Aqua­oxobis­(quinoline-2-carboxyl­ato-N,O)vanadium(IV) ethanol hemisolvate

The title compound, [VO(C₁₀H₆NO₂)₂(H₂O)]₂·C₂H₅OH, contains six-coordinate V^IV atoms. The central V^IV atom in each of the two crystallographically independent mol­ecules has a distorted octahedral coordination geometry, involving O atoms of the oxo and aqua ligands, together with two O and two N atoms of two organic ligands.

Key indicators

• Single-crystal X-ray study
• T = 296 K
• Mean [sigma](C-C) = 0.013 Å
• R factor = 0.067
• wR factor = 0.245
• Data-to-parameter ratio = 15.9

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level B:



PLAT_360  Alert B Short  C(sp3)-C(sp3) Bond  C1E    -   C2E    =       1.25 Ang.


 Alert Level C:



PLAT_321  Alert C Check Hybridisation of  C2E    in solvent/ion           ?

PLAT_369  Alert C Long   C(sp2)-C(sp2) Bond  C2C    -   C11C   =       1.53 Ang.

PLAT_369  Alert C Long   C(sp2)-C(sp2) Bond  C2A    -   C11A   =       1.53 Ang.


 0 Alert Level A = Potentially serious problem

 1 Alert Level B = Potential problem

 3 Alert Level C = Please check

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Computing details

Data collection: MSC/AFC Diffractometer Control Software (Molecular Structure Corporation & Rigaku Corporation, 1999); cell refinement: MSC/AFC Diffractometer Control Software; data reduction: TEXSAN (Molecular Structure Corporation & Rigaku Corporation, 1999); program(s) used to solve structure: SIR97 (Altomare et al., 1999) and DIRDIF94 (Beurskens et al., 1994); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEPII (Johnson, 1976); software used to prepare material for publication: TEXSAN.

(I)

Crystal data

[VO(C10H6NO2)2(H2O)]2·C2H5OH	Z = 2
Mr = 904.63	F(000) = 928.0
Triclinic, P1	Dx = 1.577 Mg m^−3
Hall symbol: -P 1	Mo Kα radiation, λ = 0.7107 Å
a = 11.745 (3) Å	Cell parameters from 25 reflections
b = 16.727 (6) Å	θ = 10.5–13.0°
c = 10.425 (2) Å	µ = 0.57 mm^−1
α = 106.94 (2)°	T = 296 K
β = 93.58 (2)°	Prism, green
γ = 101.33 (3)°	0.10 × 0.10 × 0.05 mm
V = 1905.3 (10) Å^3

Data collection

Rigaku AFC-5R diffractometer	Rint = 0.089
ω–2θ scans	θmax = 27.5°
Absorption correction: ψ scan (North et al., 1968)	h = 0→15
Tmin = 0.945, Tmax = 0.972	k = −21→21
9184 measured reflections	l = −13→13
8754 independent reflections	3 standard reflections every 150 reflections
2975 reflections with I > 2σ(I)	intensity decay: 0.3%

Refinement

Refinement on F^2	H-atom parameters not refined
R[F^2 > 2σ(F^2)] = 0.067	w = 1/[σ^2(Fo^2) + (0.081P)^2] where P = (Fo^2 + 2Fc^2)/3
wR(F^2) = 0.245	(Δ/σ)max = −0.001
S = 1.09	Δρmax = 0.87 e Å^−3
8754 reflections	Δρmin = −0.91 e Å^−3
550 parameters

Special details

Refinement. Refinement using reflections with F² > -10.0 σ(F²). The weighted R-factor (wR) and goodness of fit (S) are based on F². R-factor (gt) are based on F. The threshold expression of F² > 2.0 σ(F²) is used only for calculating R-factor (gt).

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Ų)

	x	y	z	Uiso*/Ueq
V1A	0.2619 (1)	0.26425 (8)	0.6196 (1)	0.0312 (4)
V1B	1.2393 (1)	0.81096 (9)	0.8821 (1)	0.0317 (4)
O1A	−0.0029 (4)	0.3558 (4)	0.4893 (6)	0.045 (1)
O1B	0.4998 (5)	0.1209 (4)	0.5290 (7)	0.058 (2)
O1C	1.5519 (5)	0.8260 (4)	0.7421 (6)	0.050 (2)
O1D	0.8899 (4)	0.7299 (4)	0.7755 (6)	0.044 (1)
O1E	0.6738 (6)	0.2678 (6)	0.5468 (8)	0.091 (3)
O1VB	1.2616 (4)	0.8436 (4)	1.0440 (5)	0.042 (1)
O1VA	0.2717 (5)	0.3005 (3)	0.7806 (6)	0.046 (1)
O2A	0.1015 (4)	0.2738 (3)	0.5570 (5)	0.037 (1)
O2B	0.4140 (4)	0.2306 (4)	0.5919 (6)	0.045 (1)
O2C	1.3888 (4)	0.7831 (3)	0.8266 (5)	0.038 (1)
O2D	1.0688 (4)	0.8139 (3)	0.8513 (5)	0.039 (1)
O2VA	0.2564 (4)	0.2167 (3)	0.3889 (5)	0.039 (1)
O2VB	1.1966 (4)	0.7669 (3)	0.6555 (5)	0.042 (1)
N1A	0.2975 (5)	0.3925 (4)	0.5964 (6)	0.030 (1)
N1B	0.2183 (5)	0.1319 (4)	0.6105 (6)	0.034 (2)
N1C	1.3305 (5)	0.9312 (4)	0.8630 (6)	0.033 (2)
N1D	1.1557 (5)	0.6829 (4)	0.8707 (6)	0.029 (1)
C1E	0.813 (1)	0.278 (1)	0.724 (1)	0.132 (6)
C2A	0.1999 (6)	0.4134 (5)	0.5554 (7)	0.031 (2)
C2B	0.3017 (6)	0.0921 (5)	0.5674 (8)	0.032 (2)
C2C	1.4332 (6)	0.9260 (5)	0.8166 (7)	0.034 (2)
C2D	1.0395 (6)	0.6650 (5)	0.8306 (8)	0.037 (2)
C2E	0.725 (1)	0.296 (2)	0.675 (2)	0.25 (2)
C3A	0.1964 (7)	0.4934 (5)	0.5460 (8)	0.035 (2)
C3B	0.2941 (7)	0.0058 (5)	0.5451 (9)	0.042 (2)
C3C	1.5105 (6)	0.9963 (6)	0.7996 (8)	0.040 (2)
C3D	0.9655 (7)	0.5844 (6)	0.8088 (9)	0.050 (2)
C4A	0.2954 (7)	0.5555 (5)	0.5823 (8)	0.040 (2)
C4B	0.1942 (7)	−0.0419 (5)	0.5720 (9)	0.042 (2)
C4C	1.4813 (7)	1.0732 (6)	0.8340 (9)	0.044 (2)
C4D	1.0120 (9)	0.5239 (6)	0.8317 (10)	0.058 (3)
C5A	0.3997 (7)	0.5390 (5)	0.6302 (8)	0.036 (2)
C5B	0.1052 (7)	−0.0011 (5)	0.6253 (8)	0.036 (2)
C5C	1.3771 (6)	1.0831 (5)	0.8896 (8)	0.035 (2)
C5D	1.1310 (9)	0.5385 (5)	0.8793 (8)	0.045 (2)
C6A	0.5072 (8)	0.6011 (5)	0.6751 (9)	0.044 (2)
C6B	0.0047 (8)	−0.0446 (5)	0.6655 (9)	0.045 (2)
C6C	1.3461 (7)	1.1624 (5)	0.9316 (8)	0.043 (2)
C6D	1.186 (1)	0.4756 (6)	0.909 (1)	0.062 (3)
C7A	0.6051 (7)	0.5813 (6)	0.7204 (8)	0.048 (2)
C7B	−0.0741 (7)	−0.0026 (6)	0.7214 (9)	0.047 (2)
C7C	1.2447 (8)	1.1690 (5)	0.9845 (9)	0.046 (2)
C7D	1.303 (1)	0.4968 (8)	0.957 (1)	0.070 (3)
C8A	0.6037 (7)	0.4997 (6)	0.7230 (9)	0.048 (2)
C8B	−0.0602 (7)	0.0837 (6)	0.7410 (9)	0.046 (2)
C8C	1.1700 (7)	1.0963 (5)	1.0001 (9)	0.043 (2)
C8D	1.3699 (9)	0.5779 (7)	0.9775 (10)	0.059 (3)
C9A	0.5044 (7)	0.4364 (6)	0.6812 (9)	0.044 (2)
C9B	0.0343 (7)	0.1288 (5)	0.7031 (8)	0.037 (2)
C9C	1.1978 (6)	1.0194 (5)	0.9605 (8)	0.039 (2)
C9D	1.3245 (8)	0.6394 (6)	0.9497 (9)	0.049 (2)
C10A	0.3998 (6)	0.4549 (5)	0.6356 (7)	0.031 (2)
C10B	0.1196 (7)	0.0852 (5)	0.6436 (8)	0.033 (2)
C10C	1.3004 (6)	1.0106 (5)	0.9020 (7)	0.029 (2)
C10D	1.2033 (7)	0.6209 (5)	0.8990 (8)	0.038 (2)
C11A	0.0884 (6)	0.3435 (5)	0.5305 (8)	0.032 (2)
C11B	0.4157 (7)	0.1496 (6)	0.5587 (9)	0.043 (2)
C11C	1.4628 (6)	0.8382 (5)	0.7906 (7)	0.035 (2)
C11D	0.9938 (6)	0.7407 (5)	0.8176 (8)	0.033 (2)
H1E	0.6496	0.2166	0.5284	0.1421*
H1E1	0.7979	0.2178	0.7177	0.1441*
H1E2	0.8809	0.2891	0.6790	0.1441*
H1E3	0.8387	0.3091	0.8206	0.1441*
H1W	0.2180	0.2389	0.3320	0.0494*
H2E2	0.6693	0.2859	0.7344	0.2849*
H2E1	0.7522	0.3594	0.7008	0.2849*
H2W	0.2981	0.1892	0.3252	0.0494*
H3A	0.1267	0.5040	0.5154	0.0439*
H3B	0.3549	−0.0193	0.5128	0.0539*
H3C	1.5806	0.9906	0.7660	0.0513*
H3D	0.8859	0.5739	0.7788	0.0643*
H3W	1.2323	0.7421	0.5966	0.0494*
H4A	0.2942	0.6091	0.5748	0.0502*
H4B	0.1855	−0.1005	0.5545	0.0537*
H4C	1.5302	1.1204	0.8209	0.0547*
H4D	0.9653	0.4692	0.8149	0.0747*
H4W	1.1212	0.7245	0.6215	0.0494*
H6A	0.5096	0.6562	0.6720	0.0559*
H6B	−0.0074	−0.1025	0.6542	0.0582*
H6C	1.3956	1.2104	0.9220	0.0550*
H6D	1.1423	0.4200	0.8930	0.0773*
H7A	0.6733	0.6230	0.7502	0.0604*
H7B	−0.1399	−0.0316	0.7483	0.0593*
H7C	1.2245	1.2213	1.0107	0.0587*
H7D	1.3373	0.4549	0.9755	0.0884*
H8A	0.6718	0.4866	0.7527	0.0593*
H8B	−0.1159	0.1125	0.7808	0.0564*
H8C	1.1006	1.1008	1.0366	0.0547*
H8D	1.4486	0.5900	1.0114	0.0760*
H9A	0.5048	0.3808	0.6823	0.0559*
H9B	0.0432	0.1875	0.7174	0.0466*
H9C	1.1486	0.9717	0.9713	0.0492*
H9D	1.3712	0.6934	0.9632	0.0616*

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
V1A	0.0251 (7)	0.0313 (8)	0.0381 (9)	0.0061 (6)	0.0035 (6)	0.0122 (7)
V1B	0.0223 (7)	0.0342 (8)	0.0373 (9)	0.0058 (6)	0.0035 (6)	0.0095 (7)
O1A	0.026 (3)	0.051 (4)	0.056 (4)	0.010 (3)	−0.003 (3)	0.015 (3)
O1B	0.036 (3)	0.070 (4)	0.088 (5)	0.030 (3)	0.024 (3)	0.041 (4)
O1C	0.035 (3)	0.072 (4)	0.053 (4)	0.028 (3)	0.021 (3)	0.019 (3)
O1D	0.027 (3)	0.056 (4)	0.051 (4)	0.012 (3)	0.001 (3)	0.018 (3)
O1E	0.040 (4)	0.148 (8)	0.067 (5)	−0.003 (4)	0.011 (4)	0.022 (5)
O1VB	0.035 (3)	0.055 (4)	0.033 (3)	0.007 (3)	0.001 (3)	0.011 (3)
O1VA	0.062 (4)	0.044 (4)	0.037 (4)	0.013 (3)	0.006 (3)	0.017 (3)
O2A	0.023 (3)	0.038 (3)	0.048 (4)	0.006 (2)	0.009 (2)	0.011 (3)
O2B	0.023 (3)	0.053 (4)	0.057 (4)	0.008 (3)	0.001 (3)	0.017 (3)
O2C	0.030 (3)	0.036 (3)	0.051 (4)	0.014 (2)	0.010 (3)	0.014 (3)
O2D	0.032 (3)	0.038 (3)	0.047 (4)	0.012 (3)	0.003 (3)	0.010 (3)
O2VA	0.039 (3)	0.049 (4)	0.034 (3)	0.021 (3)	0.011 (3)	0.009 (3)
O2VB	0.035 (3)	0.048 (4)	0.037 (3)	0.005 (3)	−0.003 (2)	0.008 (3)
N1A	0.031 (3)	0.033 (4)	0.025 (4)	0.002 (3)	0.004 (3)	0.009 (3)
N1B	0.031 (4)	0.035 (4)	0.038 (4)	0.006 (3)	0.004 (3)	0.015 (3)
N1C	0.026 (3)	0.041 (4)	0.024 (4)	−0.001 (3)	0.003 (3)	0.005 (3)
N1D	0.027 (3)	0.031 (4)	0.035 (4)	0.015 (3)	0.004 (3)	0.012 (3)
C1E	0.10 (1)	0.24 (2)	0.10 (1)	0.09 (1)	0.038 (9)	0.09 (1)
C2A	0.021 (4)	0.040 (5)	0.026 (4)	0.000 (3)	0.001 (3)	0.006 (4)
C2B	0.028 (4)	0.038 (5)	0.036 (5)	0.012 (4)	0.002 (3)	0.016 (4)
C2C	0.025 (4)	0.044 (5)	0.027 (4)	0.006 (3)	−0.003 (3)	0.004 (4)
C2D	0.028 (4)	0.044 (5)	0.035 (5)	0.003 (4)	0.003 (4)	0.012 (4)
C2E	0.09 (1)	0.56 (4)	0.06 (1)	0.15 (2)	−0.008 (9)	0.00 (2)
C3A	0.037 (4)	0.033 (5)	0.037 (5)	0.016 (4)	0.001 (4)	0.010 (4)
C3B	0.045 (5)	0.035 (5)	0.055 (6)	0.024 (4)	0.005 (4)	0.017 (4)
C3C	0.021 (4)	0.058 (6)	0.041 (5)	−0.005 (4)	0.000 (3)	0.023 (4)
C3D	0.043 (5)	0.044 (6)	0.065 (7)	−0.002 (4)	0.007 (5)	0.024 (5)
C4A	0.054 (5)	0.022 (4)	0.047 (5)	0.006 (4)	0.012 (4)	0.015 (4)
C4B	0.054 (5)	0.023 (4)	0.046 (6)	0.011 (4)	−0.010 (4)	0.007 (4)
C4C	0.033 (4)	0.044 (5)	0.054 (6)	−0.006 (4)	0.002 (4)	0.026 (5)
C4D	0.066 (7)	0.038 (6)	0.059 (7)	−0.012 (5)	0.005 (5)	0.014 (5)
C5A	0.046 (5)	0.028 (4)	0.033 (5)	0.002 (4)	0.010 (4)	0.010 (4)
C5B	0.041 (5)	0.034 (5)	0.033 (5)	−0.001 (4)	−0.001 (4)	0.019 (4)
C5C	0.028 (4)	0.035 (5)	0.035 (5)	0.003 (4)	−0.004 (3)	0.006 (4)
C5D	0.075 (7)	0.034 (5)	0.029 (5)	0.020 (5)	0.016 (5)	0.010 (4)
C6A	0.051 (5)	0.028 (5)	0.048 (6)	0.000 (4)	0.017 (4)	0.007 (4)
C6B	0.049 (5)	0.040 (5)	0.045 (6)	−0.006 (4)	−0.006 (4)	0.024 (4)
C6C	0.043 (5)	0.040 (5)	0.039 (5)	0.002 (4)	−0.005 (4)	0.012 (4)
C6D	0.096 (8)	0.038 (6)	0.057 (7)	0.026 (6)	0.028 (6)	0.012 (5)
C7A	0.042 (5)	0.045 (6)	0.041 (6)	−0.017 (4)	−0.001 (4)	0.011 (4)
C7B	0.044 (5)	0.058 (6)	0.037 (5)	−0.005 (4)	0.009 (4)	0.021 (5)
C7C	0.058 (6)	0.031 (5)	0.042 (5)	0.012 (4)	−0.006 (4)	0.004 (4)
C7D	0.108 (10)	0.080 (8)	0.046 (7)	0.068 (7)	0.021 (6)	0.024 (6)
C8A	0.031 (4)	0.049 (6)	0.056 (6)	−0.002 (4)	−0.005 (4)	0.013 (5)
C8B	0.044 (5)	0.051 (6)	0.045 (6)	0.012 (4)	0.011 (4)	0.018 (5)
C8C	0.050 (5)	0.038 (5)	0.047 (6)	0.026 (4)	0.014 (4)	0.009 (4)
C8D	0.063 (7)	0.079 (8)	0.054 (7)	0.043 (6)	0.014 (5)	0.029 (6)
C9A	0.038 (5)	0.050 (6)	0.042 (5)	0.001 (4)	−0.004 (4)	0.020 (4)
C9B	0.040 (5)	0.035 (5)	0.042 (5)	0.012 (4)	0.013 (4)	0.018 (4)
C9C	0.028 (4)	0.044 (5)	0.040 (5)	0.008 (4)	0.006 (4)	0.007 (4)
C9D	0.049 (5)	0.063 (6)	0.045 (6)	0.026 (5)	0.007 (4)	0.022 (5)
C10A	0.031 (4)	0.031 (4)	0.028 (4)	0.001 (3)	0.006 (3)	0.007 (3)
C10B	0.038 (4)	0.031 (4)	0.033 (5)	0.009 (4)	0.001 (4)	0.015 (4)
C10C	0.028 (4)	0.030 (4)	0.024 (4)	0.007 (3)	−0.002 (3)	0.002 (3)
C10D	0.049 (5)	0.038 (5)	0.033 (5)	0.014 (4)	0.012 (4)	0.016 (4)
C11A	0.030 (4)	0.034 (5)	0.032 (5)	0.009 (3)	0.013 (3)	0.005 (4)
C11B	0.030 (4)	0.062 (6)	0.047 (6)	0.021 (4)	0.009 (4)	0.025 (5)
C11C	0.024 (4)	0.052 (5)	0.025 (4)	0.014 (4)	−0.005 (3)	0.004 (4)
C11D	0.026 (4)	0.039 (5)	0.035 (5)	0.008 (3)	0.004 (3)	0.012 (4)

Geometric parameters (Å, º)

V1A—O1VA	1.599 (6)	C3C—C4C	1.35 (1)
V1A—O2A	2.005 (5)	C3C—H3C	0.926
V1A—O2B	1.990 (6)	C3D—C4D	1.31 (2)
V1A—O2VA	2.294 (5)	C3D—H3D	0.933
V1A—N1A	2.191 (7)	C4A—C5A	1.40 (1)
V1A—N1B	2.145 (7)	C4A—H4A	0.925
V1B—O1VB	1.602 (5)	C4B—C5B	1.41 (1)
V1B—O2C	1.982 (6)	C4B—H4B	0.926
V1B—O2D	2.020 (5)	C4C—C5C	1.40 (1)
V1B—O2VB	2.251 (5)	C4C—H4C	0.932
V1B—N1C	2.155 (7)	C4D—C5D	1.40 (1)
V1B—N1D	2.139 (6)	C4D—H4D	0.931
O1A—C11A	1.207 (10)	C5A—C6A	1.42 (1)
O1B—C11B	1.20 (1)	C5A—C10A	1.42 (1)
O1C—C11C	1.217 (10)	C5B—C6B	1.42 (1)
O1D—C11D	1.231 (9)	C5B—C10B	1.37 (1)
O1E—C2E	1.34 (2)	C5C—C6C	1.40 (1)
O1E—H1E	0.808	C5C—C10C	1.41 (1)
O2A—C11A	1.31 (1)	C5D—C6D	1.43 (2)
O2B—C11B	1.30 (1)	C5D—C10D	1.42 (1)
O2C—C11C	1.293 (10)	C6A—C7A	1.35 (1)
O2D—C11D	1.298 (9)	C6A—H6A	0.927
O2VA—H1W	0.924	C6B—C7B	1.33 (1)
O2VA—H2W	0.919	C6B—H6B	0.921
O2VB—H3W	0.822	C6C—C7C	1.35 (1)
O2VB—H4W	0.990	C6C—H6C	0.929
N1A—C2A	1.34 (1)	C6D—C7D	1.37 (2)
N1A—C10A	1.377 (8)	C6D—H6D	0.933
N1B—C2B	1.32 (1)	C7A—C8A	1.37 (1)
N1B—C10B	1.387 (10)	C7A—H7A	0.921
N1C—C2C	1.336 (10)	C7B—C8B	1.37 (1)
N1C—C10C	1.39 (1)	C7B—H7B	0.933
N1D—C2D	1.351 (9)	C7C—C8C	1.41 (1)
N1D—C10D	1.37 (1)	C7C—H7C	0.922
C1E—C2E	1.26 (3)	C7D—C8D	1.38 (2)
C1E—H1E1	0.966	C7D—H7D	0.933
C1E—H1E2	0.960	C8A—C9A	1.36 (1)
C1E—H1E3	0.989	C8A—H8A	0.927
C2A—C3A	1.38 (1)	C8B—C9B	1.36 (1)
C2A—C11A	1.526 (10)	C8B—H8B	0.935
C2B—C3B	1.38 (1)	C8C—C9C	1.34 (1)
C2B—C11B	1.51 (1)	C8C—H8C	0.928
C2C—C3C	1.40 (1)	C8D—C9D	1.34 (2)
C2C—C11C	1.53 (1)	C8D—H8D	0.929
C2D—C3D	1.40 (1)	C9A—C10A	1.41 (1)
C2D—C11D	1.51 (1)	C9A—H9A	0.936
C2E—H2E2	0.950	C9B—C10B	1.42 (1)
C2E—H2E1	0.987	C9B—H9B	0.932
C3A—C4A	1.35 (1)	C9C—C10C	1.40 (1)
C3A—H3A	0.928	C9C—H9C	0.929
C3B—C4B	1.38 (1)	C9D—C10D	1.43 (1)
C3B—H3B	0.930	C9D—H9D	0.927
O1A···O2VB^i	2.757 (6)	C5A···C8A^i	3.54 (1)
O1A···C11D^i	3.155 (9)	C5B···C10B^xi	3.48 (1)
O1A···O1D^i	3.215 (8)	C5B···C9C^iv	3.49 (1)
O1A···C2D^i	3.24 (1)	C5B···C5B^xi	3.50 (2)
O1A···C3D^i	3.56 (1)	C5B···C10C^iv	3.51 (1)
O1B···O1C^ii	3.26 (1)	C5B···C9B^xi	3.554 (10)
O1B···C3C^ii	3.397 (10)	C5B···C6B^xi	3.56 (1)
O1B···C3B^iii	3.50 (1)	C5C···C11C^v	3.47 (1)
O1B···C4C^iv	3.51 (1)	C6A···C10A^i	3.41 (1)
O1C···O2VA^ii	2.810 (8)	C6A···C9A^i	3.57 (1)
O1C···C11B^ii	3.31 (1)	C6B···C10B^xi	3.27 (1)
O1C···O2B^ii	3.404 (8)	C6B···C9C^iv	3.47 (1)
O1C···C6C^v	3.47 (1)	C6C···C11C^v	3.56 (1)
O1C···C6A^vi	3.54 (1)	C7A···C10A^i	3.58 (1)
O1C···C7C^v	3.57 (1)	C7C···C10B^x	3.52 (1)
O1D···O2VA^i	2.795 (9)	C7C···C9B^x	3.53 (1)
O1D···C11A^i	3.113 (9)	C7D···C8A^xii	3.43 (1)
O1D···C7C^vii	3.27 (1)	C7D···C10A^vi	3.53 (1)
O1D···C8C^vii	3.387 (10)	C11A···C11D^i	3.48 (1)
O1D···O2A^i	3.457 (8)	C2A···C5A	2.722 (10)
O1D···C2A^i	3.533 (8)	C2A···C6D^ix	3.55 (1)
O1E···O2VB^ii	2.672 (9)	C2B···C5B	2.73 (1)
O1E···C11C^ii	3.555 (10)	C2B···C5C^iv	3.47 (1)
O1E···C4A^i	3.55 (1)	C2B···C4C^iv	3.51 (1)
O1VB···C4C^v	3.085 (9)	C2C···C5C	2.74 (1)
O1VB···C3C^v	3.331 (8)	C2D···C5D	2.71 (1)
O1VB···C8B^viii	3.51 (1)	C3A···C5D^ix	3.50 (1)
O1VA···C7D^ix	3.20 (1)	C3B···C4C^iv	3.38 (1)
O1VA···C6D^ix	3.23 (1)	C3B···C5C^iv	3.45 (1)
O1VA···C6C^iv	3.36 (1)	C4A···C8A^i	3.40 (1)
O1VA···C7C^iv	3.46 (1)	C4B···C8B^xi	3.35 (1)
O2C···C6A^vi	3.58 (1)	C4B···C9B^xi	3.55 (1)
O2VB···C2E^ii	3.54 (2)	C4D···C6D	2.51 (2)
O2VB···C4B^x	3.56 (1)	C5A···C8A	2.79 (1)
N1A···C6D^ix	3.59 (1)	C5A···C9D^ix	3.52 (1)
N1B···C6C^iv	3.43 (1)	C5A···C8D^ix	3.54 (1)
N1B···C6B^xi	3.517 (10)	C5A···C8A^i	3.54 (1)
N1C···C4B^x	3.53 (1)	C5B···C8B	2.76 (1)
C2A···C6D^ix	3.55 (1)	C5B···C9C^iv	3.49 (1)
C2B···C5C^iv	3.47 (1)	C5B···C5B^xi	3.50 (2)
C2B···C4C^iv	3.51 (1)	C5B···C9B^xi	3.554 (10)
C3A···C5D^ix	3.50 (1)	C5B···C6B^xi	3.56 (1)
C3B···C4C^iv	3.38 (1)	C5C···C8C	2.78 (1)
C3B···C5C^iv	3.45 (1)	C5D···C8D	2.81 (1)
C4A···C8A^i	3.40 (1)	C6A···C9A	2.77 (1)
C4A···C10D^ix	3.48 (1)	C6A···C9A^i	3.57 (1)
C4B···C8B^xi	3.35 (1)	C6B···C9B	2.76 (1)
C4B···C10C^iv	3.38 (1)	C6B···C9C^iv	3.47 (1)
C4B···C9B^xi	3.55 (1)	C6C···C9C	2.77 (1)
C4C···C11B^x	3.57 (1)	C6D···C9D	2.79 (1)
C5A···C9D^ix	3.52 (1)	C7C···C9B^x	3.53 (1)
C5A···C8D^ix	3.54 (1)	C7D···C8A^xii	3.43 (1)
O1VA—V1A—O2A	103.6 (3)	C3B—C4B—H4B	119.8
O1VA—V1A—O2B	102.3 (3)	C5B—C4B—H4B	120.5
O1VA—V1A—O2VA	177.2 (2)	C3C—C4C—C5C	120.7 (8)
O1VA—V1A—N1A	93.4 (3)	C3C—C4C—H4C	120.2
O1VA—V1A—N1B	94.9 (3)	C5C—C4C—H4C	119.1
O2A—V1A—O2B	154.0 (2)	C3D—C4D—C5D	122.1 (8)
O2A—V1A—O2VA	78.1 (2)	C3D—C4D—H4D	119.5
O2A—V1A—N1A	78.2 (2)	C5D—C4D—H4D	118.4
O2A—V1A—N1B	97.7 (2)	C4A—C5A—C6A	124.3 (8)
O2B—V1A—O2VA	76.0 (2)	C4A—C5A—C10A	118.8 (6)
O2B—V1A—N1A	102.2 (3)	C6A—C5A—C10A	116.9 (8)
O2B—V1A—N1B	78.1 (3)	C4B—C5B—C6B	122.7 (8)
O2VA—V1A—N1A	84.9 (2)	C4B—C5B—C10B	118.4 (7)
O2VA—V1A—N1B	86.9 (2)	C6B—C5B—C10B	118.9 (8)
N1A—V1A—N1B	171.4 (2)	C4C—C5C—C6C	122.4 (8)
O1VB—V1B—O2C	104.4 (3)	C4C—C5C—C10C	118.9 (8)
O1VB—V1B—O2D	100.4 (3)	C6C—C5C—C10C	118.8 (7)
O1VB—V1B—O2VB	176.4 (3)	C4D—C5D—C6D	124.6 (8)
O1VB—V1B—N1C	94.0 (3)	C4D—C5D—C10D	118.4 (9)
O1VB—V1B—N1D	93.9 (3)	C6D—C5D—C10D	117.0 (9)
O2C—V1B—O2D	154.9 (2)	C5A—C6A—C7A	121.5 (8)
O2C—V1B—O2VB	79.2 (2)	C5A—C6A—H6A	118.6
O2C—V1B—N1C	78.7 (2)	C7A—C6A—H6A	119.9
O2C—V1B—N1D	95.5 (2)	C5B—C6B—C7B	120.6 (8)
O2D—V1B—O2VB	76.0 (2)	C5B—C6B—H6B	120.7
O2D—V1B—N1C	103.5 (2)	C7B—C6B—H6B	118.7
O2D—V1B—N1D	78.9 (2)	C5C—C6C—C7C	120.3 (8)
O2VB—V1B—N1C	86.5 (2)	C5C—C6C—H6C	119.2
O2VB—V1B—N1D	85.8 (2)	C7C—C6C—H6C	120.5
N1C—V1B—N1D	171.1 (2)	C5D—C6D—C7D	120.1 (9)
C2E—O1E—H1E	107.1	C5D—C6D—H6D	119.5
V1A—O2A—C11A	119.4 (4)	C7D—C6D—H6D	120.4
V1A—O2B—C11B	118.8 (5)	C6A—C7A—C8A	120.6 (7)
V1B—O2C—C11C	119.2 (5)	C6A—C7A—H7A	119.7
V1B—O2D—C11D	116.5 (5)	C8A—C7A—H7A	119.6
V1A—O2VA—H1W	122.8	C6B—C7B—C8B	121.0 (8)
V1A—O2VA—H2W	139.2	C6B—C7B—H7B	120.1
H1W—O2VA—H2W	95.5	C8B—C7B—H7B	118.9
V1B—O2VB—H3W	130.0	C6C—C7C—C8C	120.5 (8)
V1B—O2VB—H4W	113.8	C6C—C7C—H7C	119.7
H3W—O2VB—H4W	94.8	C8C—C7C—H7C	119.8
V1A—N1A—C2A	112.2 (5)	C6D—C7D—C8D	121 (1)
V1A—N1A—C10A	128.5 (6)	C6D—C7D—H7D	118.8
C2A—N1A—C10A	118.6 (7)	C8D—C7D—H7D	119.9
V1A—N1B—C2B	111.9 (5)	C7A—C8A—C9A	121.4 (9)
V1A—N1B—C10B	130.0 (5)	C7A—C8A—H8A	119.8
C2B—N1B—C10B	118.1 (7)	C9A—C8A—H8A	118.8
V1B—N1C—C2C	112.1 (5)	C7B—C8B—C9B	120.9 (8)
V1B—N1C—C10C	128.7 (5)	C7B—C8B—H8B	120.1
C2C—N1C—C10C	119.0 (6)	C9B—C8B—H8B	118.9
V1B—N1D—C2D	112.2 (6)	C7C—C8C—C9C	120.2 (8)
V1B—N1D—C10D	129.2 (5)	C7C—C8C—H8C	120.5
C2D—N1D—C10D	118.5 (7)	C9C—C8C—H8C	119.3
C2E—C1E—H1E1	111.1	C7D—C8D—C9D	121.7 (10)
C2E—C1E—H1E2	113.3	C7D—C8D—H8D	118.9
C2E—C1E—H1E3	114.0	C9D—C8D—H8D	119.4
H1E1—C1E—H1E2	107.3	C8A—C9A—C10A	119.7 (9)
H1E1—C1E—H1E3	105.0	C8A—C9A—H9A	120.6
H1E2—C1E—H1E3	105.5	C10A—C9A—H9A	119.6
N1A—C2A—C3A	123.8 (6)	C8B—C9B—C10B	118.9 (8)
N1A—C2A—C11A	114.7 (7)	C8B—C9B—H9B	120.2
C3A—C2A—C11A	121.3 (7)	C10B—C9B—H9B	120.8
N1B—C2B—C3B	124.1 (7)	C8C—C9C—C10C	120.3 (8)
N1B—C2B—C11B	115.4 (7)	C8C—C9C—H9C	120.1
C3B—C2B—C11B	120.1 (7)	C10C—C9C—H9C	119.6
N1C—C2C—C3C	122.9 (8)	C8D—C9D—C10D	119.3 (8)
N1C—C2C—C11C	114.6 (7)	C8D—C9D—H9D	120.4
C3C—C2C—C11C	122.4 (7)	C10D—C9D—H9D	120.3
N1D—C2D—C3D	123.6 (8)	N1A—C10A—C5A	119.5 (7)
N1D—C2D—C11D	114.2 (6)	N1A—C10A—C9A	120.7 (7)
C3D—C2D—C11D	122.2 (7)	C5A—C10A—C9A	119.7 (6)
O1E—C2E—C1E	127 (1)	N1B—C10B—C5B	121.5 (7)
O1E—C2E—H2E2	110.4	N1B—C10B—C9B	118.9 (7)
O1E—C2E—H2E1	108.1	C5B—C10B—C9B	119.6 (7)
C1E—C2E—H2E2	102.3	N1C—C10C—C5C	119.7 (7)
C1E—C2E—H2E1	100.0	N1C—C10C—C9C	120.4 (7)
H2E2—C2E—H2E1	106.3	C5C—C10C—C9C	119.8 (7)
C2A—C3A—C4A	118.9 (8)	N1D—C10D—C5D	119.5 (7)
C2A—C3A—H3A	120.2	N1D—C10D—C9D	120.0 (7)
C4A—C3A—H3A	120.9	C5D—C10D—C9D	120.5 (9)
C2B—C3B—C4B	118.1 (8)	O1A—C11A—O2A	125.4 (7)
C2B—C3B—H3B	120.6	O1A—C11A—C2A	119.1 (8)
C4B—C3B—H3B	121.3	O2A—C11A—C2A	115.5 (7)
C2C—C3C—C4C	118.7 (7)	O1B—C11B—O2B	124.9 (8)
C2C—C3C—H3C	121.1	O1B—C11B—C2B	121.0 (9)
C4C—C3C—H3C	120.2	O2B—C11B—C2B	114.0 (7)
C2D—C3D—C4D	117.8 (8)	O1C—C11C—O2C	125.8 (8)
C2D—C3D—H3D	121.2	O1C—C11C—C2C	119.4 (7)
C4D—C3D—H3D	121.0	O2C—C11C—C2C	114.8 (7)
C3A—C4A—C5A	120.3 (8)	O1D—C11D—O2D	124.3 (8)
C3A—C4A—H4A	119.5	O1D—C11D—C2D	119.0 (7)
C5A—C4A—H4A	120.2	O2D—C11D—C2D	116.7 (6)
C3B—C4B—C5B	119.7 (7)
V1A—O2A—C11A—O1A	178.1 (6)	C2B—N1B—C10B—C9B	173.7 (7)
V1A—O2A—C11A—C2A	−2.0 (8)	C2B—C3B—C4B—C5B	−2 (1)
V1A—O2B—C11B—O1B	173.8 (7)	C2B—C3B—C4B—H4B	177.5
V1A—O2B—C11B—C2B	−9.4 (10)	C2C—N1C—C10C—C5C	1 (1)
V1A—N1A—C2A—C3A	173.3 (6)	C2C—N1C—C10C—C9C	−175.1 (7)
V1A—N1A—C2A—C11A	−1.7 (7)	C2C—C3C—C4C—C5C	1 (1)
V1A—N1A—C10A—C5A	−170.3 (5)	C2C—C3C—C4C—H4C	−177.9
V1A—N1A—C10A—C9A	9 (1)	C2D—N1D—C10D—C5D	3 (1)
V1A—N1B—C2B—C3B	−176.4 (7)	C2D—N1D—C10D—C9D	−176.1 (7)
V1A—N1B—C2B—C11B	10.6 (8)	C2D—C3D—C4D—C5D	1 (1)
V1A—N1B—C10B—C5B	177.2 (6)	C2D—C3D—C4D—H4D	−177.7
V1A—N1B—C10B—C9B	−5 (1)	C3A—C2A—N1A—C10A	2 (1)
V1B—O2C—C11C—O1C	−172.4 (6)	C3A—C4A—C5A—C6A	−177.8 (8)
V1B—O2C—C11C—C2C	9.2 (8)	C3A—C4A—C5A—C10A	1 (1)
V1B—O2D—C11D—O1D	−168.4 (6)	C3B—C2B—N1B—C10B	4 (1)
V1B—O2D—C11D—C2D	11.1 (9)	C3B—C4B—C5B—C6B	−174.8 (8)
V1B—N1C—C2C—C3C	−177.9 (6)	C3B—C4B—C5B—C10B	2 (1)
V1B—N1C—C2C—C11C	−1.0 (7)	C3C—C2C—N1C—C10C	−2 (1)
V1B—N1C—C10C—C5C	175.2 (5)	C3C—C4C—C5C—C6C	177.4 (8)
V1B—N1C—C10C—C9C	−1.1 (10)	C3C—C4C—C5C—C10C	−3 (1)
V1B—N1D—C2D—C3D	176.9 (7)	C3D—C2D—N1D—C10D	−3 (1)
V1B—N1D—C2D—C11D	−6.1 (8)	C3D—C4D—C5D—C6D	178.6 (10)
V1B—N1D—C10D—C5D	−177.7 (6)	C3D—C4D—C5D—C10D	−1 (1)
V1B—N1D—C10D—C9D	3 (1)	C4A—C3A—C2A—C11A	173.2 (7)
O1A—C11A—C2A—N1A	−177.7 (7)	C4A—C5A—C6A—C7A	179.9 (8)
O1A—C11A—C2A—C3A	7 (1)	C4A—C5A—C6A—H6A	−0.7
O1B—C11B—C2B—N1B	175.3 (8)	C4A—C5A—C10A—C9A	178.9 (8)
O1B—C11B—C2B—C3B	1 (1)	C4B—C3B—C2B—C11B	171.3 (8)
O1C—C11C—C2C—N1C	176.5 (7)	C4B—C5B—C6B—C7B	176.7 (8)
O1C—C11C—C2C—C3C	−6 (1)	C4B—C5B—C6B—H6B	−2.8
O1D—C11D—C2D—N1D	176.6 (7)	C4B—C5B—C10B—C9B	−177.0 (7)
O1D—C11D—C2D—C3D	−6 (1)	C4C—C3C—C2C—C11C	−175.3 (7)
O1E—C2E—C1E—H1E1	−64.9	C4C—C5C—C6C—C7C	180.0 (8)
O1E—C2E—C1E—H1E2	56.0	C4C—C5C—C6C—H6C	0.5
O1E—C2E—C1E—H1E3	176.6	C4C—C5C—C10C—C9C	178.2 (8)
O1VB—V1B—O2C—C11C	−98.9 (5)	C4D—C3D—C2D—C11D	−175.3 (8)
O1VB—V1B—O2D—C11D	−103.0 (6)	C4D—C5D—C6D—C7D	−179.0 (10)
O1VB—V1B—N1C—C2C	108.1 (5)	C4D—C5D—C6D—H6D	2.4
O1VB—V1B—N1C—C10C	−66.2 (6)	C4D—C5D—C10D—C9D	178.8 (8)
O1VB—V1B—N1D—C2D	108.8 (5)	C5A—C4A—C3A—H3A	179.1
O1VB—V1B—N1D—C10D	−70.4 (7)	C5A—C6A—C7A—C8A	0 (1)
O1VA—V1A—O2A—C11A	91.5 (6)	C5A—C6A—C7A—H7A	−179.0
O1VA—V1A—O2B—C11B	104.1 (6)	C5A—C10A—C9A—C8A	1 (1)
O1VA—V1A—N1A—C2A	−102.6 (5)	C5A—C10A—C9A—H9A	−178.3
O1VA—V1A—N1A—C10A	67.5 (6)	C5B—C4B—C3B—H3B	177.9
O1VA—V1A—N1B—C2B	−113.3 (5)	C5B—C6B—C7B—C8B	0 (1)
O1VA—V1A—N1B—C10B	65.9 (7)	C5B—C6B—C7B—H7B	−179.5
O2A—V1A—O2B—C11B	−71.5 (9)	C5B—C10B—C9B—C8B	0 (1)
O2A—V1A—O2VA—H1W	34.9	C5B—C10B—C9B—H9B	179.1
O2A—V1A—O2VA—H2W	−167.7	C5C—C4C—C3C—H3C	−177.7
O2A—V1A—N1A—C2A	0.6 (5)	C5C—C6C—C7C—C8C	1 (1)
O2A—V1A—N1A—C10A	170.7 (6)	C5C—C6C—C7C—H7C	−179.1
O2A—V1A—N1B—C2B	142.2 (5)	C5C—C10C—C9C—C8C	2 (1)
O2A—V1A—N1B—C10B	−38.6 (7)	C5C—C10C—C9C—H9C	−177.9
O2A—C11A—C2A—N1A	2.4 (9)	C5D—C4D—C3D—H3D	−178.8
O2A—C11A—C2A—C3A	−172.7 (7)	C5D—C6D—C7D—C8D	0 (1)
O2B—V1A—O2A—C11A	−92.9 (7)	C5D—C6D—C7D—H7D	−180.0
O2B—V1A—O2VA—H1W	−148.0	C5D—C10D—C9D—C8D	0 (1)
O2B—V1A—O2VA—H2W	9.4	C5D—C10D—C9D—H9D	−179.5
O2B—V1A—N1A—C2A	154.0 (5)	C6A—C5A—C4A—H4A	2.7
O2B—V1A—N1A—C10A	−35.9 (6)	C6A—C5A—C10A—C9A	−1 (1)
O2B—V1A—N1B—C2B	−11.8 (5)	C6A—C7A—C8A—C9A	0 (1)
O2B—V1A—N1B—C10B	167.4 (7)	C6A—C7A—C8A—H8A	178.8
O2B—C11B—C2B—N1B	−1 (1)	C6B—C5B—C4B—H4B	5.6
O2B—C11B—C2B—C3B	−175.0 (8)	C6B—C5B—C10B—C9B	0 (1)
O2C—V1B—O2D—C11D	68.2 (9)	C6B—C7B—C8B—C9B	0 (1)
O2C—V1B—O2VB—H3W	12.0	C6B—C7B—C8B—H8B	−179.6
O2C—V1B—O2VB—H4W	131.4	C6C—C5C—C4C—H4C	−2.8
O2C—V1B—N1C—C2C	4.2 (5)	C6C—C5C—C10C—C9C	−2 (1)
O2C—V1B—N1C—C10C	−170.1 (6)	C6C—C7C—C8C—C9C	−1 (1)
O2C—V1B—N1D—C2D	−146.3 (5)	C6C—C7C—C8C—H8C	179.8
O2C—V1B—N1D—C10D	34.5 (7)	C6D—C5D—C4D—H4D	−2.2
O2C—C11C—C2C—N1C	−5.0 (9)	C6D—C5D—C10D—C9D	−1 (1)
O2C—C11C—C2C—C3C	171.9 (7)	C6D—C7D—C8D—C9D	0 (1)
O2D—V1B—O2C—C11C	90.1 (7)	C6D—C7D—C8D—H8D	179.2
O2D—V1B—O2VB—H3W	−164.0	C7A—C6A—C5A—C10A	0 (1)
O2D—V1B—O2VB—H4W	−44.7	C7A—C8A—C9A—C10A	0 (1)
O2D—V1B—N1C—C2C	−150.2 (5)	C7A—C8A—C9A—H9A	179.2
O2D—V1B—N1C—C10C	35.5 (6)	C7B—C6B—C5B—C10B	0 (1)
O2D—V1B—N1D—C2D	9.0 (5)	C7B—C8B—C9B—C10B	0 (1)
O2D—V1B—N1D—C10D	−170.3 (7)	C7B—C8B—C9B—H9B	−179.6
O2D—C11D—C2D—N1D	−2 (1)	C7C—C6C—C5C—C10C	0 (1)
O2D—C11D—C2D—C3D	174.3 (8)	C7C—C8C—C9C—C10C	0 (1)
O2VA—V1A—O2A—C11A	−86.3 (5)	C7C—C8C—C9C—H9C	179.7
O2VA—V1A—O2B—C11B	−78.2 (6)	C7D—C6D—C5D—C10D	1 (1)
O2VA—V1A—N1A—C2A	79.5 (5)	C7D—C8D—C9D—C10D	0 (1)
O2VA—V1A—N1A—C10A	−110.4 (6)	C7D—C8D—C9D—H9D	−179.2
O2VA—V1A—N1B—C2B	64.6 (5)	C8A—C7A—C6A—H6A	−178.6
O2VA—V1A—N1B—C10B	−116.2 (6)	C8B—C7B—C6B—H6B	179.7
O2VB—V1B—O2C—C11C	81.0 (5)	C8C—C7C—C6C—H6C	−179.5
O2VB—V1B—O2D—C11D	77.4 (5)	C8D—C7D—C6D—H6D	178.3
O2VB—V1B—N1C—C2C	−75.5 (5)	C9A—C8A—C7A—H7A	179.3
O2VB—V1B—N1C—C10C	110.2 (6)	C9B—C8B—C7B—H7B	−179.9
O2VB—V1B—N1D—C2D	−67.6 (5)	C9C—C8C—C7C—H7C	179.0
O2VB—V1B—N1D—C10D	113.2 (7)	C9D—C8D—C7D—H7D	178.7
N1A—V1A—O2A—C11A	0.8 (5)	C10A—N1A—C2A—C11A	−172.9 (6)
N1A—V1A—O2B—C11B	−159.6 (6)	C10A—C5A—C4A—H4A	−177.6
N1A—V1A—O2VA—H1W	−44.1	C10A—C5A—C6A—H6A	179.6
N1A—V1A—O2VA—H2W	113.3	C10A—C9A—C8A—H8A	180.0
N1A—C2A—C3A—C4A	−1 (1)	C10B—N1B—C2B—C11B	−168.8 (7)
N1A—C2A—C3A—H3A	178.8	C10B—C5B—C4B—H4B	−177.0
N1A—C10A—C5A—C4A	−1 (1)	C10B—C5B—C6B—H6B	179.8
N1A—C10A—C5A—C6A	178.5 (7)	C10B—C9B—C8B—H8B	179.4
N1A—C10A—C9A—C8A	−178.2 (8)	C10C—N1C—C2C—C11C	174.0 (6)
N1A—C10A—C9A—H9A	1.8	C10C—C5C—C4C—H4C	176.4
N1B—V1A—O2A—C11A	−171.5 (5)	C10C—C5C—C6C—H6C	−178.7
N1B—V1A—O2B—C11B	11.6 (6)	C10C—C9C—C8C—H8C	178.4
N1B—V1A—O2VA—H1W	133.5	C10D—N1D—C2D—C11D	173.2 (7)
N1B—V1A—O2VA—H2W	−69.1	C10D—C5D—C4D—H4D	177.2
N1B—C2B—C3B—C4B	−1 (1)	C10D—C5D—C6D—H6D	−177.0
N1B—C2B—C3B—H3B	178.6	C10D—C9D—C8D—H8D	−179.3
N1B—C10B—C5B—C4B	0 (1)	C11A—C2A—C3A—H3A	−6.5
N1B—C10B—C5B—C6B	177.8 (7)	C11B—C2B—C3B—H3B	−8.7
N1B—C10B—C9B—C8B	−177.2 (7)	C11C—C2C—C3C—H3C	4.4
N1B—C10B—C9B—H9B	1.7	C11D—C2D—C3D—H3D	4.9
N1C—V1B—O2C—C11C	−7.6 (5)	H1E—O1E—C2E—H2E2	−61.9
N1C—V1B—O2D—C11D	160.3 (5)	H1E—O1E—C2E—H2E1	−177.9
N1C—V1B—O2VB—H3W	91.2	H1E1—C1E—C2E—H2E2	64.49
N1C—V1B—O2VB—H4W	−149.5	H1E1—C1E—C2E—H2E1	172.7
N1C—C2C—C3C—C4C	1 (1)	H1E2—C1E—C2E—H2E2	−175.7
N1C—C2C—C3C—H3C	−179.0	H1E2—C1E—C2E—H2E1	−66.4
N1C—C10C—C5C—C4C	1 (1)	H1E3—C1E—C2E—H2E2	−55.0
N1C—C10C—C5C—C6C	−178.9 (7)	H1E3—C1E—C2E—H2E1	54.3
N1C—C10C—C9C—C8C	178.9 (7)	H3A—C3A—C4A—H4A	−1.4
N1C—C10C—C9C—H9C	−1.6	H3B—C3B—C4B—H4B	−2.5
N1D—V1B—O2C—C11C	165.6 (5)	H3C—C3C—C4C—H4C	2.4
N1D—V1B—O2D—C11D	−11.0 (5)	H3D—C3D—C4D—H4D	2.1
N1D—V1B—O2VB—H3W	−84.4	H6A—C6A—C7A—H7A	1.6
N1D—V1B—O2VB—H4W	34.9	H6B—C6B—C7B—H7B	0.1
N1D—C2D—C3D—C4D	1 (1)	H6C—C6C—C7C—H7C	0.4
N1D—C2D—C3D—H3D	−178.3	H6D—C6D—C7D—H7D	−1.3
N1D—C10D—C5D—C4D	0 (1)	H7A—C7A—C8A—H8A	−1.4
N1D—C10D—C5D—C6D	179.0 (8)	H7B—C7B—C8B—H8B	0.1
N1D—C10D—C9D—C8D	179.8 (8)	H7C—C7C—C8C—H8C	−0.1
N1D—C10D—C9D—H9D	−0.3	H7D—C7D—C8D—H8D	−1.2
C1E—C2E—O1E—H1E	63.2	H8A—C8A—C9A—H9A	0.0
C2A—N1A—C10A—C5A	0 (1)	H8B—C8B—C9B—H9B	0.5
C2A—N1A—C10A—C9A	179.2 (7)	H8C—C8C—C9C—H9C	−1.2
C2A—C3A—C4A—C5A	0 (1)	H8D—C8D—C9D—H9D	0.7
C2A—C3A—C4A—H4A	178.8	H8D—C8D—C9D—H9D	0.7
C2B—N1B—C10B—C5B	−3 (1)

Symmetry codes: (i) −x+1, −y+1, −z+1; (ii) −x+2, −y+1, −z+1; (iii) −x+1, −y, −z+1; (iv) x−1, y−1, z; (v) −x+3, −y+2, −z+2; (vi) x+1, y, z; (vii) −x+2, −y+2, −z+2; (viii) −x+1, −y+1, −z+2; (ix) x−1, y, z; (x) x+1, y+1, z; (xi) −x, −y, −z+1; (xii) −x+2, −y+1, −z+2.