.368 (6)
S2A—C15A1.751 (3)C1B—C6B1.372 (6)
S1B—C13B1.737 (4)C2B—C3B1.389 (7)
S2B—C15B1.742 (5)C3B—C4B1.367 (7)
N1A—C14A1.136 (6)C4B—C5B1.360 (8)
N2A—C16A1.135 (6)C5B—C6B1.366 (8)
N1B—C14B1.123 (7)C7B—C8B1.368 (7)
N2B—C16B1.136 (6)C7B—C12B1.375 (7)
C1A—C6A1.366 (7)C8B—C9B1.387 (8)
C1A—C2A1.370 (6)C9B—C10B1.372 (8)
C2A—C3A1.366 (7)C10B—C11B1.356 (9)
C3A—C4A1.353 (10)C11B—C12B1.389 (7)
C4A—C5A1.373 (9)C13B—C14B1.437 (6)
C5A—C6A1.411 (8)C13B—C15B1.349 (6)
C7A—C8A1.375 (6)C15B—C16B1.434 (6)
C7A—C12A1.387 (6)C2B—H2B0.9291
C8A—C9A1.374 (7)C3B—H3B0.9304
C9A—C10A1.359 (8)C4B—H4B0.9295
C10A—C11A1.353 (9)C5B—H5B0.9291
C11A—C12A1.378 (7)C6B—H6B0.9299
C13A—C14A1.438 (5)C8B—H8B0.9296
C13A—C15A1.350 (4)C9B—H9B0.9300
C15A—C16A1.431 (5)C10B—H10B0.9292
C2A—H2A0.9294C11B—H11B0.9301
C3A—H3A0.9306C12B—H12B0.9297
Ge1A···N1Bi3.319 (5)C1B···C7B3.261 (6)
Ge1B···N2Aii3.223 (4)C2A···C12A3.539 (7)
S1A···C1A3.481 (3)C2B···C14Aiv3.495 (6)
S1A···C7A3.500 (4)C3B···C16Aiv3.590 (6)
S1A···S2A3.3293 (15)C3B···C14Aiv3.476 (6)
S1A···N1Bi2.994 (5)C4B···C16Aiv3.515 (7)
S1A···S1Biii3.6569 (16)C5B···N1Aii3.290 (7)
S1A···C15A2.745 (3)C6B···N2Aii3.383 (6)
S1B···C7B3.413 (5)C6B···C8Aiv3.516 (6)
S1B···C15B2.740 (4)C7A···S2A3.416 (4)
S1B···C1B3.405 (3)C7A···S1A3.500 (4)
S1B···C8B3.547 (5)C7A···C2A3.450 (6)
S1B···S2B3.3297 (16)C7A···C1A3.234 (5)
S1B···S1Aiv3.6569 (16)C7B···S1B3.413 (5)
S2A···C8A3.524 (4)C7B···S2B3.450 (5)
S2A···S1A3.3293 (15)C7B···C1B3.261 (6)
S2A···C7A3.416 (4)C7B···C2B3.595 (7)
S2A···N1Av3.170 (3)C8A···C6Biii3.516 (6)
S2A···C1A3.455 (3)C9B···N2Biii3.416 (8)
S2A···C13A2.748 (3)C10B···C14Ax3.416 (7)
S2B···C1B3.502 (4)C11B···C16Ax3.561 (7)
S2B···C6B3.694 (5)C11B···C14Ax3.438 (6)
S2B···C7B3.450 (5)C11B···C13Ax3.553 (5)
S2B···S1B3.3297 (16)C12A···C2A3.539 (7)
S2B···N2Aii3.139 (3)C12B···N2Aii3.335 (6)
S2B···C13B2.743 (4)C13A···C11Bvi3.553 (5)
S1B···H8B3.0027C14A···C3Biii3.476 (6)
S2A···H8A2.9461C14A···C2Biii3.495 (6)
S2A···H2Bvi3.0553C14A···C10Bvi3.416 (7)
S2A···H9Aii3.1708C14A···C11Bvi3.438 (6)
S2B···H6B3.1536C16A···C4Biii3.515 (7)
S2B···H4Bvii3.0644C16A···C11Bvi3.561 (7)
N1A···C1Aviii3.424 (4)C16A···C3Biii3.590 (6)
N1A···S2Aviii3.170 (3)C3B···H11Bxi3.0860
N1A···C5Bii3.290 (7)C4B···H11Bxi3.0472
N1B···Ge1Aix3.319 (5)C7A···H2A2.9406
N1B···S1Aix2.994 (5)C9A···H6Biii2.9936
N1B···C1Aix3.320 (6)C12A···H2A2.9163
N2A···C12Bii3.335 (6)H2A···C7A2.9406
N2A···Ge1Bii3.223 (4)H2A···C12A2.9163
N2A···S2Bii3.139 (3)H2B···S2Ax3.0553
N2A···C6Bii3.383 (6)H3A···N2B2.9202
N2A···C1Bii3.247 (5)H4A···H11Ai2.4964
N2B···C9Biv3.416 (8)H4B···S2Bxii3.0644
N1A···H5Bii2.8862H5B···N1Aii2.8862
N1B···H12Aix2.8316H6B···C9Aiv2.9936
N2A···H12Bii2.7701H6B···S2B3.1536
N2B···H3A2.9202H8A···S2A2.9461
C1A···S2A3.455 (3)H8B···S1B3.0027
C1A···C7A3.234 (5)H9A···S2Aii3.1708
C1A···S1A3.481 (3)H11A···H4Aix2.4964
C1A···N1Av3.424 (4)H11B···C4Bxi3.0472
C1A···N1Bi3.320 (6)H11B···C3Bxi3.0860
C1B···S2B3.502 (4)H12A···N1Bi2.8316
C1B···S1B3.405 (3)H12B···N2Aii2.7701
C1B···N2Aii3.247 (5)
S1A—Ge1A—S2A95.16 (4)C10A—C9A—H9A119.70
S1A—Ge1A—C1A112.76 (11)C8A—C9A—H9A119.56
S1A—Ge1A—C7A113.55 (11)C11A—C10A—H10A120.38
S2A—Ge1A—C1A110.94 (11)C9A—C10A—H10A120.32
S2A—Ge1A—C7A108.90 (14)C10A—C11A—H11A119.79
C1A—Ge1A—C7A113.94 (16)C12A—C11A—H11A119.64
S1B—Ge1B—S2B95.40 (4)C7A—C12A—H12A119.51
S1B—Ge1B—C1B109.02 (11)C11A—C12A—H12A119.42
S1B—Ge1B—C7B109.22 (14)Ge1B—C1B—C2B120.0 (3)
S2B—Ge1B—C1B114.03 (12)Ge1B—C1B—C6B121.9 (3)
S2B—Ge1B—C7B111.25 (13)C2B—C1B—C6B118.1 (4)
C1B—Ge1B—C7B115.88 (17)C1B—C2B—C3B120.8 (4)
Ge1A—S1A—C13A96.94 (11)C2B—C3B—C4B119.2 (4)
Ge1A—S2A—C15A96.45 (11)C3B—C4B—C5B120.7 (5)
Ge1B—S1B—C13B96.71 (12)C4B—C5B—C6B119.4 (5)
Ge1B—S2B—C15B96.78 (15)C1B—C6B—C5B121.9 (4)
Ge1A—C1A—C2A119.4 (3)Ge1B—C7B—C8B119.6 (3)
Ge1A—C1A—C6A121.2 (3)Ge1B—C7B—C12B121.4 (4)
C2A—C1A—C6A119.4 (4)C8B—C7B—C12B118.9 (4)
C1A—C2A—C3A122.0 (5)C7B—C8B—C9B120.9 (5)
C2A—C3A—C4A118.8 (6)C8B—C9B—C10B119.1 (5)
C3A—C4A—C5A121.5 (6)C9B—C10B—C11B121.0 (5)
C4A—C5A—C6A119.0 (5)C10B—C11B—C12B119.4 (5)
C1A—C6A—C5A119.3 (5)C7B—C12B—C11B120.7 (5)
Ge1A—C7A—C8A121.6 (3)S1B—C13B—C14B114.0 (3)
Ge1A—C7A—C12A121.4 (3)S1B—C13B—C15B124.8 (3)
C8A—C7A—C12A117.0 (4)C14B—C13B—C15B121.1 (4)
C7A—C8A—C9A121.3 (5)N1B—C14B—C13B178.2 (5)
C8A—C9A—C10A120.7 (5)S2B—C15B—C13B124.6 (3)
C9A—C10A—C11A119.3 (5)S2B—C15B—C16B115.3 (3)
C10A—C11A—C12A120.6 (5)C13B—C15B—C16B120.0 (4)
C7A—C12A—C11A121.1 (5)N2B—C16B—C15B179.3 (5)
C14A—C13A—C15A121.1 (3)C1B—C2B—H2B119.58
S1A—C13A—C14A114.1 (3)C3B—C2B—H2B119.58
S1A—C13A—C15A124.8 (2)C2B—C3B—H3B120.47
N1A—C14A—C13A178.2 (5)C4B—C3B—H3B120.35
S2A—C15A—C16A114.5 (2)C3B—C4B—H4B119.68
C13A—C15A—C16A121.2 (3)C5B—C4B—H4B119.66
S2A—C15A—C13A124.3 (2)C4B—C5B—H5B120.24
N2A—C16A—C15A177.6 (4)C6B—C5B—H5B120.40
C1A—C2A—H2A118.97C1B—C6B—H6B119.09
C3A—C2A—H2A119.05C5B—C6B—H6B119.02
C4A—C3A—H3A120.60C7B—C8B—H8B119.59
C2A—C3A—H3A120.57C9B—C8B—H8B119.46
C3A—C4A—H4A119.18C8B—C9B—H9B120.45
C5A—C4A—H4A119.35C10B—C9B—H9B120.47
C4A—C5A—H5A120.51C9B—C10B—H10B119.55
C6A—C5A—H5A120.49C11B—C10B—H10B119.49
C1A—C6A—H6A120.44C10B—C11B—H11B120.33
C5A—C6A—H6A120.29C12B—C11B—H11B120.26
C7A—C8A—H8A119.38C7B—C12B—H12B119.66
C9A—C8A—H8A119.37C11B—C12B—H12B119.63
S2A—Ge1A—S1A—C13A12.66 (11)Ge1B—S2B—C15B—C13B9.0 (4)
C1A—Ge1A—S1A—C13A127.93 (16)Ge1B—S2B—C15B—C16B170.5 (3)
C7A—Ge1A—S1A—C13A100.55 (18)Ge1A—C1A—C2A—C3A178.9 (4)
S1A—Ge1A—S2A—C15A13.28 (11)C6A—C1A—C2A—C3A0.9 (7)
C1A—Ge1A—S2A—C15A130.05 (16)Ge1A—C1A—C6A—C5A177.8 (4)
C7A—Ge1A—S2A—C15A103.78 (14)C2A—C1A—C6A—C5A0.2 (7)
S1A—Ge1A—C1A—C2A146.2 (3)C1A—C2A—C3A—C4A2.1 (8)
S2A—Ge1A—C1A—C2A108.5 (3)C2A—C3A—C4A—C5A2.3 (9)
C7A—Ge1A—C1A—C2A14.8 (4)C3A—C4A—C5A—C6A1.3 (9)
S1A—Ge1A—C1A—C6A35.9 (3)C4A—C5A—C6A—C1A0.0 (8)
S2A—Ge1A—C1A—C6A69.5 (3)Ge1A—C7A—C8A—C9A178.8 (3)
C7A—Ge1A—C1A—C6A167.2 (3)Ge1A—C7A—C12A—C11A179.5 (4)
C1A—Ge1A—C7A—C8A131.2 (3)C12A—C7A—C8A—C9A0.8 (6)
S1A—Ge1A—C7A—C8A97.9 (3)C8A—C7A—C12A—C11A1.5 (6)
S2A—Ge1A—C7A—C8A6.8 (3)C7A—C8A—C9A—C10A0.1 (7)
C1A—Ge1A—C7A—C12A46.7 (4)C8A—C9A—C10A—C11A0.1 (7)
S1A—Ge1A—C7A—C12A84.2 (3)C9A—C10A—C11A—C12A0.8 (8)
S2A—Ge1A—C7A—C12A171.1 (3)C10A—C11A—C12A—C7A1.5 (8)
C1B—Ge1B—S1B—C13B128.63 (16)S1A—C13A—C15A—S2A2.0 (4)
C7B—Ge1B—C1B—C2B34.9 (4)C14A—C13A—C15A—C16A0.9 (5)
C7B—Ge1B—S1B—C13B103.84 (18)C14A—C13A—C15A—S2A177.2 (3)
S1B—Ge1B—S2B—C15B10.92 (16)S1A—C13A—C15A—C16A178.2 (3)
C1B—Ge1B—S2B—C15B124.53 (19)C2B—C1B—C6B—C5B0.7 (6)
C7B—Ge1B—S2B—C15B102.1 (2)C6B—C1B—C2B—C3B1.1 (6)
S1B—Ge1B—C1B—C2B88.8 (3)Ge1B—C1B—C2B—C3B177.7 (3)
S2B—Ge1B—C1B—C2B166.0 (3)Ge1B—C1B—C6B—C5B178.1 (4)
C1B—Ge1B—C7B—C8B149.7 (4)C1B—C2B—C3B—C4B0.9 (7)
S1B—Ge1B—C7B—C12B158.2 (3)C2B—C3B—C4B—C5B0.2 (8)
S2B—Ge1B—S1B—C13B10.91 (12)C3B—C4B—C5B—C6B0.2 (8)
C1B—Ge1B—C7B—C12B34.6 (4)C4B—C5B—C6B—C1B0.0 (7)
S1B—Ge1B—C1B—C6B90.0 (3)C8B—C7B—C12B—C11B0.0 (7)
S1B—Ge1B—C7B—C8B26.2 (4)C12B—C7B—C8B—C9B0.1 (8)
S2B—Ge1B—C7B—C8B77.9 (4)Ge1B—C7B—C12B—C11B175.7 (3)
C7B—Ge1B—C1B—C6B146.3 (3)Ge1B—C7B—C8B—C9B175.8 (5)
S2B—Ge1B—C7B—C12B97.8 (4)C7B—C8B—C9B—C10B1.2 (9)
S2B—Ge1B—C1B—C6B15.2 (3)C8B—C9B—C10B—C11B2.3 (9)
Ge1A—S1A—C13A—C14A171.5 (2)C9B—C10B—C11B—C12B2.2 (8)
Ge1A—S1A—C13A—C15A9.3 (3)C10B—C11B—C12B—C7B1.1 (7)
Ge1A—S2A—C15A—C13A11.8 (3)S1B—C13B—C15B—S2B0.1 (6)
Ge1A—S2A—C15A—C16A171.7 (2)C14B—C13B—C15B—C16B4.1 (6)
Ge1B—S1B—C13B—C15B8.9 (3)S1B—C13B—C15B—C16B179.4 (3)
Ge1B—S1B—C13B—C14B174.4 (3)C14B—C13B—C15B—S2B176.5 (3)
Symmetry codes: (i) x+1, y1/2, z+1/2; (ii) x, y+1, z; (iii) x, y+3/2, z1/2; (iv) x, y+3/2, z+1/2; (v) x, y+1/2, z+1/2; (vi) x, y1, z; (vii) x, y1/2, z+1/2; (viii) x, y+1/2, z1/2; (ix) x+1, y+1/2, z+1/2; (x) x, y+1, z; (xi) x, y+2, z; (xii) x, y+1/2, z+1/2.
 

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