Structural changes of hexamethylenetetramine and undecanedioic acid co-crystal (HMT-C11) as a function of the temperature

HMT-C11 belongs to the family of adducts formed by the co-crystallization of N₄(CH₂)₆ molecules (hexamethylenetetramine or HMT) and aliphatic dicarboxylic acids HOOC(CH₂)_{n − 2}COOH with 5 ≤ n ≤ 13 (Cn). The adducts exhibit a layered structure in which the packing between HMT and Cn is determined by strong hydrogen bonds. The compounds in this family studied so far present thermotropic structural phase transitions and, depending on the chain length, disordered, twinned and modulated phases. The structure refinement of HMT-C11 based on X-ray diffraction experiments indicates three distinct phases from the melting point down to liquid nitrogen temperature: phase I is not crystalline; phase II is disordered (stacking fault) and its average structure is described in space group Bmmb; phase III is partially disordered and its symmetry is P2₁/c. The systematic study of the structure evolution of phase III upon cooling revealed that the disorder has a dynamic character (anharmonicity). The main structural change observed from 293 K down to 93 K is the increase of the tilting angle of the C11 chains relative to the layer plane and the rotation of the HMT molecules. Both HMT and C11 behave like rigid bodies in the temperature range investigated. The quality of the refinements leads to a conclusive model for the O—H...N hydrogen bonds linking HMT and C11.

Computing details

For all compounds, data collection: kM4 - Oxford Diffraction; cell refinement: kM4 - Oxford Diffraction; data reduction: XPREP. Program(s) used to solve structure: SHELXS97 for (93K), 123K, 153K, 183K, 213K, 243K, 273K, 293K; SHELXS97 (Sheldrick, 1990) for 324K. Program(s) used to refine structure: (Jana2000; Petricek and Dusek, 2000) for (93K), 123K, 153K, 183K, 213K, 243K, 273K, 293K; SHELXL97 (Sheldrick, 1997) for 324K. For all compounds, molecular graphics: XP. Software used to prepare material for publication: (Jana2000; Petricek and Dusek, 2000) for (93K), 123K, 153K, 183K, 213K, 243K, 273K, 293K.

(93K)

Crystal data

C17H32N4O4	F(000) = 1552
Mr = 356.5	Dx = 1.269 (1) Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71069 Å
a = 5.8933 (3) Å	Cell parameters from 35600 reflections
b = 27.6701 (19) Å	θ = 1.9–24.7°
c = 23.4703 (12) Å	µ = 0.09 mm^−1
β = 102.916 (6)°	T = 93 K
V = 3730.4 (4) Å^3	Platelets, transparent
Z = 8	0.30 × 0.23 × 0.20 mm

Data collection

Stoe-IPDS diffractometer	5577 reflections with I > 2σ(I)
Radiation source: Sealed tube	Rint = 0.064
Graphite monochromator	θmax = 24.7°, θmin = 1.9°
Oscillation scans	h = −6→6
35600 measured reflections	k = −32→32
6806 independent reflections	l = −27→27

Refinement

Refinement on F^2	H atoms treated by a mixture of independent and constrained refinement
R[F^2 > 2σ(F^2)] = 0.033	Weighting scheme based on measured s.u.'s w = 1/(σ^2(I) + 0.0016I^2)
wR(F^2) = 0.082	(Δ/σ)max = 0.002
S = 1.22	Δρmax = 0.22 e Å^−3
6806 reflections	Δρmin = −0.21 e Å^−3
439 parameters

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

	x	y	z	Uiso*/Ueq	Occ. (<1)
O1a	2.0026 (4)	0.35386 (7)	1.07308 (8)	0.0193 (3)
Ho1a	2.037 (3)	0.3261 (6)	1.0994 (6)	0.027117 (2)*
O2a	1.6436 (4)	0.32371 (7)	1.05327 (8)	0.0241 (3)
O3a	0.2534 (4)	0.63279 (7)	0.65742 (8)	0.0230 (3)
Ho3a	0.144 (3)	0.6546 (6)	0.6480 (7)	0.032620 (2)*
O4a	0.2770 (4)	0.65858 (8)	0.74798 (8)	0.0339 (4)
C1a	1.7819 (2)	0.35418 (4)	1.04543 (5)	0.0138 (4)
C2a	1.7220 (2)	0.39468 (4)	1.00183 (5)	0.0162 (4)
H2aa	1.7495	0.3827	0.9649	0.023677 (3)*
H2ab	1.829	0.4209	1.0144	0.023677 (3)*
C3a	1.4721 (2)	0.41226 (4)	0.99113 (5)	0.0169 (4)
H3ab	1.4451	0.4272	1.0279	0.024806 (3)*
H3aa	1.3634	0.3846	0.9812	0.024806 (3)*
C4a	1.4181 (2)	0.44911 (4)	0.94161 (5)	0.0173 (4)
H4ab	1.5308	0.4751	0.951	0.025467 (3)*
H4aa	1.4388	0.4335	0.9057	0.025467 (3)*
C5a	1.1755 (2)	0.47061 (4)	0.93080 (5)	0.0162 (4)
H5ab	1.157	0.4874	0.9663	0.023602 (3)*
H5aa	1.058	0.444	0.9225	0.023602 (3)*
C6a	1.1274 (2)	0.50528 (4)	0.87909 (5)	0.0175 (4)
H6ab	1.2453	0.5313	0.8868	0.025388 (3)*
H6aa	1.1476	0.4882	0.8448	0.025388 (3)*
C7a	0.8861 (2)	0.52773 (4)	0.86512 (5)	0.0168 (4)
H7ab	0.8704	0.5496	0.8966	0.024349 (3)*
H7aa	0.7688	0.5022	0.8626	0.024349 (3)*
C8a	0.8390 (2)	0.55576 (4)	0.80760 (5)	0.0179 (4)
H8ab	0.9622	0.5801	0.8096	0.026088 (3)*
H8aa	0.8487	0.5334	0.7756	0.026088 (3)*
C9a	0.6043 (2)	0.58113 (4)	0.79234 (5)	0.0173 (4)
H9ab	0.4823	0.5583	0.7971	0.025260 (3)*
H9aa	0.6034	0.6082	0.8195	0.025260 (3)*
Caa	0.5529 (2)	0.60000 (4)	0.72976 (5)	0.0162 (4)
Haab	0.69	0.6182	0.7238	0.023632 (3)*
Haaa	0.53	0.573	0.7025	0.023632 (3)*
Cba	0.3464 (2)	0.63331 (4)	0.71355 (5)	0.0155 (4)
O1b	2.0106 (4)	0.36788 (7)	0.83617 (8)	0.0199 (3)
Ho1b	2.035 (3)	0.3446 (6)	0.8650 (7)	0.029705 (2)*
O2b	1.6467 (4)	0.36040 (8)	0.84707 (8)	0.0268 (3)
O3b	0.2544 (4)	0.61866 (7)	0.38589 (8)	0.0201 (3)
Ho3b	0.129 (3)	0.6395 (6)	0.3742 (6)	0.030073 (2)*
O4b	0.1673 (4)	0.62288 (7)	0.47308 (8)	0.0263 (3)
C1b	1.7854 (2)	0.37798 (4)	0.82231 (5)	0.0135 (4)
C2b	1.7234 (2)	0.41217 (4)	0.77117 (5)	0.0158 (4)
H2ba	1.741	0.3939	0.7368	0.023689 (3)*
H2bb	1.8373	0.4384	0.7768	0.023689 (3)*
C3b	1.4788 (2)	0.43295 (4)	0.76017 (5)	0.0152 (4)
H3bb	1.4689	0.4554	0.7916	0.022628 (3)*
H3ba	1.3658	0.4065	0.761	0.022628 (3)*
C4b	1.4150 (2)	0.45941 (4)	0.70167 (5)	0.0156 (4)
H4bb	1.5333	0.4848	0.7011	0.023387 (3)*
H4ba	1.4236	0.4365	0.6701	0.023387 (3)*
C5b	1.1742 (2)	0.48236 (4)	0.68803 (5)	0.0177 (4)
H5bb	1.1693	0.5083	0.7167	0.026368 (3)*
H5ba	1.0561	0.4575	0.6924	0.026368 (3)*
C6b	1.1081 (2)	0.50317 (4)	0.62625 (5)	0.0174 (4)
H6bb	1.2279	0.5262	0.6214	0.025967 (3)*
H6ba	1.1081	0.4771	0.5982	0.025967 (3)*
C7b	0.8724 (2)	0.52811 (4)	0.61100 (5)	0.0171 (4)
H7bb	0.8762	0.5566	0.6372	0.025174 (3)*
H7ba	0.7513	0.5058	0.6187	0.025174 (3)*
C8b	0.8072 (2)	0.54413 (4)	0.54716 (5)	0.0166 (4)
H8bb	0.9255	0.5671	0.5403	0.024651 (3)*
H8ba	0.812	0.5159	0.5223	0.024651 (3)*
C9b	0.5672 (2)	0.56691 (4)	0.52817 (5)	0.0159 (4)
H9bb	0.4481	0.5435	0.5353	0.023472 (3)*
H9ba	0.5598	0.5959	0.5525	0.023472 (3)*
Cab	0.5151 (2)	0.58144 (4)	0.46400 (5)	0.0163 (4)
Habb	0.6403	0.6009	0.457	0.024339 (3)*
Haba	0.5076	0.5523	0.4396	0.024339 (3)*
Cbb	0.2934 (2)	0.60935 (4)	0.44245 (5)	0.0139 (4)
O1am	2.0075	0.3547	1.0736	0.038*	0
O2am	1.6452	0.3228	1.0534	0.038*	0
O3am	0.2476	0.6338	0.6564	0.038*	0
O4am	0.2886	0.66	0.7488	0.038*	0
O1bm	2.0138	0.3674	0.8372	0.038*	0
O2bm	1.6489	0.3608	0.8483	0.038*	0
O3bm	0.25	0.6195	0.3844	0.038*	0
O4bm	0.1624	0.6234	0.474	0.038*	0
N1a	−0.12224 (13)	0.78765 (2)	0.59715 (3)	0.0138 (2)
N2a	−0.2004 (2)	0.73041 (4)	0.51539 (5)	0.0141 (2)
N3a	−0.0576 (2)	0.70098 (4)	0.61539 (5)	0.0141 (2)
N4a	−0.4533 (2)	0.73238 (4)	0.58518 (5)	0.0147 (2)
Cca	0.0251 (2)	0.75058 (4)	0.63324 (5)	0.0146 (3)
Hcba	0.18674 (13)	0.75425 (2)	0.62871 (3)	0.0187 (4)
Hcaa	0.01898 (13)	0.75494 (2)	0.67467 (3)	0.0176 (4)
Cda	−0.3644 (2)	0.78109 (4)	0.60313 (5)	0.0145 (2)
Hdaa	−0.36980 (13)	0.78629 (2)	0.64411 (3)	0.0176 (4)
Hdba	−0.46288 (13)	0.80503 (2)	0.57819 (3)	0.0181 (4)
Cea	−0.1157 (2)	0.77906 (4)	0.53505 (5)	0.0150 (2)
Heaa	−0.21997 (13)	0.80293 (2)	0.51047 (3)	0.0185 (4)
Heba	0.04263 (13)	0.78250 (2)	0.53086 (3)	0.0190 (4)
Cfa	−0.0537 (2)	0.69475 (4)	0.55259 (5)	0.0148 (3)
Hfaa	0.10688 (13)	0.69885 (2)	0.54833 (3)	0.0185 (4)
Hfba	−0.11300 (13)	0.66213 (2)	0.54021 (3)	0.0183 (5)
Cga	−0.3006 (2)	0.69690 (4)	0.62150 (5)	0.0154 (3)
Hgaa	−0.35882 (13)	0.66381 (2)	0.60939 (3)	0.0197 (5)
Hgba	−0.30178 (13)	0.70249 (2)	0.66303 (3)	0.0187 (4)
Cha	−0.4389 (2)	0.72525 (4)	0.52378 (5)	0.0153 (2)
Hhba	−0.49445 (13)	0.69252 (2)	0.51105 (3)	0.0192 (4)
Hhaa	−0.53889 (13)	0.74915 (2)	0.49937 (3)	0.0189 (4)
N1b	−0.12658 (13)	0.77430 (2)	0.36177 (3)	0.0136 (2)
N2b	−0.2019 (2)	0.73932 (4)	0.26338 (5)	0.0155 (2)
N3b	−0.0657 (2)	0.68771 (4)	0.34897 (5)	0.0137 (2)
N4b	−0.4599 (2)	0.72062 (4)	0.32902 (5)	0.0146 (2)
Ccb	0.0178 (2)	0.73155 (4)	0.38389 (5)	0.0136 (3)
Hcbb	0.18035 (13)	0.73811 (2)	0.38181 (3)	0.0168 (4)
Hcab	0.00923 (13)	0.72520 (2)	0.42480 (3)	0.0173 (4)
Cdb	−0.3701 (2)	0.76367 (4)	0.36376 (5)	0.0145 (2)
Hdab	−0.37790 (13)	0.75824 (2)	0.40454 (3)	0.0181 (4)
Hdbb	−0.46659 (13)	0.79164 (2)	0.34790 (3)	0.0181 (4)
Ceb	−0.1165 (2)	0.78182 (4)	0.29970 (5)	0.0162 (2)
Heab	−0.21878 (13)	0.80957 (2)	0.28413 (3)	0.0210 (4)
Hebb	0.04274 (13)	0.78803 (2)	0.29784 (3)	0.0204 (4)
Cfb	−0.0582 (2)	0.69763 (4)	0.28705 (5)	0.0152 (3)
Hfab	0.10331 (13)	0.70451 (2)	0.28537 (3)	0.0184 (4)
Hfbb	−0.11804 (13)	0.66890 (2)	0.26345 (3)	0.0194 (5)
Cgb	−0.3101 (2)	0.67941 (4)	0.35195 (5)	0.0160 (3)
Hgab	−0.36888 (13)	0.65017 (2)	0.32844 (3)	0.0209 (5)
Hgbb	−0.31365 (13)	0.67426 (2)	0.39342 (3)	0.0203 (4)
Chb	−0.4419 (2)	0.72946 (5)	0.26818 (5)	0.0160 (2)
Hhbb	−0.49794 (13)	0.70075 (2)	0.24423 (3)	0.0203 (4)
Hhab	−0.53989 (13)	0.75725 (2)	0.25280 (3)	0.0199 (4)

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
O1a	0.0156 (5)	0.0135 (4)	0.0256 (4)	0.0001 (3)	−0.0018 (3)	0.0068 (3)
O2a	0.0180 (5)	0.0183 (4)	0.0332 (5)	−0.0035 (4)	−0.0006 (4)	0.0099 (4)
O3a	0.0270 (6)	0.0210 (5)	0.0179 (4)	0.0128 (4)	−0.0013 (3)	0.0014 (3)
O4a	0.0387 (7)	0.0375 (6)	0.0234 (5)	0.0252 (5)	0.0022 (4)	−0.0046 (4)
C1a	0.0145 (8)	0.0108 (6)	0.0159 (5)	0.0002 (5)	0.0029 (5)	−0.0022 (4)
C2a	0.0168 (7)	0.0131 (5)	0.0179 (5)	0.0003 (4)	0.0022 (4)	0.0028 (4)
C3a	0.0158 (7)	0.0136 (6)	0.0207 (6)	0.0023 (4)	0.0028 (5)	0.0033 (4)
C4a	0.0175 (7)	0.0151 (6)	0.0189 (6)	0.0018 (5)	0.0030 (4)	0.0026 (4)
C5a	0.0158 (7)	0.0142 (6)	0.0177 (5)	0.0020 (4)	0.0018 (4)	0.0014 (4)
C6a	0.0158 (7)	0.0169 (6)	0.0185 (5)	0.0020 (5)	0.0016 (4)	0.0023 (4)
C7a	0.0161 (7)	0.0149 (6)	0.0182 (5)	0.0017 (4)	0.0014 (4)	0.0017 (4)
C8a	0.0166 (7)	0.0172 (6)	0.0190 (5)	0.0032 (5)	0.0019 (4)	0.0028 (4)
C9a	0.0174 (7)	0.0143 (5)	0.0193 (6)	0.0031 (4)	0.0022 (5)	0.0019 (4)
Caa	0.0171 (7)	0.0125 (5)	0.0182 (5)	0.0037 (4)	0.0019 (4)	−0.0007 (4)
Cba	0.0163 (7)	0.0119 (6)	0.0176 (6)	0.0000 (5)	0.0021 (5)	0.0009 (5)
O1b	0.0172 (6)	0.0178 (4)	0.0250 (4)	0.0041 (3)	0.0054 (3)	0.0086 (3)
O2b	0.0194 (6)	0.0296 (5)	0.0328 (5)	0.0014 (4)	0.0092 (4)	0.0155 (4)
O3b	0.0211 (5)	0.0219 (4)	0.0177 (4)	0.0098 (4)	0.0051 (3)	0.0038 (3)
O4b	0.0249 (6)	0.0336 (5)	0.0223 (4)	0.0125 (4)	0.0094 (4)	0.0023 (4)
C1b	0.0154 (8)	0.0090 (5)	0.0158 (5)	−0.0007 (5)	0.0030 (5)	−0.0023 (4)
C2b	0.0179 (7)	0.0137 (5)	0.0163 (5)	0.0001 (4)	0.0046 (4)	0.0017 (4)
C3b	0.0167 (7)	0.0133 (5)	0.0157 (5)	0.0003 (4)	0.0040 (4)	0.0006 (4)
C4b	0.0173 (7)	0.0129 (5)	0.0171 (5)	0.0012 (4)	0.0045 (4)	0.0012 (4)
C5b	0.0165 (7)	0.0189 (6)	0.0179 (5)	0.0014 (5)	0.0042 (4)	0.0019 (4)
C6b	0.0162 (7)	0.0185 (6)	0.0178 (6)	0.0014 (5)	0.0043 (4)	0.0014 (4)
C7b	0.0167 (7)	0.0166 (6)	0.0175 (5)	0.0009 (5)	0.0031 (4)	0.0008 (4)
C8b	0.0172 (7)	0.0150 (6)	0.0176 (5)	0.0005 (4)	0.0041 (4)	0.0013 (4)
C9b	0.0168 (7)	0.0135 (6)	0.0171 (5)	−0.0004 (4)	0.0030 (4)	−0.0001 (4)
Cab	0.0163 (7)	0.0145 (6)	0.0184 (5)	0.0018 (4)	0.0047 (4)	0.0006 (4)
Cbb	0.0165 (7)	0.0096 (5)	0.0160 (6)	−0.0026 (4)	0.0045 (5)	−0.0013 (4)
N1a	0.0134 (4)	0.0116 (3)	0.0161 (4)	−0.0016 (2)	0.0028 (2)	−0.0013 (2)
N2a	0.0147 (4)	0.0145 (4)	0.0128 (2)	0.0012 (3)	0.00291 (19)	−0.0007 (2)
N3a	0.0142 (4)	0.0132 (4)	0.0144 (4)	0.0023 (3)	0.0022 (2)	0.0007 (3)
N4a	0.0107 (3)	0.0154 (4)	0.0184 (4)	−0.0012 (2)	0.0040 (2)	−0.0015 (3)
Cca	0.0117 (3)	0.0162 (6)	0.0148 (3)	−0.0004 (3)	0.0007 (2)	−0.0015 (3)
Hcba	0.0109 (3)	0.0231 (10)	0.0207 (6)	−0.0014 (4)	0.0003 (3)	−0.0021 (6)
Hcaa	0.0171 (7)	0.0199 (10)	0.0142 (3)	0.0000 (6)	−0.0002 (3)	−0.0025 (3)
Cda	0.0132 (5)	0.0135 (3)	0.0172 (4)	0.0018 (3)	0.0040 (3)	−0.0019 (3)
Hdaa	0.0179 (8)	0.0175 (6)	0.0187 (5)	0.0024 (5)	0.0068 (5)	−0.0037 (4)
Hdba	0.0165 (6)	0.0155 (4)	0.0218 (8)	0.0052 (4)	0.0035 (5)	−0.0014 (4)
Cea	0.0157 (5)	0.0140 (3)	0.0160 (4)	−0.0010 (3)	0.0048 (3)	0.0016 (3)
Heaa	0.0228 (9)	0.0149 (4)	0.0180 (5)	0.0008 (4)	0.0047 (4)	0.0039 (4)
Heba	0.0180 (6)	0.0199 (5)	0.0211 (6)	−0.0034 (4)	0.0085 (5)	0.0021 (5)
Cfa	0.0149 (5)	0.0142 (3)	0.0155 (5)	0.0032 (3)	0.0038 (3)	−0.0012 (3)
Hfaa	0.0153 (5)	0.0213 (6)	0.0198 (8)	0.0054 (4)	0.0062 (5)	−0.0012 (5)
Hfba	0.0222 (9)	0.0136 (3)	0.0189 (8)	0.0038 (3)	0.0043 (6)	−0.0029 (4)
Cga	0.0167 (6)	0.0133 (3)	0.0170 (4)	−0.0018 (3)	0.0056 (3)	0.0009 (3)
Hgaa	0.0232 (9)	0.0137 (3)	0.0233 (8)	−0.0045 (4)	0.0074 (6)	0.0011 (4)
Hgba	0.0224 (9)	0.0182 (7)	0.0175 (4)	−0.0014 (5)	0.0085 (4)	0.0022 (4)
Cha	0.0124 (3)	0.0156 (5)	0.0163 (3)	−0.0004 (3)	0.0000 (2)	−0.0023 (3)
Hhba	0.0166 (6)	0.0182 (7)	0.0206 (6)	−0.0034 (5)	−0.0007 (4)	−0.0050 (5)
Hhaa	0.0145 (4)	0.0208 (9)	0.0184 (4)	0.0023 (4)	−0.0025 (3)	−0.0016 (5)
N1b	0.0125 (4)	0.0121 (3)	0.0156 (4)	−0.0013 (2)	0.0018 (2)	−0.0020 (2)
N2b	0.0152 (4)	0.0190 (4)	0.0125 (2)	−0.0004 (3)	0.0032 (2)	0.0003 (2)
N3b	0.0126 (4)	0.0122 (4)	0.0164 (4)	0.0005 (3)	0.0030 (2)	0.0000 (3)
N4b	0.0101 (3)	0.0161 (4)	0.0179 (4)	−0.0019 (2)	0.0035 (2)	−0.0020 (3)
Ccb	0.0111 (4)	0.0153 (6)	0.0137 (3)	0.0000 (3)	0.0011 (2)	−0.0010 (3)
Hcbb	0.0104 (3)	0.0199 (10)	0.0188 (7)	−0.0009 (3)	0.0005 (3)	−0.0029 (6)
Hcab	0.0161 (7)	0.0215 (9)	0.0130 (3)	0.0023 (6)	0.0007 (3)	0.0000 (4)
Cdb	0.0120 (5)	0.0158 (3)	0.0157 (4)	0.0011 (3)	0.0032 (3)	−0.0025 (3)
Hdab	0.0157 (8)	0.0233 (6)	0.0164 (5)	0.0019 (5)	0.0059 (5)	−0.0034 (4)
Hdbb	0.0149 (6)	0.0176 (5)	0.0211 (8)	0.0041 (4)	0.0021 (5)	−0.0037 (4)
Ceb	0.0166 (5)	0.0142 (3)	0.0180 (4)	−0.0025 (3)	0.0041 (3)	0.0028 (2)
Heab	0.0239 (9)	0.0151 (5)	0.0233 (5)	−0.0005 (4)	0.0038 (4)	0.0060 (4)
Hebb	0.0191 (6)	0.0190 (6)	0.0243 (6)	−0.0060 (4)	0.0075 (5)	0.0037 (4)
Cfb	0.0130 (5)	0.0174 (3)	0.0156 (5)	0.0001 (3)	0.0042 (3)	−0.0034 (3)
Hfab	0.0137 (5)	0.0241 (6)	0.0189 (7)	0.0004 (4)	0.0068 (5)	−0.0036 (5)
Hfbb	0.0174 (9)	0.0206 (3)	0.0202 (8)	0.0011 (4)	0.0040 (6)	−0.0082 (4)
Cgb	0.0148 (6)	0.0131 (4)	0.0208 (4)	−0.0029 (3)	0.0056 (3)	0.0010 (3)
Hgab	0.0190 (9)	0.0134 (4)	0.0308 (8)	−0.0054 (4)	0.0064 (6)	−0.0016 (4)
Hgbb	0.0208 (9)	0.0186 (7)	0.0234 (4)	−0.0027 (5)	0.0091 (4)	0.0056 (4)
Chb	0.0124 (3)	0.0190 (5)	0.0150 (3)	0.0001 (3)	−0.0001 (2)	−0.0028 (3)
Hhbb	0.0147 (6)	0.0244 (7)	0.0193 (6)	−0.0012 (5)	−0.0014 (4)	−0.0077 (5)
Hhab	0.0158 (4)	0.0240 (9)	0.0171 (5)	0.0036 (4)	−0.0023 (3)	−0.0010 (5)

Geometric parameters (Å, º)

O1a—Ho1a	0.977 (16)	C6b—C8b	2.5305 (15)
O1a—O2a	2.225 (3)	C6b—H8bb	2.7178 (11)
O1a—C1a	1.318 (2)	C6b—H8ba	2.6865 (10)
O1a—C2a	2.360 (2)	C7b—H5bb	2.7519 (10)
O1a—H2aa	2.7587 (18)	C7b—H5ba	2.7778 (11)
O1a—H2ab	2.3985 (19)	C7b—H6bb	2.0548 (13)
O1a—H7ab^i	2.823 (2)	C7b—H6ba	2.0487 (12)
O1a—O1am	0.037 (2)	C7b—H7bb	0.9960 (11)
O1a—O2am	2.226 (2)	C7b—H7ba	0.9904 (12)
O1a—Heaa^ii	2.931 (2)	C7b—C8b	1.5270 (15)
O1a—N1b^ii	2.687 (2)	C7b—H8bb	2.0612 (12)
Ho1a—O2a	2.328 (14)	C7b—H8ba	2.0602 (11)
Ho1a—C1a	1.900 (14)	C7b—C9b	2.5697 (15)
Ho1a—O1am	0.987 (16)	C7b—H9bb	2.7580 (11)
Ho1a—O2am	2.320 (14)	C7b—H9ba	2.7688 (11)
Ho1a—N1b^ii	1.719 (16)	C8b—H6bb	2.7380 (11)
Ho1a—Ccb^ii	2.676 (17)	C8b—H6ba	2.6582 (11)
Ho1a—Hcbb^ii	2.831 (16)	C8b—H7bb	2.0888 (11)
Ho1a—Hcab^ii	2.851 (16)	C8b—H7ba	2.0731 (12)
Ho1a—Cdb^ii	2.615 (15)	C8b—H8bb	0.9826 (12)
Ho1a—Hdab^ii	2.769 (16)	C8b—H8ba	0.9799 (11)
Ho1a—Hdbb^ii	2.732 (14)	C8b—C9b	1.5210 (16)
Ho1a—Ceb^ii	2.615 (15)	C8b—H9bb	2.0717 (12)
Ho1a—Heab^ii	2.743 (14)	C8b—H9ba	2.0681 (12)
Ho1a—Hebb^ii	2.766 (16)	C8b—Cab	2.5171 (15)
O2a—C1a	1.215 (2)	C8b—Habb	2.6420 (10)
O2a—C2a	2.403 (2)	C8b—Haba	2.7481 (10)
O2a—H2aa	2.816 (2)	C9b—H7bb	2.8035 (10)
O2a—C3a	2.914 (2)	C9b—H7ba	2.7422 (10)
O2a—H3aa	2.6790 (18)	C9b—H8bb	2.0663 (12)
O2a—O1am	2.260 (2)	C9b—H8ba	2.0452 (12)
O2a—O2am	0.027 (2)	C9b—H9bb	0.9957 (12)
O2a—Heaa^iii	2.670 (2)	C9b—H9ba	0.9926 (11)
O2a—Hhaa^iii	2.413 (2)	C9b—Cab	1.5223 (15)
O2a—Hcbb^ii	2.881 (2)	C9b—Habb	2.0442 (12)
O2a—Hdab^iii	2.721 (2)	C9b—Haba	2.0702 (11)
O2a—Hdbb^iii	2.888 (2)	C9b—Cbb	2.5651 (15)
O3a—Ho3a	0.872 (17)	C9b—O4bm	2.8976 (11)
O3a—O4a	2.217 (3)	Cab—H8bb	2.6971 (11)
O3a—Caa	2.341 (2)	Cab—H8ba	2.6747 (11)
O3a—Haab	2.724 (2)	Cab—H9bb	2.0856 (12)
O3a—Haaa	2.396 (2)	Cab—H9ba	2.0747 (11)
O3a—Cba	1.309 (2)	Cab—Habb	0.9566 (12)
O3a—O3am	0.046 (2)	Cab—Haba	0.9855 (11)
O3a—O4am	2.239 (2)	Cab—Cbb	1.5049 (16)
O3a—N3a	2.661 (2)	Cab—O3bm	2.3950 (10)
O3a—Hgaa^iv	2.895 (2)	Cab—O4bm	2.4377 (12)
Ho3a—O4a	2.304 (15)	Cbb—H9bb	2.8294 (11)
Ho3a—Cba	1.819 (15)	Cbb—H9ba	2.7326 (10)
Ho3a—O3am	0.827 (17)	Cbb—Habb	2.0096 (13)
Ho3a—O4am	2.332 (15)	Cbb—Haba	2.0326 (12)
Ho3a—N3a	1.802 (17)	Cbb—O3bm	1.3583 (11)
Ho3a—Cca	2.750 (18)	Cbb—O4bm	1.2452 (13)
Ho3a—Hcba	2.816 (18)	Cbb—Hhba^iv	2.9244 (12)
Ho3a—Hcaa	2.976 (18)	O1am—H2aa	2.7716
Ho3a—Cfa	2.539 (15)	O1am—H2ab	2.3953
Ho3a—Hfaa	2.606 (16)	O1am—H7ab^i	2.7931
Ho3a—Hfba	2.652 (14)	O1am—O2am	2.2606
Ho3a—Cga	2.812 (17)	O1am—Heaa^ii	2.9355 (8)
Ho3a—Hgaa	2.912 (17)	O1am—N1b^ii	2.6958 (7)
O4a—C9a	2.915 (2)	O2am—H2aa	2.8296
O4a—H9aa	2.649 (2)	O2am—H3aa	2.701
O4a—Caa	2.401 (3)	O2am—Heaa^iii	2.6740 (7)
O4a—Haab	2.849 (2)	O2am—Hhaa^iii	2.3942 (7)
O4a—Cba	1.207 (2)	O2am—Hcbb^ii	2.8569 (7)
O4a—O3am	2.226 (2)	O2am—Hdab^iii	2.7096 (8)
O4a—O4am	0.077 (2)	O2am—Hdbb^iii	2.8824 (7)
O4a—Hdbb^v	2.845 (2)	O3am—Haab	2.7643
O4a—Hebb^vi	2.486 (2)	O3am—Haaa	2.4421
O4a—Hhab^v	2.559 (2)	O3am—O4am	2.2478
C1a—C2a	1.5053 (15)	O3am—N3a	2.6157 (11)
C1a—H2aa	2.0167 (11)	O3am—Hgaa^iv	2.9036 (8)
C1a—H2ab	2.0262 (11)	O4am—H9aa	2.6222
C1a—C3a	2.5496 (16)	O4am—Haab	2.8111
C1a—H3ab	2.7972 (12)	O4am—Hdbb^v	2.7895 (6)
C1a—H3aa	2.7206 (11)	O4am—Heab^v	2.9578 (7)
C1a—O1am	1.3462 (12)	O4am—Hebb^vi	2.4975 (8)
C1a—O2am	1.2268 (12)	O4am—Hhab^v	2.4962 (7)
C2a—H2aa	0.9737 (12)	O1bm—H5aa^iv	2.8867
C2a—H2ab	0.9632 (11)	O1bm—H2ba	2.6423
C2a—C3a	1.5180 (17)	O1bm—H2bb	2.5084
C2a—H3ab	2.0723 (13)	O1bm—O2bm	2.2307
C2a—H3aa	2.0788 (12)	O1bm—N1a^ii	2.6855 (7)
C2a—C4a	2.5186 (15)	O1bm—Hfbb^vii	2.7596 (7)
C2a—H4ab	2.6547 (11)	O2bm—H2aa	2.7365
C2a—H4aa	2.7101 (10)	O2bm—H4aa	2.8528
C2a—O1am	2.3715 (11)	O2bm—H2ba	2.9356
C2a—O2am	2.4229 (11)	O2bm—H3ba	2.6562
C3a—H2aa	2.0418 (13)	O2bm—Hdaa^iii	2.6681 (7)
C3a—H2ab	2.0655 (12)	O2bm—Hdba^iii	2.7214 (7)
C3a—H3ab	1.0014 (12)	O2bm—Hhbb^viii	2.7467 (6)
C3a—H3aa	0.9916 (11)	O3bm—H2ba^vii	2.8803
C3a—C4a	1.5253 (15)	O3bm—H4ba^vii	2.9731
C3a—H4ab	2.0443 (11)	O3bm—Habb	2.59
C3a—H4aa	2.0559 (11)	O3bm—Haba	2.5618
C3a—C5a	2.5615 (15)	O3bm—O4bm	2.2772
C3a—H5ab	2.7611 (11)	O3bm—N3b	2.6503 (12)
C3a—H5aa	2.7495 (11)	O3bm—Hgab^iv	2.9680 (8)
C3a—O2am	2.9389 (11)	O3bm—Hgbb^iv	2.9514 (7)
C4a—H2aa	2.6481 (12)	O4bm—H8bb^ix	2.7871
C4a—H2ab	2.7467 (11)	O4bm—H9bb	2.9503
C4a—H3ab	2.0865 (11)	O4bm—H9ba	2.7445
C4a—H3aa	2.0705 (11)	O4bm—Habb	2.9962
C4a—H4ab	0.9708 (11)	O4bm—Hfaa	2.7864 (7)
C4a—H4aa	0.9787 (11)	O4bm—Hfba	2.7065 (8)
C4a—C5a	1.5167 (17)	O4bm—Hhba^iv	2.7780 (7)
C4a—H5ab	2.0552 (13)	N1a—N2a	2.4512 (13)
C4a—H5aa	2.0735 (12)	N1a—N3a	2.4509 (13)
C4a—C6a	2.5260 (15)	N1a—N4a	2.4455 (14)
C4a—H6ab	2.6979 (11)	N1a—Cca	1.4817 (13)
C4a—H6aa	2.6940 (10)	N1a—Hcba	2.0286 (10)
C5a—H3ab	2.7471 (10)	N1a—Hcaa	2.0360 (9)
C5a—H3aa	2.7755 (11)	N1a—Cda	1.4759 (16)
C5a—H4ab	2.0450 (12)	N1a—Hdaa	2.0158 (11)
C5a—H4aa	2.0540 (12)	N1a—Hdba	2.0149 (10)
C5a—H5ab	0.9812 (11)	N1a—Cea	1.4857 (14)
C5a—H5aa	1.0004 (11)	N1a—Heaa	2.0312 (9)
C5a—C6a	1.5231 (15)	N1a—Heba	2.0151 (11)
C5a—H6ab	2.0605 (11)	N1a—Cfa	2.8378 (14)
C5a—H6aa	2.0473 (11)	N1a—Cga	2.8292 (14)
C5a—C7a	2.5704 (15)	N1a—Cha	2.8270 (14)
C5a—H7ab	2.8292 (11)	N2a—N3a	2.4490 (15)
C5a—H7aa	2.7118 (11)	N2a—N4a	2.4495 (19)
C6a—H4ab	2.7209 (11)	N2a—Cca	2.8435 (15)
C6a—H4aa	2.6822 (12)	N2a—Cda	2.8339 (18)
C6a—H5ab	2.0756 (11)	N2a—Cea	1.4735 (17)
C6a—H5aa	2.0672 (12)	N2a—Heaa	2.0119 (13)
C6a—H6ab	0.9892 (12)	N2a—Heba	2.0070 (14)
C6a—H6aa	0.9631 (12)	N2a—Cfa	1.4648 (16)
C6a—C7a	1.5186 (17)	N2a—Hfaa	2.0034 (14)
C6a—H7ab	2.0595 (13)	N2a—Hfba	2.0100 (13)
C6a—H7aa	2.0632 (12)	N2a—Cga	2.8404 (18)
C6a—C8a	2.5257 (15)	N2a—Cha	1.469 (2)
C6a—H8ab	2.6802 (11)	N2a—Hhba	2.0085 (15)
C6a—H8aa	2.7230 (10)	N2a—Hhaa	2.0136 (15)
C7a—H5ab	2.7824 (10)	N2a—Hcab	2.6910 (15)
C7a—H5aa	2.7579 (11)	N2a—Hdab	2.6906 (12)
C7a—H6ab	2.0658 (12)	N3a—N4a	2.4410 (17)
C7a—H6aa	2.0310 (13)	N3a—Cca	1.4850 (16)
C7a—H7ab	0.9742 (11)	N3a—Hcba	2.0353 (14)
C7a—H7aa	0.9815 (12)	N3a—Hcaa	2.0217 (13)
C7a—C8a	1.5276 (15)	N3a—Cda	2.8344 (17)
C7a—H8ab	2.0636 (12)	N3a—Cea	2.8376 (16)
C7a—H8aa	2.0681 (11)	N3a—Cfa	1.4893 (18)
C7a—C9a	2.5673 (15)	N3a—Hfaa	2.0253 (16)
C7a—H9ab	2.6891 (11)	N3a—Hfba	2.0293 (13)
C7a—H9aa	2.8425 (11)	N3a—Cga	1.475 (2)
C8a—H6ab	2.7673 (11)	N3a—Hgaa	2.0293 (15)
C8a—H6aa	2.6173 (11)	N3a—Hgba	2.0106 (16)
C8a—H7ab	2.0621 (11)	N3a—Cha	2.8221 (16)
C8a—H7aa	2.0675 (12)	N4a—Cca	2.8382 (17)
C8a—H8ab	0.9838 (12)	N4a—Hcba^ix	2.6227 (16)
C8a—H8aa	0.9840 (12)	N4a—Cda	1.4733 (17)
C8a—C9a	1.5210 (17)	N4a—Hdaa	2.0189 (13)
C8a—H9ab	2.0629 (13)	N4a—Hdba	2.0167 (13)
C8a—H9aa	2.0696 (12)	N4a—Cea	2.8386 (19)
C8a—Caa	2.5106 (15)	N4a—Cfa	2.832 (2)
C8a—Haab	2.6180 (11)	N4a—Hfaa^ix	2.7063 (14)
C8a—Haaa	2.7603 (10)	N4a—Cga	1.4687 (16)
C9a—H7ab	2.7372 (10)	N4a—Hgaa	2.0227 (13)
C9a—H7aa	2.7779 (11)	N4a—Hgba	2.0224 (13)
C9a—H8ab	2.0571 (12)	N4a—Cha	1.4757 (18)
C9a—H8aa	2.0557 (12)	N4a—Hhba	2.0282 (14)
C9a—H9ab	0.9814 (12)	N4a—Hhaa	2.0180 (13)
C9a—H9aa	0.9841 (11)	Cca—Hcba	0.9868 (16)
C9a—Caa	1.5240 (15)	Cca—Hcaa	0.9884 (14)
C9a—Haab	2.0642 (12)	Cca—Cda	2.3993 (18)
C9a—Haaa	2.0671 (11)	Cca—Hdaa	2.5931 (16)
C9a—Cba	2.5610 (15)	Cca—Cea	2.4013 (16)
C9a—O4am	2.9015 (11)	Cca—Heba	2.5837 (14)
Caa—H8ab	2.7595 (11)	Cca—Cfa	2.4066 (17)
Caa—H8aa	2.5994 (11)	Cca—Hfaa	2.5848 (14)
Caa—H9ab	2.0726 (12)	Cca—Cga	2.3937 (18)
Caa—H9aa	2.0727 (11)	Cca—Hgba	2.5639 (16)
Caa—Haab	0.9886 (12)	Cda—Hcba^ix	2.9361 (16)
Caa—Haaa	0.9722 (11)	Cda—Hcaa	2.5983 (13)
Caa—Cba	1.5061 (16)	Cda—Hdaa	0.9801 (14)
Caa—O3am	2.3856 (11)	Cda—Hdba	0.9830 (13)
Caa—O4am	2.3859 (12)	Cda—Cea	2.398 (2)
Caa—Heab^v	2.9888 (13)	Cda—Heaa	2.5780 (15)
Cba—H9ab	2.8444 (11)	Cda—Cga	2.3836 (17)
Cba—H9aa	2.6980 (11)	Cda—Hgba	2.5713 (14)
Cba—Haab	2.0291 (13)	Cda—Cha	2.3838 (17)
Cba—Haaa	2.0361 (12)	Cda—Hhaa	2.5786 (13)
Cba—O3am	1.3375 (11)	Cea—Hcba	2.5941 (13)
Cba—O4am	1.2132 (12)	Cea—Hdba	2.5793 (16)
O1b—H5aa^iv	2.892 (2)	Cea—Heaa	0.9940 (13)
O1b—Ho1b	0.923 (16)	Cea—Heba	0.9648 (16)
O1b—O2b	2.226 (3)	Cea—Cfa	2.3827 (17)
O1b—C1b	1.324 (2)	Cea—Hfaa	2.5616 (14)
O1b—C2b	2.354 (2)	Cea—Cha	2.3849 (18)
O1b—H2ba	2.6127 (18)	Cea—Hhaa	2.5828 (15)
O1b—H2bb	2.4813 (19)	Cfa—Hcba	2.6036 (13)
O1b—O1bm	0.0301 (18)	Cfa—Heba	2.5703 (14)
O1b—O2bm	2.221 (2)	Cfa—Hfaa	0.9802 (16)
O1b—N1a^ii	2.711 (2)	Cfa—Hfba	0.9880 (14)
O1b—Hfbb^vii	2.750 (2)	Cfa—Cga	2.406 (2)
Ho1b—O2b	2.272 (16)	Cfa—Hgaa	2.6106 (17)
Ho1b—C1b	1.832 (15)	Cfa—Cha	2.3740 (19)
Ho1b—O1bm	0.897 (16)	Cfa—Hhba	2.5630 (15)
Ho1b—O2bm	2.263 (15)	Cga—Hcaa	2.5752 (14)
Ho1b—N1a^ii	1.825 (16)	Cga—Hdaa	2.5811 (14)
Ho1b—Cca^ii	2.626 (17)	Cga—Hfba	2.5943 (16)
Ho1b—Hcba^ii	2.838 (17)	Cga—Hgaa	0.9969 (14)
Ho1b—Hcaa^ii	2.644 (16)	Cga—Hgba	0.9885 (15)
Ho1b—Cda^ii	2.602 (16)	Cga—Cha	2.3882 (17)
Ho1b—Hdaa^ii	2.596 (16)	Cga—Hhba	2.5914 (14)
Ho1b—Hdba^ii	2.800 (15)	Cha—Hdba	2.5698 (14)
Ho1b—Cea^ii	2.918 (16)	Cha—Heaa	2.5617 (15)
O2b—H2aa	2.7664 (19)	Cha—Hfaa^ix	2.9532 (16)
O2b—H4aa	2.870 (2)	Cha—Hfba	2.5606 (15)
O2b—C1b	1.206 (3)	Cha—Hgaa	2.5935 (14)
O2b—C2b	2.406 (2)	Cha—Hhba	0.9865 (14)
O2b—H2ba	2.917 (2)	Cha—Hhaa	0.9809 (14)
O2b—C3b	2.875 (2)	N1b—N2b	2.4512 (13)
O2b—H3ba	2.6374 (19)	N1b—N3b	2.4510 (13)
O2b—O1bm	2.235 (2)	N1b—N4b	2.4455 (14)
O2b—O2bm	0.0309 (19)	N1b—Ccb	1.4817 (14)
O2b—Hdaa^iii	2.658 (2)	N1b—Hcbb	2.0286 (10)
O2b—Hdba^iii	2.729 (2)	N1b—Hcab	2.0360 (9)
O2b—Hhbb^viii	2.717 (2)	N1b—Cdb	1.4759 (16)
O3b—Ho3b	0.930 (17)	N1b—Hdab	2.0158 (11)
O3b—O4b	2.221 (3)	N1b—Hdbb	2.0149 (11)
O3b—H2ba^vii	2.906 (2)	N1b—Ceb	1.4857 (14)
O3b—H4ba^vii	2.962 (2)	N1b—Heab	2.0312 (9)
O3b—Cab	2.350 (2)	N1b—Hebb	2.0151 (11)
O3b—Habb	2.5500 (18)	N1b—Cfb	2.8378 (15)
O3b—Haba	2.5193 (19)	N1b—Cgb	2.8292 (14)
O3b—Cbb	1.321 (2)	N1b—Chb	2.8270 (13)
O3b—O3bm	0.0452 (18)	N2b—Hcaa^x	2.6956 (15)
O3b—O4bm	2.256 (2)	N2b—Hdaa^x	2.8424 (12)
O3b—N3b	2.689 (2)	N2b—Hgba^x	2.8049 (13)
O3b—Hgab^iv	2.974 (2)	N2b—N3b	2.4490 (16)
O3b—Hgbb^iv	2.946 (2)	N2b—N4b	2.4495 (19)
Ho3b—O4b	2.327 (15)	N2b—Ccb	2.8435 (15)
Ho3b—Cbb	1.873 (14)	N2b—Cdb	2.8339 (18)
Ho3b—O3bm	0.892 (17)	N2b—Ceb	1.4735 (16)
Ho3b—O4bm	2.349 (15)	N2b—Heab	2.0119 (14)
Ho3b—N3b	1.773 (16)	N2b—Hebb	2.0070 (14)
Ho3b—Ccb	2.653 (17)	N2b—Cfb	1.4648 (17)
Ho3b—Hcbb	2.747 (16)	N2b—Hfab	2.0034 (14)
Ho3b—Hcab	2.812 (17)	N2b—Hfbb	2.0100 (14)
Ho3b—Cfb	2.642 (15)	N2b—Cgb	2.8404 (18)
Ho3b—Hfab	2.732 (16)	N2b—Chb	1.469 (2)
Ho3b—Hfbb	2.801 (14)	N2b—Hhbb	2.0085 (14)
Ho3b—Cgb	2.753 (17)	N2b—Hhab	2.0136 (15)
Ho3b—Hgab	2.904 (17)	N3b—N4b	2.4410 (18)
Ho3b—Hgbb	2.908 (18)	N3b—Ccb	1.4850 (16)
O4b—H8bb^ix	2.812 (2)	N3b—Hcbb	2.0353 (14)
O4b—C9b	2.875 (2)	N3b—Hcab	2.0217 (13)
O4b—H9bb	2.9342 (19)	N3b—Cdb	2.8344 (18)
O4b—H9ba	2.7309 (19)	N3b—Ceb	2.8376 (17)
O4b—Cab	2.399 (2)	N3b—Cfb	1.4893 (18)
O4b—Habb	2.958 (2)	N3b—Hfab	2.0253 (15)
O4b—Cbb	1.203 (3)	N3b—Hfbb	2.0293 (13)
O4b—O3bm	2.243 (2)	N3b—Cgb	1.475 (2)
O4b—O4bm	0.042 (2)	N3b—Hgab	2.0293 (14)
O4b—Hfaa	2.819 (2)	N3b—Hgbb	2.0106 (16)
O4b—Hfba	2.749 (2)	N3b—Chb	2.8221 (16)
O4b—Hhba^iv	2.773 (2)	N4b—Ccb	2.8382 (17)
C1b—C2b	1.5076 (15)	N4b—Hcbb^ix	2.7273 (16)
C1b—H2ba	2.0139 (11)	N4b—Cdb	1.4733 (16)
C1b—H2bb	2.0432 (11)	N4b—Hdab	2.0189 (13)
C1b—C3b	2.5548 (15)	N4b—Hdbb	2.0167 (14)
C1b—H3bb	2.8269 (12)	N4b—Ceb	2.8386 (19)
C1b—H3ba	2.6870 (12)	N4b—Cfb	2.832 (2)
C1b—O1bm	1.3450 (13)	N4b—Hfab^ix	2.5876 (14)
C1b—O2bm	1.2104 (14)	N4b—Cgb	1.4687 (17)
C1b—Hhbb^viii	2.9787 (13)	N4b—Hgab	2.0227 (14)
C2b—H2ba	0.9779 (11)	N4b—Hgbb	2.0224 (13)
C2b—H2bb	0.9769 (11)	N4b—Chb	1.4757 (18)
C2b—C3b	1.5194 (17)	N4b—Hhbb	2.0282 (13)
C2b—H3bb	2.0573 (12)	N4b—Hhab	2.0180 (13)
C2b—H3ba	2.0733 (13)	Ccb—Hcbb	0.9868 (16)
C2b—C4b	2.5192 (15)	Ccb—Hcab	0.9884 (14)
C2b—H4bb	2.6785 (10)	Ccb—Cdb	2.3993 (18)
C2b—H4ba	2.7064 (10)	Ccb—Hdab	2.5931 (16)
C2b—O1bm	2.3833 (11)	Ccb—Ceb	2.4013 (16)
C2b—O2bm	2.4178 (11)	Ccb—Hebb	2.5837 (14)
C3b—H2ba	2.0587 (12)	Ccb—Cfb	2.4066 (17)
C3b—H2bb	2.0662 (12)	Ccb—Hfab	2.5848 (15)
C3b—H3bb	0.9761 (11)	Ccb—Cgb	2.3937 (18)
C3b—H3ba	0.9931 (12)	Ccb—Hgbb	2.5639 (15)
C3b—C4b	1.5270 (15)	Cdb—Hcbb^ix	2.8636 (16)
C3b—H4bb	2.0690 (11)	Cdb—Hcab	2.5983 (14)
C3b—H4ba	2.0673 (10)	Cdb—Hdab	0.9801 (14)
C3b—C5b	2.5689 (15)	Cdb—Hdbb	0.9830 (14)
C3b—H5bb	2.8082 (11)	Cdb—Ceb	2.398 (2)
C3b—H5ba	2.7246 (11)	Cdb—Heab	2.5780 (15)
C3b—O2bm	2.8883 (10)	Cdb—Cgb	2.3836 (17)
C4b—H2ba	2.6366 (11)	Cdb—Hgbb	2.5713 (14)
C4b—H2bb	2.7707 (11)	Cdb—Chb	2.3838 (17)
C4b—H3bb	2.0651 (11)	Cdb—Hhab	2.5786 (13)
C4b—H3ba	2.0848 (11)	Ceb—Hcbb	2.5941 (13)
C4b—H4bb	0.9918 (12)	Ceb—Hdbb	2.5793 (16)
C4b—H4ba	0.9844 (11)	Ceb—Heab	0.9940 (14)
C4b—C5b	1.5223 (17)	Ceb—Hebb	0.9648 (16)
C4b—H5bb	2.0689 (12)	Ceb—Cfb	2.3827 (18)
C4b—H5ba	2.0782 (12)	Ceb—Hfab	2.5616 (15)
C4b—C6b	2.5378 (15)	Ceb—Chb	2.3849 (18)
C4b—H6bb	2.6926 (10)	Ceb—Hhab	2.5828 (14)
C4b—H6ba	2.7296 (10)	Cfb—Hcbb	2.6036 (13)
C5b—H3bb	2.7549 (10)	Cfb—Hebb	2.5703 (14)
C5b—H3ba	2.7836 (11)	Cfb—Hfab	0.9802 (16)
C5b—H4bb	2.0703 (12)	Cfb—Hfbb	0.9880 (14)
C5b—H4ba	2.0551 (13)	Cfb—Cgb	2.406 (2)
C5b—H5bb	0.9887 (12)	Cfb—Hgab	2.6106 (16)
C5b—H5ba	0.9996 (12)	Cfb—Chb	2.3740 (19)
C5b—C6b	1.5277 (15)	Cfb—Hhbb	2.5630 (15)
C5b—H6bb	2.0587 (12)	Cgb—Hcab	2.5752 (14)
C5b—H6ba	2.0627 (11)	Cgb—Hdab	2.5811 (15)
C5b—C7b	2.5685 (15)	Cgb—Hfbb	2.5943 (16)
C5b—H7bb	2.7909 (11)	Cgb—Hgab	0.9969 (14)
C5b—H7ba	2.7326 (11)	Cgb—Hgbb	0.9885 (15)
C6b—H4bb	2.7672 (11)	Cgb—Chb	2.3882 (17)
C6b—H4ba	2.6580 (11)	Cgb—Hhbb	2.5914 (13)
C6b—H5bb	2.0766 (11)	Chb—Hdbb	2.5698 (14)
C6b—H5ba	2.0775 (12)	Chb—Heab	2.5617 (15)
C6b—H6bb	0.9757 (12)	Chb—Hfab^ix	2.8823 (16)
C6b—H6ba	0.9768 (11)	Chb—Hfbb	2.5606 (15)
C6b—C7b	1.5203 (17)	Chb—Hgab	2.5935 (14)
C6b—H7bb	2.0674 (12)	Chb—Hhbb	0.9865 (14)
C6b—H7ba	2.0712 (13)	Chb—Hhab	0.9809 (14)
Ho1a—O1a—O2a	83.6 (9)	Hcbb^ii—O2am—Hdab^iii	55.58 (2)
Ho1a—O1a—C1a	110.9 (9)	Hcbb^ii—O2am—Hdbb^iii	58.63 (2)
Ho1a—O1a—C2a	146.7 (9)	Hdab^iii—O2am—Hdbb^iii	33.228 (19)
Ho1a—O1a—H2aa	143.2 (9)	O3a—O3am—Ho3a	163 (3)
Ho1a—O1a—H2ab	166.1 (10)	O3a—O3am—O4a	78 (3)
Ho1a—O1a—H7ab^i	125.3 (9)	O3a—O3am—Caa	17 (2)
Ho1a—O1a—O1am	104 (3)	O3a—O3am—Haab	29 (3)
Ho1a—O1a—O2am	83.0 (9)	O3a—O3am—Haaa	7 (2)
Ho1a—O1a—Heaa^ii	89.3 (10)	O3a—O3am—Cba	51 (3)
Ho1a—O1a—N1b^ii	6.2 (10)	O3a—O3am—O4am	78 (3)
O2a—O1a—C1a	27.29 (9)	O3a—O3am—N3a	170 (2)
O2a—O1a—C2a	63.15 (7)	O3a—O3am—Hgaa^iv	79 (3)
O2a—O1a—H2aa	67.84 (7)	Ho3a—O3am—O4a	84.8 (11)
O2a—O1a—H2ab	84.62 (8)	Ho3a—O3am—Caa	147.0 (11)
O2a—O1a—H7ab^i	126.42 (10)	Ho3a—O3am—Haab	142.5 (11)
O2a—O1a—O1am	160 (3)	Ho3a—O3am—Haaa	167.2 (11)
O2a—O1a—O2am	0.69 (5)	Ho3a—O3am—Cba	112.2 (11)
O2a—O1a—Heaa^ii	102.55 (9)	Ho3a—O3am—O4am	85.4 (11)
O2a—O1a—N1b^ii	86.36 (8)	Ho3a—O3am—N3a	8.6 (12)
C1a—O1a—C2a	35.87 (8)	Ho3a—O3am—Hgaa^iv	108.5 (13)
C1a—O1a—H2aa	43.43 (8)	O4a—O3am—Caa	62.63 (6)
C1a—O1a—H2ab	57.63 (9)	O4a—O3am—Haab	68.65 (6)
C1a—O1a—H7ab^i	107.15 (12)	O4a—O3am—Haaa	83.44 (5)
C1a—O1a—O1am	140 (3)	O4a—O3am—Cba	27.40 (8)
C1a—O1a—O2am	27.87 (7)	O4a—O3am—O4am	1.90 (6)
C1a—O1a—Heaa^ii	101.81 (11)	O4a—O3am—N3a	92.02 (6)
C1a—O1a—N1b^ii	113.49 (13)	O4a—O3am—Hgaa^iv	112.49 (6)
C2a—O1a—H2aa	20.05 (3)	Caa—O3am—Haab	20.48 (3)
C2a—O1a—H2ab	23.34 (3)	Caa—O3am—Haaa	23.20 (3)
C2a—O1a—H7ab^i	80.22 (6)	Caa—O3am—Cba	35.25 (6)
C2a—O1a—O1am	108 (3)	Caa—O3am—O4am	61.90 (3)
C2a—O1a—O2am	63.71 (6)	Caa—O3am—N3a	152.84 (4)
C2a—O1a—Heaa^ii	95.61 (7)	Caa—O3am—Hgaa^iv	81.30 (3)
C2a—O1a—N1b^ii	148.61 (9)	Haab—O3am—Haaa	34.575
H2aa—O1a—H2ab	34.38 (2)	Haab—O3am—Cba	44.07 (6)
H2aa—O1a—H7ab^i	90.95 (6)	Haab—O3am—O4am	67.321
H2aa—O1a—O1am	110 (3)	Haab—O3am—N3a	143.57 (2)
H2aa—O1a—O2am	68.21 (5)	Haab—O3am—Hgaa^iv	62.004 (12)
H2aa—O1a—Heaa^ii	75.58 (5)	Haaa—O3am—Cba	56.48 (5)
H2aa—O1a—N1b^ii	141.53 (8)	Haaa—O3am—O4am	83.037
H2ab—O1a—H7ab^i	57.85 (4)	Haaa—O3am—N3a	175.42 (3)
H2ab—O1a—O1am	85 (3)	Haaa—O3am—Hgaa^iv	80.920 (13)
H2ab—O1a—O2am	85.24 (6)	Cba—O3am—O4am	26.74 (5)
H2ab—O1a—Heaa^ii	100.48 (7)	Cba—O3am—N3a	119.04 (6)
H2ab—O1a—N1b^ii	170.79 (10)	Cba—O3am—Hgaa^iv	100.28 (6)
H7ab^i—O1a—O1am	35 (3)	O4am—O3am—N3a	92.44 (3)
H7ab^i—O1a—O2am	127.09 (9)	O4am—O3am—Hgaa^iv	110.591 (13)
H7ab^i—O1a—Heaa^ii	119.54 (8)	N3a—O3am—Hgaa^iv	101.47 (3)
H7ab^i—O1a—N1b^ii	127.52 (7)	O3a—O4am—Ho3a	21.9 (4)
O1am—O1a—O2am	161 (3)	O3a—O4am—O4a	72.7 (15)
O1am—O1a—Heaa^ii	96 (3)	O3a—O4am—C9a	89.96 (6)
O1am—O1a—N1b^ii	104 (3)	O3a—O4am—H9aa	108.87 (5)
O2am—O1a—Heaa^ii	102.14 (7)	O3a—O4am—Caa	60.74 (6)
O2am—O1a—N1b^ii	85.75 (7)	O3a—O4am—Haab	64.11 (6)
Heaa^ii—O1a—N1b^ii	83.28 (6)	O3a—O4am—Cba	28.58 (7)
O1a—Ho1a—O2a	71.8 (8)	O3a—O4am—O3am	1.16 (5)
O1a—Ho1a—C1a	40.4 (6)	O3a—O4am—Hdbb^v	151.66 (6)
O1a—Ho1a—O1am	2.07 (12)	O3a—O4am—Heab^v	103.85 (6)
O1a—Ho1a—O2am	72.3 (8)	O3a—O4am—Hebb^vi	134.11 (6)
O1a—Ho1a—N1b^ii	170.4 (15)	O3a—O4am—Hhab^v	107.14 (6)
O1a—Ho1a—Ccb^ii	147.8 (11)	Ho3a—O4am—O4a	67.2 (15)
O1a—Ho1a—Hcbb^ii	137.6 (10)	Ho3a—O4am—C9a	111.6 (4)
O1a—Ho1a—Hcab^ii	130.3 (11)	Ho3a—O4am—H9aa	130.7 (4)
O1a—Ho1a—Cdb^ii	139.5 (13)	Ho3a—O4am—Caa	82.5 (4)
O1a—Ho1a—Hdab^ii	124.0 (12)	Ho3a—O4am—Haab	83.9 (4)
O1a—Ho1a—Hdbb^ii	126.8 (12)	Ho3a—O4am—Cba	50.4 (4)
O1a—Ho1a—Ceb^ii	155.6 (13)	Ho3a—O4am—O3am	20.7 (4)
O1a—Ho1a—Heab^ii	137.8 (12)	Ho3a—O4am—Hdbb^v	151.6 (4)
O1a—Ho1a—Hebb^ii	143.1 (13)	Ho3a—O4am—Heab^v	114.5 (5)
O2a—Ho1a—C1a	31.4 (2)	Ho3a—O4am—Hebb^vi	112.8 (4)
O2a—Ho1a—O1am	73.7 (8)	Ho3a—O4am—Hhab^v	98.6 (4)
O2a—Ho1a—O2am	0.63 (5)	O4a—O4am—C9a	99.5 (16)
O2a—Ho1a—N1b^ii	112.3 (8)	O4a—O4am—H9aa	109.9 (15)
O2a—Ho1a—Ccb^ii	84.3 (5)	O4a—O4am—Caa	100.1 (17)
O2a—Ho1a—Hcbb^ii	67.1 (4)	O4a—O4am—Haab	118.4 (17)
O2a—Ho1a—Hcab^ii	80.7 (4)	O4a—O4am—Cba	83.5 (17)
O2a—Ho1a—Cdb^ii	137.0 (7)	O4a—O4am—O3am	72.3 (15)
O2a—Ho1a—Hdab^ii	128.3 (6)	O4a—O4am—Hdbb^v	135.6 (15)
O2a—Ho1a—Hdbb^ii	157.9 (7)	O4a—O4am—Heab^v	166.0 (16)
O2a—Ho1a—Ceb^ii	111.5 (6)	O4a—O4am—Hebb^vi	80.7 (17)
O2a—Ho1a—Heab^ii	125.9 (7)	O4a—O4am—Hhab^v	143.4 (16)
O2a—Ho1a—Hebb^ii	92.9 (5)	C9a—O4am—H9aa	19.70 (2)
C1a—Ho1a—O1am	42.4 (6)	C9a—O4am—Caa	31.63 (4)
C1a—Ho1a—O2am	31.9 (2)	C9a—O4am—Haab	42.33 (3)
C1a—Ho1a—N1b^ii	143.0 (9)	C9a—O4am—Cba	61.76 (6)
C1a—Ho1a—Ccb^ii	113.2 (6)	C9a—O4am—O3am	91.11 (2)
C1a—Ho1a—Hcbb^ii	98.0 (6)	C9a—O4am—Hdbb^v	84.02 (3)
C1a—Ho1a—Hcab^ii	104.0 (6)	C9a—O4am—Heab^v	66.64 (3)
C1a—Ho1a—Cdb^ii	156.0 (8)	C9a—O4am—Hebb^vi	131.54 (3)
C1a—Ho1a—Hdab^ii	136.6 (7)	C9a—O4am—Hhab^v	117.02 (3)
C1a—Ho1a—Hdbb^ii	163.6 (8)	H9aa—O4am—Caa	48.62 (3)
C1a—Ho1a—Ceb^ii	138.7 (8)	H9aa—O4am—Haab	52.973
C1a—Ho1a—Heab^ii	143.9 (8)	H9aa—O4am—Cba	80.33 (5)
C1a—Ho1a—Hebb^ii	118.3 (7)	H9aa—O4am—O3am	110.029
O1am—Ho1a—O2am	74.2 (8)	H9aa—O4am—Hdbb^v	64.770 (14)
O1am—Ho1a—N1b^ii	169.9 (15)	H9aa—O4am—Heab^v	57.791 (13)
O1am—Ho1a—Ccb^ii	149.7 (11)	H9aa—O4am—Hebb^vi	115.119 (14)
O1am—Ho1a—Hcbb^ii	139.7 (10)	H9aa—O4am—Hhab^v	104.746 (15)
O1am—Ho1a—Hcab^ii	131.8 (11)	Caa—O4am—Haab	19.84 (3)
O1am—Ho1a—Cdb^ii	138.3 (12)	Caa—O4am—Cba	32.25 (6)
O1am—Ho1a—Hdab^ii	123.4 (12)	Caa—O4am—O3am	61.89 (2)
O1am—Ho1a—Hdbb^ii	125.0 (11)	Caa—O4am—Hdbb^v	104.62 (3)
O1am—Ho1a—Ceb^ii	154.5 (12)	Caa—O4am—Heab^v	67.03 (3)
O1am—Ho1a—Heab^ii	136.1 (11)	Caa—O4am—Hebb^vi	163.17 (3)
O1am—Ho1a—Hebb^ii	143.1 (13)	Caa—O4am—Hhab^v	111.69 (3)
O2am—Ho1a—N1b^ii	111.8 (8)	Haab—O4am—Cba	39.58 (5)
O2am—Ho1a—Ccb^ii	83.7 (5)	Haab—O4am—O3am	65.135
O2am—Ho1a—Hcbb^ii	66.5 (4)	Haab—O4am—Hdbb^v	93.970 (16)
O2am—Ho1a—Hcab^ii	80.1 (4)	Haab—O4am—Heab^v	49.959 (14)
O2am—Ho1a—Cdb^ii	136.3 (7)	Haab—O4am—Hebb^vi	159.290 (15)
O2am—Ho1a—Hdab^ii	127.7 (6)	Haab—O4am—Hhab^v	91.884 (18)
O2am—Ho1a—Hdbb^ii	157.2 (7)	Cba—O4am—O3am	29.74 (5)
O2am—Ho1a—Ceb^ii	111.2 (6)	Cba—O4am—Hdbb^v	133.55 (6)
O2am—Ho1a—Heab^ii	125.7 (7)	Cba—O4am—Heab^v	87.54 (6)
O2am—Ho1a—Hebb^ii	92.7 (5)	Cba—O4am—Hebb^vi	160.90 (6)
N1b^ii—Ho1a—Ccb^ii	30.6 (3)	Cba—O4am—Hhab^v	114.27 (6)
N1b^ii—Ho1a—Hcbb^ii	45.2 (4)	O3am—O4am—Hdbb^v	152.024 (16)
N1b^ii—Ho1a—Hcab^ii	45.0 (4)	O3am—O4am—Heab^v	104.440 (14)
N1b^ii—Ho1a—Cdb^ii	32.1 (3)	O3am—O4am—Hebb^vi	132.999 (14)
N1b^ii—Ho1a—Hdab^ii	46.5 (4)	O3am—O4am—Hhab^v	106.707 (16)
N1b^ii—Ho1a—Hdbb^ii	47.4 (4)	Hdbb^v—O4am—Heab^v	48.50 (2)
N1b^ii—Ho1a—Ceb^ii	32.5 (3)	Hdbb^v—O4am—Hebb^vi	65.46 (2)
N1b^ii—Ho1a—Heab^ii	47.6 (3)	Hdbb^v—O4am—Hhab^v	53.06 (2)
N1b^ii—Ho1a—Hebb^ii	46.5 (4)	Heab^v—O4am—Hebb^vi	109.94 (2)
Ccb^ii—Ho1a—Hcbb^ii	20.40 (13)	Heab^v—O4am—Hhab^v	50.54 (2)
Ccb^ii—Ho1a—Hcab^ii	20.29 (13)	Hebb^vi—O4am—Hhab^v	74.11 (2)
Ccb^ii—Ho1a—Cdb^ii	53.9 (3)	H5aa^iv—O1bm—O1b	100 (4)
Ccb^ii—Ho1a—Hdab^ii	56.8 (3)	H5aa^iv—O1bm—Ho1b	92.0 (10)
Ccb^ii—Ho1a—Hdbb^ii	73.8 (4)	H5aa^iv—O1bm—O2b	86.04 (5)
Ccb^ii—Ho1a—Ceb^ii	54.0 (3)	H5aa^iv—O1bm—C1b	87.16 (5)
Ccb^ii—Ho1a—Heab^ii	73.9 (4)	H5aa^iv—O1bm—C2b	90.58 (3)
Ccb^ii—Ho1a—Hebb^ii	56.7 (3)	H5aa^iv—O1bm—H2ba	110.983
Hcbb^ii—Ho1a—Hcab^ii	33.09 (19)	H5aa^iv—O1bm—H2bb	77.256
Hcbb^ii—Ho1a—Cdb^ii	73.3 (4)	H5aa^iv—O1bm—O2bm	85.346
Hcbb^ii—Ho1a—Hdab^ii	77.2 (4)	H5aa^iv—O1bm—N1a^ii	103.406 (14)
Hcbb^ii—Ho1a—Hdbb^ii	92.0 (5)	H5aa^iv—O1bm—Hfbb^vii	149.114 (15)
Hcbb^ii—Ho1a—Ceb^ii	56.7 (3)	O1b—O1bm—Ho1b	148 (4)
Hcbb^ii—Ho1a—Heab^ii	77.9 (4)	O1b—O1bm—O2b	71 (4)
Hcbb^ii—Ho1a—Hebb^ii	50.6 (3)	O1b—O1bm—C1b	45 (4)
Hcab^ii—Ho1a—Cdb^ii	56.6 (3)	O1b—O1bm—C2b	12 (4)
Hcab^ii—Ho1a—Hdab^ii	50.6 (3)	O1b—O1bm—H2ba	11 (4)
Hcab^ii—Ho1a—Hdbb^ii	77.6 (4)	O1b—O1bm—H2bb	26 (4)
Hcab^ii—Ho1a—Ceb^ii	73.2 (4)	O1b—O1bm—O2bm	72 (4)
Hcab^ii—Ho1a—Heab^ii	91.9 (5)	O1b—O1bm—N1a^ii	148 (4)
Hcab^ii—Ho1a—Hebb^ii	76.9 (4)	O1b—O1bm—Hfbb^vii	72 (4)
Cdb^ii—Ho1a—Hdab^ii	20.72 (13)	Ho1b—O1bm—O2b	80.9 (10)
Cdb^ii—Ho1a—Hdbb^ii	21.04 (12)	Ho1b—O1bm—C1b	108.0 (10)
Cdb^ii—Ho1a—Ceb^ii	54.6 (3)	Ho1b—O1bm—C2b	143.2 (10)
Cdb^ii—Ho1a—Heab^ii	57.5 (3)	Ho1b—O1bm—H2ba	143.3 (9)
Cdb^ii—Ho1a—Hebb^ii	73.8 (4)	Ho1b—O1bm—H2bb	159.2 (11)
Hdab^ii—Ho1a—Hdbb^ii	33.97 (19)	Ho1b—O1bm—O2bm	80.5 (10)
Hdab^ii—Ho1a—Ceb^ii	74.1 (4)	Ho1b—O1bm—N1a^ii	13.5 (11)
Hdab^ii—Ho1a—Heab^ii	78.1 (4)	Ho1b—O1bm—Hfbb^vii	110.3 (11)
Hdab^ii—Ho1a—Hebb^ii	92.1 (5)	O2b—O1bm—C1b	27.16 (7)
Hdbb^ii—Ho1a—Ceb^ii	57.6 (3)	O2b—O1bm—C2b	62.70 (6)
Hdbb^ii—Ho1a—Heab^ii	51.2 (2)	O2b—O1bm—H2ba	72.93 (5)
Hdbb^ii—Ho1a—Hebb^ii	78.0 (4)	O2b—O1bm—H2bb	80.66 (5)
Ceb^ii—Ho1a—Heab^ii	21.21 (12)	O2b—O1bm—O2bm	0.79 (5)
Ceb^ii—Ho1a—Hebb^ii	20.41 (13)	O2b—O1bm—N1a^ii	88.91 (5)
Heab^ii—Ho1a—Hebb^ii	34.12 (18)	O2b—O1bm—Hfbb^vii	117.58 (5)
O1a—O2a—Ho1a	24.7 (4)	C1b—O1bm—C2b	35.55 (6)
O1a—O2a—C1a	29.82 (9)	C1b—O1bm—H2ba	48.23 (5)
O1a—O2a—C2a	61.17 (8)	C1b—O1bm—H2bb	54.41 (5)
O1a—O2a—H2aa	65.13 (7)	C1b—O1bm—O2bm	27.55 (5)
O1a—O2a—C3a	89.80 (9)	C1b—O1bm—N1a^ii	115.09 (5)
O1a—O2a—H3aa	108.62 (9)	C1b—O1bm—Hfbb^vii	104.95 (5)
O1a—O2a—O1am	0.32 (5)	C2b—O1bm—H2ba	21.66 (3)
O1a—O2a—O2am	92 (4)	C2b—O1bm—H2bb	22.86 (3)
O1a—O2a—Heaa^iii	157.55 (10)	C2b—O1bm—O2bm	63.10 (3)
O1a—O2a—Hhaa^iii	123.36 (11)	C2b—O1bm—N1a^ii	147.61 (3)
O1a—O2a—Hcbb^ii	89.11 (8)	C2b—O1bm—Hfbb^vii	84.11 (3)
O1a—O2a—Hdab^iii	140.46 (9)	H2ba—O1bm—H2bb	35.504
O1a—O2a—Hdbb^iii	116.41 (8)	H2ba—O1bm—O2bm	73.54
Ho1a—O2a—C1a	54.5 (4)	H2ba—O1bm—N1a^ii	139.360 (14)
Ho1a—O2a—C2a	85.8 (4)	H2ba—O1bm—Hfbb^vii	62.920 (14)
Ho1a—O2a—H2aa	88.0 (4)	H2bb—O1bm—O2bm	80.869
Ho1a—O2a—C3a	114.0 (4)	H2bb—O1bm—N1a^ii	169.501 (16)
Ho1a—O2a—H3aa	133.2 (4)	H2bb—O1bm—Hfbb^vii	86.823 (14)
Ho1a—O2a—O1am	24.8 (4)	O2bm—O1bm—N1a^ii	88.722 (17)
Ho1a—O2a—O2am	71 (4)	O2bm—O1bm—Hfbb^vii	118.363 (15)
Ho1a—O2a—Heaa^iii	167.2 (4)	N1a^ii—O1bm—Hfbb^vii	97.02 (2)
Ho1a—O2a—Hhaa^iii	112.1 (4)	H2aa—O2bm—H4aa	52.493
Ho1a—O2a—Hcbb^ii	64.8 (4)	H2aa—O2bm—O1b	96.26 (5)
Ho1a—O2a—Hdab^iii	116.3 (4)	H2aa—O2bm—Ho1b	83.4 (4)
Ho1a—O2a—Hdbb^iii	97.8 (4)	H2aa—O2bm—O2b	165 (4)
C1a—O2a—C2a	31.37 (8)	H2aa—O2bm—C1b	113.42 (5)
C1a—O2a—H2aa	38.71 (8)	H2aa—O2bm—C2b	125.72 (2)
C1a—O2a—C3a	60.68 (10)	H2aa—O2bm—H2ba	141.356
C1a—O2a—H3aa	78.92 (10)	H2aa—O2bm—C3b	121.75 (2)
C1a—O2a—O1am	29.69 (7)	H2aa—O2bm—H3ba	128.68
C1a—O2a—O2am	116 (5)	H2aa—O2bm—O1bm	95.723
C1a—O2a—Heaa^iii	129.76 (12)	H2aa—O2bm—Hdaa^iii	95.931 (14)
C1a—O2a—Hhaa^iii	128.25 (15)	H2aa—O2bm—Hdba^iii	61.268 (13)
C1a—O2a—Hcbb^ii	118.42 (13)	H2aa—O2bm—Hhbb^viii	152.599 (15)
C1a—O2a—Hdab^iii	167.68 (13)	H4aa—O2bm—O1b	121.91 (5)
C1a—O2a—Hdbb^iii	135.23 (12)	H4aa—O2bm—Ho1b	125.6 (4)
C2a—O2a—H2aa	19.52 (3)	H4aa—O2bm—O2b	124 (4)
C2a—O2a—C3a	31.34 (5)	H4aa—O2bm—C1b	111.64 (5)
C2a—O2a—H3aa	47.91 (4)	H4aa—O2bm—C2b	96.31 (3)
C2a—O2a—O1am	61.05 (6)	H4aa—O2bm—H2ba	112.815
C2a—O2a—O2am	136 (5)	H4aa—O2bm—C3b	74.53 (2)
C2a—O2a—Heaa^iii	98.94 (7)	H4aa—O2bm—H3ba	76.41
C2a—O2a—Hhaa^iii	119.82 (8)	H4aa—O2bm—O1bm	121.935
C2a—O2a—Hcbb^ii	148.24 (9)	H4aa—O2bm—Hdaa^iii	100.021 (16)
C2a—O2a—Hdab^iii	156.57 (9)	H4aa—O2bm—Hdba^iii	79.711 (15)
C2a—O2a—Hdbb^iii	143.06 (9)	H4aa—O2bm—Hhbb^viii	135.436 (16)
H2aa—O2a—C3a	41.70 (4)	O1b—O2bm—Ho1b	23.7 (4)
H2aa—O2a—H3aa	51.50 (3)	O1b—O2bm—O2b	97 (4)
H2aa—O2a—O1am	65.12 (5)	O1b—O2bm—C1b	30.21 (7)
H2aa—O2a—O2am	120 (5)	O1b—O2bm—C2b	60.81 (6)
H2aa—O2a—Heaa^iii	92.63 (5)	O1b—O2bm—H2ba	58.96 (5)
H2aa—O2a—Hhaa^iii	101.08 (7)	O1b—O2bm—C3b	92.10 (6)
H2aa—O2a—Hcbb^ii	138.84 (8)	O1b—O2bm—H3ba	108.33 (5)
H2aa—O2a—Hdab^iii	153.38 (7)	O1b—O2bm—O1bm	0.74 (5)
H2aa—O2a—Hdbb^iii	161.59 (8)	O1b—O2bm—Hdaa^iii	134.45 (5)
C3a—O2a—H3aa	19.85 (3)	O1b—O2bm—Hdba^iii	131.71 (5)
C3a—O2a—O1am	89.62 (7)	O1b—O2bm—Hhbb^viii	95.96 (5)
C3a—O2a—O2am	157 (4)	Ho1b—O2bm—O2b	107 (4)
C3a—O2a—Heaa^iii	74.01 (5)	Ho1b—O2bm—C1b	53.9 (4)
C3a—O2a—Hhaa^iii	116.25 (7)	Ho1b—O2bm—C2b	84.4 (4)
C3a—O2a—Hcbb^ii	178.04 (8)	Ho1b—O2bm—H2ba	80.7 (4)
C3a—O2a—Hdab^iii	125.34 (8)	Ho1b—O2bm—C3b	115.8 (4)
C3a—O2a—Hdbb^iii	120.88 (8)	Ho1b—O2bm—H3ba	131.4 (4)
H3aa—O2a—O1am	108.46 (8)	Ho1b—O2bm—O1bm	23.0 (4)
H3aa—O2a—O2am	145 (4)	Ho1b—O2bm—Hdaa^iii	116.4 (4)
H3aa—O2a—Heaa^iii	54.18 (4)	Ho1b—O2bm—Hdba^iii	108.0 (4)
H3aa—O2a—Hhaa^iii	99.41 (6)	Ho1b—O2bm—Hhbb^viii	98.6 (4)
H3aa—O2a—Hcbb^ii	161.65 (8)	O2b—O2bm—C1b	82 (4)
H3aa—O2a—Hdab^iii	108.96 (7)	O2b—O2bm—C2b	68 (4)
H3aa—O2a—Hdbb^iii	114.72 (8)	O2b—O2bm—H2ba	53 (4)
O1am—O2a—O2am	92 (4)	O2b—O2bm—C3b	65 (4)
O1am—O2a—Heaa^iii	157.58 (9)	O2b—O2bm—H3ba	52 (4)
O1am—O2a—Hhaa^iii	123.68 (9)	O2b—O2bm—O1bm	98 (4)
O1am—O2a—Hcbb^ii	89.29 (6)	O2b—O2bm—Hdaa^iii	70 (4)
O1am—O2a—Hdab^iii	140.52 (8)	O2b—O2bm—Hdba^iii	104 (4)
O1am—O2a—Hdbb^iii	116.31 (7)	O2b—O2bm—Hhbb^viii	18 (4)
O2am—O2a—Heaa^iii	97 (4)	C1b—O2bm—C2b	30.60 (6)
O2am—O2a—Hhaa^iii	46 (4)	C1b—O2bm—H2ba	32.00 (5)
O2am—O2a—Hcbb^ii	25 (4)	C1b—O2bm—C3b	62.02 (6)
O2am—O2a—Hdab^iii	64 (5)	C1b—O2bm—H3ba	78.33 (5)
O2am—O2a—Hdbb^iii	79 (4)	C1b—O2bm—O1bm	30.93 (5)
Heaa^iii—O2a—Hhaa^iii	55.19 (4)	C1b—O2bm—Hdaa^iii	145.73 (5)
Heaa^iii—O2a—Hcbb^ii	107.48 (7)	C1b—O2bm—Hdba^iii	161.75 (6)
Heaa^iii—O2a—Hdab^iii	61.23 (5)	C1b—O2bm—Hhbb^viii	88.82 (5)
Heaa^iii—O2a—Hdbb^iii	85.61 (6)	C2b—O2bm—H2ba	17.91 (3)
Hhaa^iii—O2a—Hcbb^ii	65.71 (5)	C2b—O2bm—C3b	31.73 (4)
Hhaa^iii—O2a—Hdab^iii	61.00 (5)	C2b—O2bm—H3ba	47.95 (3)
Hhaa^iii—O2a—Hdbb^iii	92.96 (7)	C2b—O2bm—O1bm	61.53 (3)
Hcbb^ii—O2a—Hdab^iii	55.17 (4)	C2b—O2bm—Hdaa^iii	136.23 (3)
Hcbb^ii—O2a—Hdbb^iii	58.30 (4)	C2b—O2bm—Hdba^iii	167.00 (3)
Hdab^iii—O2a—Hdbb^iii	33.14 (3)	C2b—O2bm—Hhbb^viii	81.58 (3)
Ho3a—O3a—O4a	84.6 (10)	H2ba—O2bm—C3b	41.39 (2)
Ho3a—O3a—Caa	147.6 (10)	H2ba—O2bm—H3ba	51.175
Ho3a—O3a—Haab	142.7 (11)	H2ba—O2bm—O1bm	59.678
Ho3a—O3a—Haaa	168.0 (11)	H2ba—O2bm—Hdaa^iii	122.684 (14)
Ho3a—O3a—Cba	111.5 (10)	H2ba—O2bm—Hdba^iii	157.368 (13)
Ho3a—O3a—O3am	16 (3)	H2ba—O2bm—Hhbb^viii	65.171 (15)
Ho3a—O3a—O4am	85.1 (10)	C3b—O2bm—H3ba	20.08 (2)
Ho3a—O3a—N3a	7.9 (11)	C3b—O2bm—O1bm	92.81 (3)
Ho3a—O3a—Hgaa^iv	107.3 (12)	C3b—O2bm—Hdaa^iii	117.48 (3)
O4a—O3a—Caa	63.49 (8)	C3b—O2bm—Hdba^iii	136.18 (3)
O4a—O3a—Haab	69.56 (7)	C3b—O2bm—Hhbb^viii	82.13 (2)
O4a—O3a—Haaa	84.71 (8)	H3ba—O2bm—O1bm	109.064
O4a—O3a—Cba	27.00 (9)	H3ba—O2bm—Hdaa^iii	97.408 (14)
O4a—O3a—O3am	100 (3)	H3ba—O2bm—Hdba^iii	119.114 (14)
O4a—O3a—O4am	1.91 (6)	H3ba—O2bm—Hhbb^viii	69.407 (14)
O4a—O3a—N3a	91.01 (10)	O1bm—O2bm—Hdaa^iii	134.094 (16)
O4a—O3a—Hgaa^iv	113.07 (10)	O1bm—O2bm—Hdba^iii	130.992 (15)
Caa—O3a—Haab	20.80 (4)	O1bm—O2bm—Hhbb^viii	96.245 (16)
Caa—O3a—Haaa	23.65 (3)	Hdaa^iii—O2bm—Hdba^iii	34.69 (2)
Caa—O3a—Cba	36.50 (8)	Hdaa^iii—O2bm—Hhbb^viii	58.54 (2)
Caa—O3a—O3am	163 (3)	Hdba^iii—O2bm—Hhbb^viii	92.55 (2)
Caa—O3a—O4am	62.74 (6)	O3b—O3bm—Ho3b	145 (3)
Caa—O3a—N3a	152.69 (10)	O3b—O3bm—O4b	61 (3)
Caa—O3a—Hgaa^iv	82.21 (7)	O3b—O3bm—H2ba^vii	124 (3)
Haab—O3a—Haaa	35.16 (3)	O3b—O3bm—H4ba^vii	75 (3)
Haab—O3a—Cba	45.31 (9)	O3b—O3bm—Cab	6 (3)
Haab—O3a—O3am	151 (3)	O3b—O3bm—Habb	28 (3)
Haab—O3a—O4am	68.21 (5)	O3b—O3bm—Haba	20 (3)
Haab—O3a—N3a	143.26 (9)	O3b—O3bm—Cbb	34 (3)
Haab—O3a—Hgaa^iv	62.57 (5)	O3b—O3bm—O4bm	61 (3)
Haaa—O3a—Cba	58.16 (9)	O3b—O3bm—N3b	149 (3)
Haaa—O3a—O3am	173 (2)	O3b—O3bm—Hgab^iv	97 (3)
Haaa—O3a—O4am	84.29 (6)	O3b—O3bm—Hgbb^iv	82 (3)
Haaa—O3a—N3a	175.66 (10)	Ho3b—O3bm—O4b	84.1 (10)
Haaa—O3a—Hgaa^iv	81.85 (7)	Ho3b—O3bm—H2ba^vii	90.3 (10)
Cba—O3a—O3am	127 (3)	Ho3b—O3bm—H4ba^vii	139.7 (10)
Cba—O3a—O4am	26.32 (7)	Ho3b—O3bm—Cab	145.6 (10)
Cba—O3a—N3a	117.64 (14)	Ho3b—O3bm—Habb	147.1 (9)
Cba—O3a—Hgaa^iv	101.49 (13)	Ho3b—O3bm—Haba	159.0 (11)
O3am—O3a—O4am	101 (3)	Ho3b—O3bm—Cbb	110.9 (10)
O3am—O3a—N3a	10 (2)	Ho3b—O3bm—O4bm	83.4 (10)
O3am—O3a—Hgaa^iv	100 (3)	Ho3b—O3bm—N3b	8.5 (11)
O4am—O3a—N3a	91.46 (8)	Ho3b—O3bm—Hgab^iv	110.1 (11)
O4am—O3a—Hgaa^iv	111.17 (8)	Ho3b—O3bm—Hgbb^iv	109.5 (11)
N3a—O3a—Hgaa^iv	100.58 (7)	O4b—O3bm—H2ba^vii	167.78 (5)
O3a—Ho3a—O4a	73.3 (9)	O4b—O3bm—H4ba^vii	135.79 (5)
O3a—Ho3a—Cba	42.0 (7)	O4b—O3bm—Cab	62.21 (6)
O3a—Ho3a—O3am	0.88 (14)	O4b—O3bm—Habb	75.08 (5)
O3a—Ho3a—O4am	73.0 (9)	O4b—O3bm—Haba	77.79 (5)
O3a—Ho3a—N3a	168.3 (17)	O4b—O3bm—Cbb	27.01 (7)
O3a—Ho3a—Cca	148.5 (15)	O4b—O3bm—O4bm	0.63 (5)
O3a—Ho3a—Hcba	129.1 (14)	O4b—O3bm—N3b	88.77 (6)
O3a—Ho3a—Hcaa	142.7 (13)	O4b—O3bm—Hgab^iv	137.87 (5)
O3a—Ho3a—Cfa	133.9 (14)	O4b—O3bm—Hgbb^iv	106.18 (5)
O3a—Ho3a—Hfaa	117.5 (14)	H2ba^vii—O3bm—H4ba^vii	49.577
O3a—Ho3a—Hfba	121.8 (13)	H2ba^vii—O3bm—Cab	124.13 (3)
O3a—Ho3a—Cga	160.3 (15)	H2ba^vii—O3bm—Habb	114.517
O3a—Ho3a—Hgaa	141.3 (15)	H2ba^vii—O3bm—Haba	105.437
O4a—Ho3a—Cba	31.3 (3)	H2ba^vii—O3bm—Cbb	157.38 (5)
O4a—Ho3a—O3am	74.2 (10)	H2ba^vii—O3bm—O4bm	167.41
O4a—Ho3a—O4am	1.77 (6)	H2ba^vii—O3bm—N3b	87.03 (3)
O4a—Ho3a—N3a	116.1 (9)	H2ba^vii—O3bm—Hgab^iv	54.335 (12)
O4a—Ho3a—Cca	95.8 (6)	H2ba^vii—O3bm—Hgbb^iv	85.910 (13)
O4a—Ho3a—Hcba	95.4 (6)	H4ba^vii—O3bm—Cab	74.61 (3)
O4a—Ho3a—Hcaa	77.6 (5)	H4ba^vii—O3bm—Habb	67.37
O4a—Ho3a—Cfa	149.5 (8)	H4ba^vii—O3bm—Haba	58.11
O4a—Ho3a—Hfaa	146.4 (8)	H4ba^vii—O3bm—Cbb	109.22 (5)
O4a—Ho3a—Hfba	163.6 (8)	H4ba^vii—O3bm—O4bm	136.404
O4a—Ho3a—Cga	107.0 (7)	H4ba^vii—O3bm—N3b	135.44 (3)
O4a—Ho3a—Hgaa	113.8 (7)	H4ba^vii—O3bm—Hgab^iv	48.102 (14)
Cba—Ho3a—O3am	42.9 (7)	H4ba^vii—O3bm—Hgbb^iv	70.207 (14)
Cba—Ho3a—O4am	30.9 (2)	Cab—O3bm—Habb	21.67 (3)
Cba—Ho3a—N3a	146.6 (10)	Cab—O3bm—Haba	22.61 (3)
Cba—Ho3a—Cca	121.3 (8)	Cab—O3bm—Cbb	35.21 (6)
Cba—Ho3a—Hcba	112.8 (7)	Cab—O3bm—O4bm	62.84 (3)
Cba—Ho3a—Hcaa	105.7 (7)	Cab—O3bm—N3b	147.97 (4)
Cba—Ho3a—Cfa	166.5 (10)	Cab—O3bm—Hgab^iv	92.56 (3)
Cba—Ho3a—Hfaa	145.0 (9)	Cab—O3bm—Hgbb^iv	76.33 (3)
Cba—Ho3a—Hfba	163.5 (9)	Habb—O3bm—Haba	35.364
Cba—Ho3a—Cga	136.3 (9)	Habb—O3bm—Cbb	50.09 (6)
Cba—Ho3a—Hgaa	136.0 (9)	Habb—O3bm—O4bm	75.685
O3am—Ho3a—O4am	73.9 (10)	Habb—O3bm—N3b	143.68 (2)
O3am—Ho3a—N3a	167.5 (17)	Habb—O3bm—Hgab^iv	72.516 (12)
O3am—Ho3a—Cca	148.6 (15)	Habb—O3bm—Hgbb^iv	54.787 (12)
O3am—Ho3a—Hcba	129.2 (15)	Haba—O3bm—Cbb	52.09 (5)
O3am—Ho3a—Hcaa	143.3 (13)	Haba—O3bm—O4bm	78.393
O3am—Ho3a—Cfa	133.0 (14)	Haba—O3bm—N3b	166.14 (3)
O3am—Ho3a—Hfaa	116.7 (14)	Haba—O3bm—Hgab^iv	90.556 (13)
O3am—Ho3a—Hfba	121.0 (13)	Haba—O3bm—Hgbb^iv	85.883 (13)
O3am—Ho3a—Cga	160.2 (16)	Cbb—O3bm—O4bm	27.64 (5)
O3am—Ho3a—Hgaa	141.1 (15)	Cbb—O3bm—N3b	115.05 (6)
O4am—Ho3a—N3a	116.2 (8)	Cbb—O3bm—Hgab^iv	120.78 (6)
O4am—Ho3a—Cca	95.2 (6)	Cbb—O3bm—Hgbb^iv	93.94 (5)
O4am—Ho3a—Hcba	94.3 (6)	O4bm—O3bm—N3b	88.16 (3)
O4am—Ho3a—Hcaa	77.2 (5)	O4bm—O3bm—Hgab^iv	138.186 (12)
O4am—Ho3a—Cfa	149.1 (8)	O4bm—O3bm—Hgbb^iv	106.451 (13)
O4am—Ho3a—Hfaa	144.9 (8)	N3b—O3bm—Hgab^iv	101.84 (3)
O4am—Ho3a—Hfba	164.5 (8)	N3b—O3bm—Hgbb^iv	101.32 (3)
O4am—Ho3a—Cga	107.9 (7)	Hgab^iv—O3bm—Hgbb^iv	31.951 (18)
O4am—Ho3a—Hgaa	115.1 (7)	O3b—O4bm—Ho3b	23.2 (4)
N3a—Ho3a—Cca	29.7 (3)	O3b—O4bm—O4b	35 (2)
N3a—Ho3a—Hcba	46.1 (4)	O3b—O4bm—H8bb^ix	137.05 (5)
N3a—Ho3a—Hcaa	41.6 (4)	O3b—O4bm—C9b	91.59 (5)
N3a—Ho3a—Cfa	35.2 (3)	O3b—O4bm—H9bb	100.10 (5)
N3a—Ho3a—Hfaa	50.8 (4)	O3b—O4bm—H9ba	104.81 (5)
N3a—Ho3a—Hfba	49.9 (4)	O3b—O4bm—Cab	59.94 (6)
N3a—Ho3a—Cga	27.6 (3)	O3b—O4bm—Habb	55.98 (5)
N3a—Ho3a—Hgaa	43.5 (4)	O3b—O4bm—Cbb	29.40 (7)
Cca—Ho3a—Hcba	20.38 (13)	O3b—O4bm—O3bm	1.01 (5)
Cca—Ho3a—Hcaa	19.36 (13)	O3b—O4bm—Hfaa	134.71 (5)
Cca—Ho3a—Cfa	53.9 (3)	O3b—O4bm—Hfba	147.92 (5)
Cca—Ho3a—Hfaa	57.6 (4)	O3b—O4bm—Hhba^iv	91.13 (5)
Cca—Ho3a—Hfba	74.2 (4)	Ho3b—O4bm—O4b	58 (3)
Cca—Ho3a—Cga	51.0 (3)	Ho3b—O4bm—H8bb^ix	136.2 (4)
Cca—Ho3a—Hgaa	70.2 (4)	Ho3b—O4bm—C9b	114.7 (4)
Hcba—Ho3a—Hcaa	32.3 (2)	Ho3b—O4bm—H9bb	122.7 (4)
Hcba—Ho3a—Cfa	57.9 (4)	Ho3b—O4bm—H9ba	126.3 (4)
Hcba—Ho3a—Hfaa	52.2 (3)	Ho3b—O4bm—Cab	83.0 (4)
Hcba—Ho3a—Hfba	79.7 (4)	Ho3b—O4bm—Habb	77.2 (4)
Hcba—Ho3a—Cga	70.6 (4)	Ho3b—O4bm—Cbb	52.5 (4)
Hcba—Ho3a—Hgaa	89.1 (5)	Ho3b—O4bm—O3bm	22.2 (4)
Hcaa—Ho3a—Cfa	71.9 (4)	Ho3b—O4bm—Hfaa	119.1 (4)
Hcaa—Ho3a—Hfaa	77.0 (4)	Ho3b—O4bm—Hfba	124.7 (4)
Hcaa—Ho3a—Hfba	90.6 (5)	Ho3b—O4bm—Hhba^iv	94.3 (4)
Hcaa—Ho3a—Cga	52.7 (3)	O4b—O4bm—H8bb^ix	125 (3)
Hcaa—Ho3a—Hgaa	72.5 (4)	O4b—O4bm—C9b	57 (2)
Cfa—Ho3a—Hfaa	21.91 (14)	O4b—O4bm—H9bb	67 (3)
Cfa—Ho3a—Hfba	21.80 (12)	O4b—O4bm—H9ba	71 (2)
Cfa—Ho3a—Cga	53.1 (3)	O4b—O4bm—Cab	25 (2)
Cfa—Ho3a—Hgaa	56.7 (3)	O4b—O4bm—Habb	25 (2)
Hfaa—Ho3a—Hfba	36.0 (2)	O4b—O4bm—Cbb	6 (2)
Hfaa—Ho3a—Cga	73.6 (4)	O4b—O4bm—O3bm	36 (2)
Hfaa—Ho3a—Hgaa	78.6 (4)	O4b—O4bm—Hfaa	140 (3)
Hfba—Ho3a—Cga	56.6 (3)	O4b—O4bm—Hfba	174 (3)
Hfba—Ho3a—Hgaa	51.0 (3)	O4b—O4bm—Hhba^iv	82 (3)
Cga—Ho3a—Hgaa	19.96 (12)	H8bb^ix—O4bm—C9b	85.39 (2)
O3a—O4a—Ho3a	22.1 (5)	H8bb^ix—O4bm—H9bb	67.147
O3a—O4a—C9a	90.03 (9)	H8bb^ix—O4bm—H9ba	85.932
O3a—O4a—H9aa	108.62 (10)	H8bb^ix—O4bm—Cab	109.37 (3)
O3a—O4a—Caa	60.78 (8)	H8bb^ix—O4bm—Habb	124.125
O3a—O4a—Haab	63.63 (8)	H8bb^ix—O4bm—Cbb	127.70 (5)
O3a—O4a—Cba	29.49 (9)	H8bb^ix—O4bm—O3bm	137.219
O3a—O4a—O3am	1.17 (5)	H8bb^ix—O4bm—Hfaa	85.764 (15)
O3a—O4a—O4am	105.4 (16)	H8bb^ix—O4bm—Hfba	57.424 (14)
O3a—O4a—Hdbb^v	148.67 (12)	H8bb^ix—O4bm—Hhba^iv	129.109 (15)
O3a—O4a—Hebb^vi	136.06 (10)	C9b—O4bm—H9bb	19.58 (2)
O3a—O4a—Hhab^v	105.73 (10)	C9b—O4bm—H9ba	20.03 (2)
Ho3a—O4a—C9a	112.0 (5)	C9b—O4bm—Cab	31.69 (3)
Ho3a—O4a—H9aa	130.8 (5)	C9b—O4bm—Habb	40.54 (2)
Ho3a—O4a—Caa	82.8 (5)	C9b—O4bm—Cbb	62.19 (5)
Ho3a—O4a—Haab	83.6 (5)	C9b—O4bm—O3bm	92.59 (2)
Ho3a—O4a—Cba	51.6 (5)	C9b—O4bm—Hfaa	109.26 (2)
Ho3a—O4a—O3am	21.0 (4)	C9b—O4bm—Hfba	120.15 (3)
Ho3a—O4a—O4am	111.0 (16)	C9b—O4bm—Hhba^iv	76.33 (3)
Ho3a—O4a—Hdbb^v	149.3 (5)	H9bb—O4bm—H9ba	32.51
Ho3a—O4a—Hebb^vi	114.2 (5)	H9bb—O4bm—Cab	44.29 (3)
Ho3a—O4a—Hhab^v	97.6 (5)	H9bb—O4bm—Habb	57.202
C9a—O4a—H9aa	19.63 (3)	H9bb—O4bm—Cbb	72.18 (5)
C9a—O4a—Caa	31.46 (4)	H9bb—O4bm—O3bm	101.079
C9a—O4a—Haab	41.95 (4)	H9bb—O4bm—Hfaa	112.960 (13)
C9a—O4a—Cba	61.14 (10)	H9bb—O4bm—Hfba	111.520 (14)
C9a—O4a—O3am	91.20 (8)	H9bb—O4bm—Hhba^iv	93.833 (14)
C9a—O4a—O4am	79.0 (16)	H9ba—O4bm—Cab	46.74 (2)
C9a—O4a—Hdbb^v	82.79 (5)	H9ba—O4bm—Habb	49.107
C9a—O4a—Hebb^vi	131.41 (8)	H9ba—O4bm—Cbb	76.33 (5)
C9a—O4a—Hhab^v	114.50 (8)	H9ba—O4bm—O3bm	105.759
H9aa—O4a—Caa	48.15 (5)	H9ba—O4bm—Hfaa	89.368 (13)
H9aa—O4a—Haab	52.28 (4)	H9ba—O4bm—Hfba	104.788 (13)
H9aa—O4a—Cba	79.21 (11)	H9ba—O4bm—Hhba^iv	61.846 (13)
H9aa—O4a—O3am	109.79 (9)	Cab—O4bm—Habb	16.52 (3)
H9aa—O4a—O4am	68.6 (15)	Cab—O4bm—Cbb	30.55 (5)
H9aa—O4a—Hdbb^v	63.64 (4)	Cab—O4bm—O3bm	60.94 (2)
H9aa—O4a—Hebb^vi	114.55 (7)	Cab—O4bm—Hfaa	129.73 (3)
H9aa—O4a—Hhab^v	102.23 (7)	Cab—O4bm—Hfba	151.35 (3)
Caa—O4a—Haab	19.40 (3)	Cab—O4bm—Hhba^iv	77.36 (3)
Caa—O4a—Cba	31.30 (8)	Habb—O4bm—Cbb	29.58 (5)
Caa—O4a—O3am	61.95 (6)	Habb—O4bm—O3bm	56.886
Caa—O4a—O4am	78.1 (17)	Habb—O4bm—Hfaa	118.950 (15)
Caa—O4a—Hdbb^v	102.57 (7)	Habb—O4bm—Hfba	149.376 (14)
Caa—O4a—Hebb^vi	162.64 (9)	Habb—O4bm—Hhba^iv	62.894 (16)
Caa—O4a—Hhab^v	109.08 (9)	Cbb—O4bm—O3bm	30.40 (5)
Haab—O4a—Cba	37.51 (9)	Cbb—O4bm—Hfaa	141.39 (5)
Haab—O4a—O3am	64.66 (6)	Cbb—O4bm—Hfba	174.87 (5)
Haab—O4a—O4am	60.3 (17)	Cbb—O4bm—Hhba^iv	84.06 (5)
Haab—O4a—Hdbb^v	91.98 (6)	O3bm—O4bm—Hfaa	134.129 (15)
Haab—O4a—Hebb^vi	156.39 (8)	O3bm—O4bm—Hfba	146.911 (14)
Haab—O4a—Hhab^v	89.74 (7)	O3bm—O4bm—Hhba^iv	91.277 (15)
Cba—O4a—O3am	30.66 (7)	Hfaa—O4bm—Hfba	34.35 (2)
Cba—O4a—O4am	92.9 (17)	Hfaa—O4bm—Hhba^iv	57.82 (2)
Cba—O4a—Hdbb^v	129.46 (14)	Hfba—O4bm—Hhba^iv	92.05 (2)
Cba—O4a—Hebb^vi	165.07 (14)	O1b^xi—N1a—Ho1b^xi	6.7 (5)
Cba—O4a—Hhab^v	110.76 (15)	O1b^xi—N1a—O1bm^xi	0.34 (4)
O3am—O4a—O4am	105.8 (16)	O1b^xi—N1a—N2a	163.73 (6)
O3am—O4a—Hdbb^v	149.04 (10)	O1b^xi—N1a—N3a	133.80 (5)
O3am—O4a—Hebb^vi	134.92 (9)	O1b^xi—N1a—N4a	131.52 (7)
O3am—O4a—Hhab^v	105.32 (9)	O1b^xi—N1a—Cca	101.61 (7)
O4am—O4a—Hdbb^v	43.3 (15)	O1b^xi—N1a—Hcba	94.59 (5)
O4am—O4a—Hebb^vi	97.6 (17)	O1b^xi—N1a—Hcaa	81.39 (5)
O4am—O4a—Hhab^v	35.6 (16)	O1b^xi—N1a—Cda	99.25 (8)
Hdbb^v—O4a—Hebb^vi	64.71 (5)	O1b^xi—N1a—Hdaa	79.14 (6)
Hdbb^v—O4a—Hhab^v	51.82 (4)	O1b^xi—N1a—Hdba	91.91 (6)
Hebb^vi—O4a—Hhab^v	73.22 (6)	O1b^xi—N1a—Cea	129.88 (8)
O1a—C1a—Ho1a	28.7 (5)	O1b^xi—N1a—Heaa	112.68 (5)
O1a—C1a—O2a	122.88 (15)	O1b^xi—N1a—Heba	114.01 (6)
O1a—C1a—C2a	113.28 (13)	O1b^xi—N1a—Cfa	156.68 (6)
O1a—C1a—H2aa	109.88 (12)	O1b^xi—N1a—Cga	131.55 (6)
O1a—C1a—H2ab	89.05 (11)	O1b^xi—N1a—Cha	153.34 (6)
O1a—C1a—C3a	140.19 (12)	Ho1b^xi—N1a—O1bm^xi	6.6 (5)
O1a—C1a—H3ab	131.85 (11)	Ho1b^xi—N1a—N2a	157.2 (5)
O1a—C1a—H3aa	161.42 (11)	Ho1b^xi—N1a—N3a	138.0 (5)
O1a—C1a—O1am	1.00 (9)	Ho1b^xi—N1a—N4a	136.7 (5)
O1a—C1a—O2am	122.00 (12)	Ho1b^xi—N1a—Cca	104.7 (5)
Ho1a—C1a—O2a	94.2 (5)	Ho1b^xi—N1a—Hcba	94.7 (5)
Ho1a—C1a—C2a	141.9 (5)	Ho1b^xi—N1a—Hcaa	86.2 (5)
Ho1a—C1a—H2aa	132.8 (5)	Ho1b^xi—N1a—Cda	103.6 (5)
Ho1a—C1a—H2ab	117.4 (5)	Ho1b^xi—N1a—Hdaa	84.9 (5)
Ho1a—C1a—C3a	164.0 (5)	Ho1b^xi—N1a—Hdba	93.5 (5)
Ho1a—C1a—H3ab	145.3 (5)	Ho1b^xi—N1a—Cea	123.3 (5)
Ho1a—C1a—H3aa	168.3 (5)	Ho1b^xi—N1a—Heaa	107.1 (5)
Ho1a—C1a—O1am	29.6 (5)	Ho1b^xi—N1a—Heba	107.7 (5)
Ho1a—C1a—O2am	93.3 (5)	Ho1b^xi—N1a—Cfa	155.9 (5)
O2a—C1a—C2a	123.79 (13)	Ho1b^xi—N1a—Cga	138.2 (5)
O2a—C1a—H2aa	119.16 (11)	Ho1b^xi—N1a—Cha	154.1 (5)
O2a—C1a—H2ab	146.83 (13)	O1bm^xi—N1a—N2a	163.56 (4)
O2a—C1a—C3a	94.77 (11)	O1bm^xi—N1a—N3a	134.11 (4)
O2a—C1a—H3ab	92.59 (12)	O1bm^xi—N1a—N4a	131.39 (4)
O2a—C1a—H3aa	75.09 (10)	O1bm^xi—N1a—Cca	101.95 (5)
O2a—C1a—O1am	123.75 (12)	O1bm^xi—N1a—Hcba	94.92 (3)
O2a—C1a—O2am	1.14 (10)	O1bm^xi—N1a—Hcaa	81.68 (3)
C2a—C1a—H2aa	27.51 (5)	O1bm^xi—N1a—Cda	99.07 (6)
C2a—C1a—H2ab	26.83 (5)	O1bm^xi—N1a—Hdaa	79.05 (3)
C2a—C1a—C3a	32.66 (6)	O1bm^xi—N1a—Hdba	91.62 (3)
C2a—C1a—H3ab	46.51 (6)	O1bm^xi—N1a—Cea	129.74 (6)
C2a—C1a—H3aa	49.26 (6)	O1bm^xi—N1a—Heaa	112.43 (3)
C2a—C1a—O1am	112.43 (10)	O1bm^xi—N1a—Heba	114.03 (4)
C2a—C1a—O2am	124.64 (10)	O1bm^xi—N1a—Cfa	157.01 (4)
H2aa—C1a—H2ab	45.47 (2)	O1bm^xi—N1a—Cga	131.67 (4)
H2aa—C1a—C3a	51.52 (4)	O1bm^xi—N1a—Cha	153.04 (4)
H2aa—C1a—H3ab	70.38 (3)	N2a—N1a—N3a	59.95 (4)
H2aa—C1a—H3aa	58.38 (3)	N2a—N1a—N4a	60.03 (5)
H2aa—C1a—O1am	109.39 (8)	N2a—N1a—Cca	89.07 (6)
H2aa—C1a—O2am	119.47 (7)	N2a—N1a—Hcba	89.30 (4)
H2ab—C1a—C3a	52.15 (4)	N2a—N1a—Hcaa	112.34 (4)
H2ab—C1a—H3ab	55.87 (3)	N2a—N1a—Cda	88.77 (6)
H2ab—C1a—H3aa	72.48 (3)	N2a—N1a—Hdaa	112.56 (5)
H2ab—C1a—O1am	88.11 (6)	N2a—N1a—Hdba	88.72 (4)
H2ab—C1a—O2am	147.88 (9)	N2a—N1a—Cea	33.91 (6)
C3a—C1a—H3ab	20.93 (3)	N2a—N1a—Heaa	52.32 (4)
C3a—C1a—H3aa	21.37 (3)	N2a—N1a—Heba	52.30 (4)
C3a—C1a—O1am	139.20 (7)	N2a—N1a—Cfa	31.07 (4)
C3a—C1a—O2am	95.80 (7)	N2a—N1a—Cga	64.62 (4)
H3ab—C1a—H3aa	33.851 (14)	N2a—N1a—Cha	31.30 (4)
H3ab—C1a—O1am	130.91 (6)	N3a—N1a—N4a	59.80 (4)
H3ab—C1a—O2am	93.72 (7)	N3a—N1a—Cca	34.34 (5)
H3aa—C1a—O1am	160.44 (7)	N3a—N1a—Hcba	53.03 (4)
H3aa—C1a—O2am	76.03 (6)	N3a—N1a—Hcaa	52.58 (4)
O1am—C1a—O2am	122.88 (8)	N3a—N1a—Cda	88.80 (6)
O1a—C2a—O2a	55.68 (7)	N3a—N1a—Hdaa	89.40 (5)
O1a—C2a—C1a	30.85 (7)	N3a—N1a—Hdba	112.36 (5)
O1a—C2a—H2aa	103.75 (10)	N3a—N1a—Cea	88.72 (6)
O1a—C2a—H2ab	80.57 (8)	N3a—N1a—Heaa	112.14 (4)
O1a—C2a—C3a	140.44 (10)	N3a—N1a—Heba	89.01 (5)
O1a—C2a—H3ab	118.14 (7)	N3a—N1a—Cfa	31.65 (4)
O1a—C2a—H3aa	128.00 (8)	N3a—N1a—Cga	31.42 (4)
O1a—C2a—C4a	168.99 (8)	N3a—N1a—Cha	64.18 (4)
O1a—C2a—H4ab	151.59 (7)	N4a—N1a—Cca	89.04 (6)
O1a—C2a—H4aa	169.42 (8)	N4a—N1a—Hcba	112.65 (4)
O1a—C2a—O1am	0.85 (5)	N4a—N1a—Hcaa	88.90 (4)
O1a—C2a—O2am	55.45 (6)	N4a—N1a—Cda	33.95 (6)
O2a—C2a—C1a	24.84 (7)	N4a—N1a—Hdaa	52.75 (4)
O2a—C2a—H2aa	104.94 (9)	N4a—N1a—Hdba	52.69 (4)
O2a—C2a—H2ab	130.36 (9)	N4a—N1a—Cea	88.98 (6)
O2a—C2a—C3a	93.23 (9)	N4a—N1a—Heaa	88.56 (4)
O2a—C2a—H3ab	87.33 (7)	N4a—N1a—Heba	112.16 (4)
O2a—C2a—H3aa	73.00 (6)	N4a—N1a—Cfa	64.33 (4)
O2a—C2a—C4a	125.30 (8)	N4a—N1a—Cga	31.27 (4)
O2a—C2a—H4ab	143.21 (7)	N4a—N1a—Cha	31.46 (4)
O2a—C2a—H4aa	126.15 (6)	Cca—N1a—Hcba	27.41 (6)
O2a—C2a—O1am	56.48 (5)	Cca—N1a—Hcaa	27.25 (6)
O2a—C2a—O2am	0.44 (5)	Cca—N1a—Cda	108.43 (8)
C1a—C2a—H2aa	106.92 (10)	Cca—N1a—Hdaa	94.47 (7)
C1a—C2a—H2ab	108.32 (9)	Cca—N1a—Hdba	135.99 (7)
C1a—C2a—C3a	114.98 (11)	Cca—N1a—Cea	108.04 (8)
C1a—C2a—H3ab	101.69 (8)	Cca—N1a—Heaa	135.68 (7)
C1a—C2a—H3aa	97.47 (8)	Cca—N1a—Heba	94.03 (7)
C1a—C2a—C4a	148.86 (10)	Cca—N1a—Cfa	58.00 (6)
C1a—C2a—H4ab	160.25 (9)	Cca—N1a—Cga	57.78 (6)
C1a—C2a—H4aa	150.22 (8)	Cca—N1a—Cha	98.52 (6)
C1a—C2a—O1am	31.65 (5)	Hcba—N1a—Hcaa	46.91 (3)
C1a—C2a—O2am	24.62 (5)	Hcba—N1a—Cda	135.83 (7)
H2aa—C2a—H2ab	107.53 (12)	Hcba—N1a—Hdaa	119.48 (4)
H2aa—C2a—C3a	108.06 (9)	Hcba—N1a—Hdba	163.34 (5)
H2aa—C2a—H3ab	135.15 (9)	Hcba—N1a—Cea	93.87 (6)
H2aa—C2a—H3aa	96.31 (7)	Hcba—N1a—Heaa	119.41 (5)
H2aa—C2a—C4a	86.74 (7)	Hcba—N1a—Heba	72.63 (4)
H2aa—C2a—H4ab	91.36 (7)	Hcba—N1a—Cfa	62.09 (4)
H2aa—C2a—H4aa	65.70 (6)	Hcba—N1a—Cga	82.28 (4)
H2aa—C2a—O1am	103.91 (8)	Hcba—N1a—Cha	111.14 (4)
H2aa—C2a—O2am	104.59 (8)	Hcaa—N1a—Cda	94.08 (6)
H2ab—C2a—C3a	110.71 (10)	Hcaa—N1a—Hdaa	72.81 (4)
H2ab—C2a—H3ab	95.00 (8)	Hcaa—N1a—Hdba	119.44 (5)
H2ab—C2a—H3aa	137.22 (10)	Hcaa—N1a—Cea	135.28 (7)
H2ab—C2a—C4a	93.23 (8)	Hcaa—N1a—Heaa	162.81 (5)
H2ab—C2a—H4ab	71.90 (6)	Hcaa—N1a—Heba	119.15 (5)
H2ab—C2a—H4aa	101.30 (7)	Hcaa—N1a—Cfa	82.14 (4)
H2ab—C2a—O1am	79.73 (6)	Hcaa—N1a—Cga	61.38 (4)
H2ab—C2a—O2am	130.36 (8)	Hcaa—N1a—Cha	110.80 (4)
C3a—C2a—H3ab	27.20 (5)	Cda—N1a—Hdaa	27.43 (5)
C3a—C2a—H3aa	26.61 (5)	Cda—N1a—Hdba	27.58 (5)
C3a—C2a—C4a	34.24 (6)	Cda—N1a—Cea	108.12 (8)
C3a—C2a—H4ab	50.07 (5)	Cda—N1a—Heaa	93.27 (6)
C3a—C2a—H4aa	48.78 (5)	Cda—N1a—Heba	135.07 (6)
C3a—C2a—O1am	140.81 (8)	Cda—N1a—Cfa	98.28 (6)
C3a—C2a—O2am	93.61 (7)	Cda—N1a—Cga	57.38 (6)
H3ab—C2a—H3aa	45.58 (3)	Cda—N1a—Cha	57.47 (6)
H3ab—C2a—C4a	52.98 (4)	Hdaa—N1a—Hdba	47.00 (3)
H3ab—C2a—H4ab	59.05 (3)	Hdaa—N1a—Cea	135.55 (7)
H3ab—C2a—H4aa	72.23 (3)	Hdaa—N1a—Heaa	118.27 (4)
H3ab—C2a—O1am	118.23 (5)	Hdaa—N1a—Heba	162.48 (4)
H3ab—C2a—O2am	87.77 (5)	Hdaa—N1a—Cfa	111.38 (4)
H3aa—C2a—C4a	52.48 (4)	Hdaa—N1a—Cga	61.71 (4)
H3aa—C2a—H4ab	72.57 (3)	Hdaa—N1a—Cha	82.05 (4)
H3aa—C2a—H4aa	56.93 (3)	Hdba—N1a—Cea	93.69 (6)
H3aa—C2a—O1am	128.74 (6)	Hdba—N1a—Heaa	71.56 (4)
H3aa—C2a—O2am	73.29 (4)	Hdba—N1a—Heba	118.35 (4)
C4a—C2a—H4ab	21.42 (3)	Hdba—N1a—Cfa	110.59 (4)
C4a—C2a—H4aa	21.17 (3)	Hdba—N1a—Cga	81.93 (4)
C4a—C2a—O1am	168.57 (6)	Hdba—N1a—Cha	61.43 (4)
C4a—C2a—O2am	125.61 (6)	Cea—N1a—Heaa	27.67 (5)
H4ab—C2a—H4aa	34.215 (13)	Cea—N1a—Heba	26.96 (6)
H4ab—C2a—O1am	150.79 (5)	Cea—N1a—Cfa	57.08 (6)
H4ab—C2a—O2am	143.60 (6)	Cea—N1a—Cga	98.53 (6)
H4aa—C2a—O1am	169.47 (6)	Cea—N1a—Cha	57.52 (6)
H4aa—C2a—O2am	126.29 (5)	Heaa—N1a—Heba	47.09 (3)
O1am—C2a—O2am	56.25 (2)	Heaa—N1a—Cfa	81.45 (4)
O2a—C3a—C1a	24.55 (5)	Heaa—N1a—Cga	110.62 (4)
O2a—C3a—C2a	55.43 (7)	Heaa—N1a—Cha	61.07 (4)
O2a—C3a—H2aa	66.58 (5)	Heba—N1a—Cfa	61.22 (4)
O2a—C3a—H2ab	75.29 (5)	Heba—N1a—Cga	110.99 (4)
O2a—C3a—H3ab	91.10 (8)	Heba—N1a—Cha	81.55 (4)
O2a—C3a—H3aa	66.57 (7)	Cfa—N1a—Cga	50.24 (4)
O2a—C3a—C4a	158.96 (9)	Cfa—N1a—Cha	49.55 (4)
O2a—C3a—H4ab	150.52 (7)	Cga—N1a—Cha	49.95 (4)
O2a—C3a—H4aa	132.45 (6)	N1a—N2a—N3a	60.02 (4)
O2a—C3a—C5a	157.53 (7)	N1a—N2a—N4a	59.87 (4)
O2a—C3a—H5ab	151.65 (7)	N1a—N2a—Cca	31.40 (3)
O2a—C3a—H5aa	136.41 (6)	N1a—N2a—Cda	31.38 (3)
O2a—C3a—O2am	0.21 (4)	N1a—N2a—Cea	34.23 (6)
C1a—C3a—C2a	32.36 (6)	N1a—N2a—Heaa	53.04 (4)
C1a—C3a—H2aa	50.64 (4)	N1a—N2a—Heba	52.60 (4)
C1a—C3a—H2ab	50.77 (4)	N1a—N2a—Cfa	89.19 (7)
C1a—C3a—H3ab	93.60 (7)	N1a—N2a—Hfaa	89.08 (5)
C1a—C3a—H3aa	89.07 (7)	N1a—N2a—Hfba	112.91 (5)
C1a—C3a—C4a	143.75 (9)	N1a—N2a—Cga	64.15 (4)
C1a—C3a—H4ab	126.20 (6)	N1a—N2a—Cha	88.61 (8)
C1a—C3a—H4aa	124.68 (6)	N1a—N2a—Hhba	112.70 (6)
C1a—C3a—C5a	176.05 (7)	N1a—N2a—Hhaa	89.12 (5)
C1a—C3a—H5ab	162.30 (5)	N1a—N2a—Hcab	127.88 (6)
C1a—C3a—H5aa	159.46 (5)	N1a—N2a—Hdab	122.44 (5)
C1a—C3a—O2am	24.54 (3)	N3a—N2a—N4a	59.78 (5)
C2a—C3a—H2aa	26.96 (5)	N3a—N2a—Cca	31.48 (4)
C2a—C3a—H2ab	25.86 (5)	N3a—N2a—Cda	64.41 (5)
C2a—C3a—H3ab	108.95 (9)	N3a—N2a—Cea	89.07 (7)
C2a—C3a—H3aa	110.09 (10)	N3a—N2a—Heaa	112.93 (6)
C2a—C3a—C4a	111.70 (10)	N3a—N2a—Heba	89.25 (5)
C2a—C3a—H4ab	95.22 (8)	N3a—N2a—Cfa	34.32 (7)
C2a—C3a—H4aa	97.49 (8)	N3a—N2a—Hfaa	52.97 (5)
C2a—C3a—C5a	144.15 (9)	N3a—N2a—Hfba	53.04 (4)
C2a—C3a—H5ab	149.11 (8)	N3a—N2a—Cga	31.29 (4)
C2a—C3a—H5aa	154.23 (8)	N3a—N2a—Cha	88.47 (8)
C2a—C3a—O2am	55.36 (6)	N3a—N2a—Hhba	89.01 (6)
H2aa—C3a—H2ab	44.71 (3)	N3a—N2a—Hhaa	112.24 (7)
H2aa—C3a—H3ab	135.79 (9)	N3a—N2a—Hcab	128.26 (6)
H2aa—C3a—H3aa	97.99 (8)	N3a—N2a—Hdab	176.34 (6)
H2aa—C3a—C4a	94.76 (8)	N4a—N2a—Cca	64.35 (5)
H2aa—C3a—H4ab	88.42 (5)	N4a—N2a—Cda	31.32 (4)
H2aa—C3a—H4aa	74.28 (4)	N4a—N2a—Cea	89.10 (8)
H2aa—C3a—C5a	125.41 (6)	N4a—N2a—Heaa	88.89 (6)
H2aa—C3a—H5ab	141.63 (5)	N4a—N2a—Heba	112.29 (6)
H2aa—C3a—H5aa	128.11 (5)	N4a—N2a—Cfa	89.00 (8)
H2aa—C3a—O2am	66.43 (3)	N4a—N2a—Hfaa	112.59 (6)
H2ab—C3a—H3ab	94.17 (7)	N4a—N2a—Hfba	88.96 (6)
H2ab—C3a—H3aa	135.85 (9)	N4a—N2a—Cga	31.13 (4)
H2ab—C3a—C4a	98.68 (8)	N4a—N2a—Cha	33.80 (6)
H2ab—C3a—H4ab	75.89 (4)	N4a—N2a—Hhba	53.01 (5)
H2ab—C3a—H4aa	95.42 (5)	N4a—N2a—Hhaa	52.67 (5)
H2ab—C3a—C5a	127.02 (6)	N4a—N2a—Hcab	170.08 (6)
H2ab—C3a—H5ab	124.46 (5)	N4a—N2a—Hdab	118.50 (6)
H2ab—C3a—H5aa	146.73 (5)	Cca—N2a—Cda	50.00 (4)
H2ab—C3a—O2am	75.29 (3)	Cca—N2a—Cea	57.60 (6)
H3ab—C3a—H3aa	107.58 (12)	Cca—N2a—Heaa	82.44 (5)
H3ab—C3a—C4a	109.58 (10)	Cca—N2a—Heba	61.55 (4)
H3ab—C3a—H4ab	97.04 (7)	Cca—N2a—Cfa	57.79 (6)
H3ab—C3a—H4aa	136.41 (9)	Cca—N2a—Hfaa	61.60 (4)
H3ab—C3a—C5a	89.81 (7)	Cca—N2a—Hfba	82.45 (5)
H3ab—C3a—H5ab	69.06 (6)	Cca—N2a—Cga	49.81 (4)
H3ab—C3a—H5aa	94.72 (7)	Cca—N2a—Cha	98.15 (8)
H3ab—C3a—O2am	91.31 (7)	Cca—N2a—Hhba	111.23 (6)
H3aa—C3a—C4a	108.85 (9)	Cca—N2a—Hhaa	111.05 (6)
H3aa—C3a—H4ab	135.67 (8)	Cca—N2a—Hcab	125.57 (6)
H3aa—C3a—H4aa	94.33 (7)	Cca—N2a—Hdab	151.71 (5)
H3aa—C3a—C5a	91.80 (7)	Cda—N2a—Cea	57.78 (7)
H3aa—C3a—H5ab	99.36 (8)	Cda—N2a—Heaa	61.55 (5)
H3aa—C3a—H5aa	70.51 (6)	Cda—N2a—Heba	81.87 (5)
H3aa—C3a—O2am	66.49 (6)	Cda—N2a—Cfa	98.73 (8)
C4a—C3a—H4ab	26.87 (5)	Cda—N2a—Hfaa	111.15 (5)
C4a—C3a—H4aa	26.85 (5)	Cda—N2a—Hfba	111.19 (6)
C4a—C3a—C5a	32.54 (6)	Cda—N2a—Cga	49.68 (4)
C4a—C3a—H5ab	47.17 (6)	Cda—N2a—Cha	57.23 (7)
C4a—C3a—H5aa	48.23 (6)	Cda—N2a—Hhba	82.22 (6)
C4a—C3a—O2am	158.76 (8)	Cda—N2a—Hhaa	61.55 (5)
H4ab—C3a—H4aa	45.30 (2)	Cda—N2a—Hcab	153.12 (6)
H4ab—C3a—C5a	51.23 (4)	Cda—N2a—Hdab	116.04 (5)
H4ab—C3a—H5ab	55.77 (3)	Cea—N2a—Heaa	28.09 (5)
H4ab—C3a—H5aa	71.23 (3)	Cea—N2a—Heba	27.03 (6)
H4ab—C3a—O2am	150.47 (6)	Cea—N2a—Cfa	108.38 (9)
H4aa—C3a—C5a	51.41 (4)	Cea—N2a—Hfaa	93.66 (8)
H4aa—C3a—H5ab	70.51 (3)	Cea—N2a—Hfba	136.14 (8)
H4aa—C3a—H5aa	57.26 (3)	Cea—N2a—Cga	98.38 (8)
H4aa—C3a—O2am	132.24 (5)	Cea—N2a—Cha	108.29 (11)
C5a—C3a—H5ab	20.81 (3)	Cea—N2a—Hhba	136.11 (10)
C5a—C3a—H5aa	21.34 (3)	Cea—N2a—Hhaa	94.30 (8)
C5a—C3a—O2am	157.51 (6)	Cea—N2a—Hcab	96.50 (8)
H5ab—C3a—H5aa	33.833 (14)	Cea—N2a—Hdab	94.16 (7)
H5ab—C3a—O2am	151.79 (5)	Heaa—N2a—Heba	47.43 (4)
H5aa—C3a—O2am	136.37 (4)	Heaa—N2a—Cfa	136.44 (9)
C2a—C4a—H2aa	21.54 (3)	Heaa—N2a—Hfaa	119.49 (7)
C2a—C4a—H2ab	20.50 (3)	Heaa—N2a—Hfba	164.13 (6)
C2a—C4a—C3a	34.06 (6)	Heaa—N2a—Cga	110.82 (6)
C2a—C4a—H3ab	52.47 (4)	Heaa—N2a—Cha	93.46 (8)
C2a—C4a—H3aa	52.78 (4)	Heaa—N2a—Hhba	118.69 (7)
C2a—C4a—H4ab	87.21 (7)	Heaa—N2a—Hhaa	71.98 (5)
C2a—C4a—H4aa	90.50 (8)	Heaa—N2a—Hcab	92.21 (5)
C2a—C4a—C5a	148.66 (9)	Heaa—N2a—Hdab	69.76 (4)
C2a—C4a—H5ab	129.28 (6)	Heba—N2a—Cfa	94.22 (8)
C2a—C4a—H5aa	130.18 (6)	Heba—N2a—Hfaa	72.32 (5)
C2a—C4a—C6a	177.39 (7)	Heba—N2a—Hfba	119.76 (6)
C2a—C4a—H6ab	156.49 (6)	Heba—N2a—Cga	110.82 (5)
C2a—C4a—H6aa	157.85 (6)	Heba—N2a—Cha	135.30 (9)
H2aa—C4a—H2ab	33.605 (14)	Heba—N2a—Hhba	163.10 (8)
H2aa—C4a—C3a	50.21 (6)	Heba—N2a—Hhaa	119.07 (6)
H2aa—C4a—H3ab	72.83 (3)	Heba—N2a—Hcab	75.31 (5)
H2aa—C4a—H3aa	59.38 (3)	Heba—N2a—Hdab	94.41 (5)
H2aa—C4a—H4ab	91.82 (8)	Cfa—N2a—Hfaa	27.66 (7)
H2aa—C4a—H4aa	69.09 (6)	Cfa—N2a—Hfba	27.78 (6)
H2aa—C4a—C5a	158.58 (8)	Cfa—N2a—Cga	57.87 (8)
H2aa—C4a—H5ab	149.68 (5)	Cfa—N2a—Cha	108.03 (11)
H2aa—C4a—H5aa	131.98 (5)	Cfa—N2a—Hhba	93.79 (8)
H2aa—C4a—C6a	156.96 (6)	Cfa—N2a—Hhaa	135.46 (10)
H2aa—C4a—H6ab	149.98 (5)	Cfa—N2a—Hcab	96.95 (9)
H2aa—C4a—H6aa	136.33 (5)	Cfa—N2a—Hdab	145.01 (9)
H2ab—C4a—C3a	48.02 (6)	Hfaa—N2a—Hfba	47.74 (4)
H2ab—C4a—H3ab	56.49 (2)	Hfaa—N2a—Cga	82.32 (5)
H2ab—C4a—H3aa	71.32 (3)	Hfaa—N2a—Cha	135.66 (9)
H2ab—C4a—H4ab	66.81 (6)	Hfaa—N2a—Hhba	119.16 (6)
H2ab—C4a—H4aa	98.49 (8)	Hfaa—N2a—Hhaa	163.06 (8)
H2ab—C4a—C5a	151.97 (8)	Hfaa—N2a—Hcab	75.32 (5)
H2ab—C4a—H5ab	125.63 (5)	Hfaa—N2a—Hdab	128.35 (7)
H2ab—C4a—H5aa	146.33 (5)	Hfba—N2a—Cga	61.90 (5)
H2ab—C4a—C6a	157.75 (6)	Hfba—N2a—Cha	93.48 (8)
H2ab—C4a—H6ab	136.26 (4)	Hfba—N2a—Hhba	71.72 (5)
H2ab—C4a—H6aa	155.81 (5)	Hfba—N2a—Hhaa	118.37 (7)
C3a—C4a—H3ab	26.88 (5)	Hfba—N2a—Hcab	92.61 (5)
C3a—C4a—H3aa	26.95 (5)	Hfba—N2a—Hdab	124.64 (5)
C3a—C4a—H4ab	107.89 (9)	Cga—N2a—Cha	57.19 (7)
C3a—C4a—H4aa	108.40 (10)	Cga—N2a—Hhba	61.83 (5)
C3a—C4a—C5a	114.71 (10)	Cga—N2a—Hhaa	81.74 (6)
C3a—C4a—H5ab	99.86 (8)	Cga—N2a—Hcab	153.82 (6)
C3a—C4a—H5aa	98.49 (8)	Cga—N2a—Hdab	146.01 (6)
C3a—C4a—C6a	148.53 (9)	Cha—N2a—Hhba	27.83 (6)
C3a—C4a—H6ab	156.78 (8)	Cha—N2a—Hhaa	27.44 (6)
C3a—C4a—H6aa	153.48 (8)	Cha—N2a—Hcab	136.28 (8)
H3ab—C4a—H3aa	45.51 (2)	Cha—N2a—Hdab	88.89 (7)
H3ab—C4a—H4ab	95.49 (7)	Hhba—N2a—Hhaa	46.96 (4)
H3ab—C4a—H4aa	135.25 (9)	Hhba—N2a—Hcab	118.38 (5)
H3ab—C4a—C5a	98.11 (8)	Hhba—N2a—Hdab	87.47 (4)
H3ab—C4a—H5ab	77.01 (4)	Hhaa—N2a—Hcab	118.49 (5)
H3ab—C4a—H5aa	92.40 (5)	Hhaa—N2a—Hdab	65.85 (4)
H3ab—C4a—C6a	129.62 (6)	Hcab—N2a—Hdab	53.08 (3)
H3ab—C4a—H6ab	130.29 (5)	O3a—N3a—Ho3a	3.8 (6)
H3ab—C4a—H6aa	146.95 (6)	O3a—N3a—O3am	0.18 (4)
H3aa—C4a—H4ab	134.80 (8)	O3a—N3a—N1a	145.67 (7)
H3aa—C4a—H4aa	93.86 (7)	O3a—N3a—N2a	130.67 (8)
H3aa—C4a—C5a	100.24 (8)	O3a—N3a—N4a	153.38 (8)
H3aa—C4a—H5ab	96.65 (5)	O3a—N3a—Cca	113.28 (9)
H3aa—C4a—H5aa	77.48 (4)	O3a—N3a—Hcba	92.97 (7)
H3aa—C4a—C6a	129.63 (6)	O3a—N3a—Hcaa	103.85 (6)
H3aa—C4a—H6ab	149.39 (6)	O3a—N3a—Cda	164.34 (7)
H3aa—C4a—H6aa	127.08 (5)	O3a—N3a—Cea	139.20 (8)
H4ab—C4a—H4aa	108.18 (12)	O3a—N3a—Cfa	97.08 (9)
H4ab—C4a—C5a	108.60 (10)	O3a—N3a—Hfaa	81.84 (7)
H4ab—C4a—H5ab	94.12 (8)	O3a—N3a—Hfba	84.86 (6)
H4ab—C4a—H5aa	135.68 (9)	O3a—N3a—Cga	120.85 (9)
H4ab—C4a—C6a	90.94 (7)	O3a—N3a—Hgaa	100.70 (7)
H4ab—C4a—H6ab	69.46 (6)	O3a—N3a—Hgba	109.13 (7)
H4ab—C4a—H6aa	98.00 (7)	O3a—N3a—Cha	144.70 (7)
H4aa—C4a—C5a	108.88 (9)	Ho3a—N3a—O3am	3.9 (6)
H4aa—C4a—H5ab	135.72 (9)	Ho3a—N3a—N1a	146.5 (5)
H4aa—C4a—H5aa	95.88 (7)	Ho3a—N3a—N2a	134.2 (5)
H4aa—C4a—C6a	88.33 (7)	Ho3a—N3a—N4a	151.0 (6)
H4aa—C4a—H6ab	93.95 (7)	Ho3a—N3a—Cca	113.3 (5)
H4aa—C4a—H6aa	67.40 (6)	Ho3a—N3a—Hcba	94.2 (6)
C5a—C4a—H5ab	26.86 (5)	Ho3a—N3a—Hcaa	102.1 (5)
C5a—C4a—H5aa	27.10 (5)	Ho3a—N3a—Cda	161.2 (5)
C5a—C4a—C6a	33.88 (6)	Ho3a—N3a—Cea	142.7 (6)
C5a—C4a—H6ab	49.33 (5)	Ho3a—N3a—Cfa	100.6 (5)
C5a—C4a—H6aa	48.95 (5)	Ho3a—N3a—Hfaa	85.6 (6)
H5ab—C4a—H5aa	45.70 (3)	Ho3a—N3a—Hfba	87.4 (5)
H5ab—C4a—C6a	52.67 (4)	Ho3a—N3a—Cga	117.9 (6)
H5ab—C4a—H6ab	58.23 (3)	Ho3a—N3a—Hgaa	98.8 (6)
H5ab—C4a—H6aa	72.05 (3)	Ho3a—N3a—Hgba	105.4 (6)
H5aa—C4a—C6a	52.30 (4)	Ho3a—N3a—Cha	146.3 (5)
H5aa—C4a—H6ab	72.31 (3)	O3am—N3a—N1a	145.78 (5)
H5aa—C4a—H6aa	57.42 (3)	O3am—N3a—N2a	130.52 (6)
C6a—C4a—H6ab	21.51 (3)	O3am—N3a—N4a	153.32 (6)
C6a—C4a—H6aa	20.95 (3)	O3am—N3a—Cca	113.43 (8)
H6ab—C4a—H6aa	33.911 (13)	O3am—N3a—Hcba	93.07 (5)
C3a—C5a—H3ab	21.38 (3)	O3am—N3a—Hcaa	104.02 (5)
C3a—C5a—H3aa	20.92 (3)	O3am—N3a—Cda	164.51 (5)
C3a—C5a—C4a	32.75 (6)	O3am—N3a—Cea	139.17 (6)
C3a—C5a—H4ab	51.20 (4)	O3am—N3a—Cfa	96.93 (8)
C3a—C5a—H4aa	51.48 (4)	O3am—N3a—Hfaa	81.73 (5)
C3a—C5a—H5ab	91.14 (7)	O3am—N3a—Hfba	84.68 (4)
C3a—C5a—H5aa	89.98 (7)	O3am—N3a—Cga	120.83 (8)
C3a—C5a—C6a	145.08 (9)	O3am—N3a—Hgaa	100.62 (5)
C3a—C5a—H6ab	127.06 (6)	O3am—N3a—Hgba	109.20 (5)
C3a—C5a—H6aa	126.14 (6)	O3am—N3a—Cha	144.53 (5)
C3a—C5a—C7a	176.76 (7)	N1a—N3a—N2a	60.03 (4)
C3a—C5a—H7ab	162.84 (5)	N1a—N3a—N4a	59.99 (4)
C3a—C5a—H7aa	158.94 (5)	N1a—N3a—Cca	34.25 (5)
H3ab—C5a—H3aa	33.851 (13)	N1a—N3a—Hcba	52.78 (4)
H3ab—C5a—C4a	48.76 (5)	N1a—N3a—Hcaa	53.11 (4)
H3ab—C5a—H4ab	57.45 (3)	N1a—N3a—Cda	31.37 (4)
H3ab—C5a—H4aa	71.64 (3)	N1a—N3a—Cea	31.56 (3)
H3ab—C5a—H5ab	69.83 (6)	N1a—N3a—Cfa	88.65 (7)
H3ab—C5a—H5aa	94.89 (7)	N1a—N3a—Hfaa	88.59 (5)
H3ab—C5a—C6a	155.07 (8)	N1a—N3a—Hfba	112.20 (5)
H3ab—C5a—H6ab	128.97 (5)	N1a—N3a—Cga	88.58 (7)
H3ab—C5a—H6aa	145.74 (6)	N1a—N3a—Hgaa	112.60 (6)
H3ab—C5a—C7a	161.76 (6)	N1a—N3a—Hgba	88.52 (5)
H3ab—C5a—H7ab	141.84 (4)	N1a—N3a—Cha	64.39 (4)
H3ab—C5a—H7aa	154.38 (5)	N2a—N3a—N4a	60.12 (5)
H3aa—C5a—C4a	47.23 (5)	N2a—N3a—Cca	89.08 (7)
H3aa—C5a—H4ab	70.32 (3)	N2a—N3a—Hcba	89.21 (6)
H3aa—C5a—H4aa	55.82 (3)	N2a—N3a—Hcaa	112.95 (6)
H3aa—C5a—H5ab	98.77 (7)	N2a—N3a—Cda	64.39 (5)
H3aa—C5a—H5aa	69.11 (6)	N2a—N3a—Cea	31.28 (4)
H3aa—C5a—C6a	149.91 (8)	N2a—N3a—Cfa	33.68 (6)
H3aa—C5a—H6ab	143.81 (6)	N2a—N3a—Hfaa	52.16 (5)
H3aa—C5a—H6aa	124.13 (5)	N2a—N3a—Hfba	52.32 (4)
H3aa—C5a—C7a	158.58 (5)	N2a—N3a—Cga	89.16 (8)
H3aa—C5a—H7ab	161.94 (5)	N2a—N3a—Hgaa	89.66 (5)
H3aa—C5a—H7aa	138.04 (4)	N2a—N3a—Hgba	112.99 (6)
C4a—C5a—H4ab	26.74 (5)	N2a—N3a—Cha	31.36 (5)
C4a—C5a—H4aa	26.80 (5)	N4a—N3a—Cca	89.14 (8)
C4a—C5a—H5ab	108.83 (9)	N4a—N3a—Hcba	112.58 (6)
C4a—C5a—H5aa	109.21 (10)	N4a—N3a—Hcaa	89.36 (6)
C4a—C5a—C6a	112.39 (10)	N4a—N3a—Cda	31.32 (4)
C4a—C5a—H6ab	96.73 (8)	N4a—N3a—Cea	64.55 (5)
C4a—C5a—H6aa	97.08 (8)	N4a—N3a—Cfa	88.78 (8)
C4a—C5a—C7a	144.66 (9)	N4a—N3a—Hfaa	112.13 (6)
C4a—C5a—H7ab	149.98 (8)	N4a—N3a—Hfba	88.76 (5)
C4a—C5a—H7aa	154.26 (8)	N4a—N3a—Cga	33.90 (6)
H4ab—C5a—H4aa	45.31 (3)	N4a—N3a—Hgaa	52.83 (5)
H4ab—C5a—H5ab	94.40 (7)	N4a—N3a—Hgba	52.97 (5)
H4ab—C5a—H5aa	135.92 (9)	N4a—N3a—Cha	31.52 (4)
H4ab—C5a—C6a	98.32 (8)	Cca—N3a—Hcba	27.25 (6)
H4ab—C5a—H6ab	75.96 (4)	Cca—N3a—Hcaa	27.71 (6)
H4ab—C5a—H6aa	93.80 (5)	Cca—N3a—Cda	57.83 (7)
H4ab—C5a—C7a	127.52 (6)	Cca—N3a—Cea	57.80 (6)
H4ab—C5a—H7ab	124.86 (5)	Cca—N3a—Cfa	108.02 (10)
H4ab—C5a—H7aa	147.27 (5)	Cca—N3a—Hfaa	93.57 (9)
H4aa—C5a—H5ab	135.60 (9)	Cca—N3a—Hfba	135.54 (9)
H4aa—C5a—H5aa	96.33 (8)	Cca—N3a—Cga	107.92 (11)
H4aa—C5a—C6a	96.01 (8)	Cca—N3a—Hgaa	135.64 (10)
H4aa—C5a—H6ab	90.92 (5)	Cca—N3a—Hgba	93.13 (8)
H4aa—C5a—H6aa	74.68 (4)	Cca—N3a—Cha	98.64 (7)
H4aa—C5a—C7a	125.32 (6)	Hcba—N3a—Hcaa	47.00 (4)
H4aa—C5a—H7ab	141.06 (5)	Hcba—N3a—Cda	82.09 (5)
H4aa—C5a—H7aa	128.07 (5)	Hcba—N3a—Cea	61.76 (4)
H5ab—C5a—H5aa	108.03 (12)	Hcba—N3a—Cfa	93.96 (8)
H5ab—C5a—C6a	110.07 (10)	Hcba—N3a—Hfaa	72.27 (5)
H5ab—C5a—H6ab	96.47 (7)	Hcba—N3a—Hfba	119.22 (7)
H5ab—C5a—H6aa	136.51 (9)	Hcba—N3a—Cga	135.17 (9)
H5ab—C5a—C7a	91.96 (8)	Hcba—N3a—Hgaa	162.87 (8)
H5ab—C5a—H7ab	72.06 (6)	Hcba—N3a—Hgba	117.99 (6)
H5ab—C5a—H7aa	95.62 (8)	Hcba—N3a—Cha	111.11 (5)
H5aa—C5a—C6a	108.22 (9)	Hcaa—N3a—Cda	62.06 (4)
H5aa—C5a—H6ab	135.32 (8)	Hcaa—N3a—Cea	82.54 (5)
H5aa—C5a—H6aa	94.89 (7)	Hcaa—N3a—Cfa	135.73 (9)
H5aa—C5a—C7a	89.98 (7)	Hcaa—N3a—Hfaa	118.97 (7)
H5aa—C5a—H7ab	98.39 (7)	Hcaa—N3a—Hfba	163.20 (7)
H5aa—C5a—H7aa	68.97 (6)	Hcaa—N3a—Cga	93.54 (8)
C6a—C5a—H6ab	27.11 (5)	Hcaa—N3a—Hgaa	118.64 (7)
C6a—C5a—H6aa	26.45 (5)	Hcaa—N3a—Hgba	71.30 (5)
C6a—C5a—C7a	32.27 (6)	Hcaa—N3a—Cha	111.45 (6)
C6a—C5a—H7ab	45.10 (6)	Cda—N3a—Cea	50.02 (4)
C6a—C5a—H7aa	49.02 (6)	Cda—N3a—Cfa	98.07 (7)
H6ab—C5a—H6aa	45.01 (2)	Cda—N3a—Hfaa	110.43 (6)
H6ab—C5a—C7a	51.56 (4)	Cda—N3a—Hfba	110.54 (5)
H6ab—C5a—H7ab	54.11 (3)	Cda—N3a—Cga	57.21 (7)
H6ab—C5a—H7aa	72.00 (3)	Cda—N3a—Hgaa	82.01 (5)
H6aa—C5a—C7a	50.65 (4)	Cda—N3a—Hgba	61.35 (5)
H6aa—C5a—H7ab	68.31 (3)	Cda—N3a—Cha	49.85 (4)
H6aa—C5a—H7aa	58.38 (3)	Cea—N3a—Cfa	57.09 (6)
C7a—C5a—H7ab	20.06 (3)	Cea—N3a—Hfaa	60.89 (5)
C7a—C5a—H7aa	21.20 (3)	Cea—N3a—Hfba	81.57 (5)
H7ab—C5a—H7aa	33.072 (13)	Cea—N3a—Cga	98.45 (7)
C4a—C6a—H4ab	20.90 (3)	Cea—N3a—Hgaa	111.46 (5)
C4a—C6a—H4aa	21.39 (3)	Cea—N3a—Hgba	111.01 (6)
C4a—C6a—C5a	33.72 (6)	Cea—N3a—Cha	49.84 (4)
C4a—C6a—H5ab	51.94 (4)	Cfa—N3a—Hfaa	27.33 (6)
C4a—C6a—H5aa	52.52 (4)	Cfa—N3a—Hfba	27.53 (6)
C4a—C6a—H6ab	89.08 (7)	Cfa—N3a—Cga	108.49 (10)
C4a—C6a—H6aa	89.40 (8)	Cfa—N3a—Hgaa	94.55 (8)
C4a—C6a—C7a	149.07 (9)	Cfa—N3a—Hgba	136.38 (9)
C4a—C6a—H7ab	133.14 (6)	Cfa—N3a—Cha	57.26 (7)
C4a—C6a—H7aa	128.07 (6)	Hfaa—N3a—Hfba	47.22 (4)
C4a—C6a—C8a	173.97 (6)	Hfaa—N3a—Cga	135.79 (8)
C4a—C6a—H8ab	159.34 (6)	Hfaa—N3a—Hgaa	119.63 (6)
C4a—C6a—H8aa	152.79 (6)	Hfaa—N3a—Hgba	163.55 (7)
H4ab—C6a—H4aa	33.975 (14)	Hfaa—N3a—Cha	81.53 (5)
H4ab—C6a—C5a	48.05 (6)	Hfba—N3a—Cga	94.18 (8)
H4ab—C6a—H5ab	56.35 (2)	Hfba—N3a—Hgaa	72.71 (5)
H4ab—C6a—H5aa	71.58 (3)	Hfba—N3a—Hgba	119.89 (7)
H4ab—C6a—H6ab	68.20 (6)	Hfba—N3a—Cha	61.16 (4)
H4ab—C6a—H6aa	96.54 (8)	Cga—N3a—Hgaa	27.71 (6)
H4ab—C6a—C7a	154.88 (8)	Cga—N3a—Hgba	27.92 (6)
H4ab—C6a—H7ab	129.68 (5)	Cga—N3a—Cha	57.80 (7)
H4ab—C6a—H7aa	145.08 (5)	Hgaa—N3a—Hgba	47.56 (4)
H4ab—C6a—C8a	161.17 (6)	Hgaa—N3a—Cha	62.12 (4)
H4ab—C6a—H8ab	139.68 (5)	Hgba—N3a—Cha	82.62 (5)
H4ab—C6a—H8aa	155.48 (5)	N1a—N4a—N2a	60.10 (4)
H4aa—C6a—C5a	49.61 (6)	N1a—N4a—N3a	60.21 (4)
H4aa—C6a—H5ab	72.00 (3)	N1a—N4a—Cca	31.47 (3)
H4aa—C6a—H5aa	58.50 (3)	N1a—N4a—Hcba^ix	120.33 (5)
H4aa—C6a—H6ab	94.62 (8)	N1a—N4a—Cda	34.02 (6)
H4aa—C6a—H6aa	68.03 (6)	N1a—N4a—Hdaa	52.63 (4)
H4aa—C6a—C7a	155.81 (8)	N1a—N4a—Hdba	52.62 (4)
H4aa—C6a—H7ab	152.83 (5)	N1a—N4a—Cea	31.55 (3)
H4aa—C6a—H7aa	129.17 (5)	N1a—N4a—Cfa	64.57 (4)
H4aa—C6a—C8a	152.65 (6)	N1a—N4a—Hfaa^ix	159.01 (5)
H4aa—C6a—H8ab	148.28 (5)	N1a—N4a—Cga	88.94 (8)
H4aa—C6a—H8aa	131.63 (4)	N1a—N4a—Hgaa	113.07 (6)
C5a—C6a—H5ab	26.36 (5)	N1a—N4a—Hgba	88.40 (5)
C5a—C6a—H5aa	27.37 (5)	N1a—N4a—Cha	88.68 (8)
C5a—C6a—H6ab	108.32 (9)	N1a—N4a—Hhba	112.20 (6)
C5a—C6a—H6aa	108.76 (10)	N1a—N4a—Hhaa	89.18 (5)
C5a—C6a—C7a	115.35 (11)	N2a—N4a—N3a	60.10 (5)
C5a—C6a—H7ab	103.30 (8)	N2a—N4a—Cca	64.57 (5)
C5a—C6a—H7aa	97.10 (8)	N2a—N4a—Hcba^ix	158.70 (6)
C5a—C6a—C8a	148.80 (9)	N2a—N4a—Cda	88.89 (8)
C5a—C6a—H8ab	161.60 (9)	N2a—N4a—Hdaa	112.51 (6)
C5a—C6a—H8aa	149.11 (8)	N2a—N4a—Hdba	88.73 (6)
H5ab—C6a—H5aa	45.54 (2)	N2a—N4a—Cea	31.27 (4)
H5ab—C6a—H6ab	95.27 (7)	N2a—N4a—Cfa	31.14 (4)
H5ab—C6a—H6aa	135.13 (9)	N2a—N4a—Hfaa^ix	117.46 (5)
H5ab—C6a—C7a	100.30 (8)	N2a—N4a—Cga	89.29 (9)
H5ab—C6a—H7ab	81.31 (4)	N2a—N4a—Hgaa	89.80 (6)
H5ab—C6a—H7aa	91.83 (5)	N2a—N4a—Hgba	112.53 (6)
H5ab—C6a—C8a	133.08 (7)	N2a—N4a—Cha	33.63 (7)
H5ab—C6a—H8ab	136.34 (5)	N2a—N4a—Hhba	52.27 (5)
H5ab—C6a—H8aa	148.07 (6)	N2a—N4a—Hhaa	52.50 (5)
H5aa—C6a—H6ab	135.68 (8)	N3a—N4a—Cca	31.54 (4)
H5aa—C6a—H6aa	94.90 (8)	N3a—N4a—Hcba^ix	140.58 (6)
H5aa—C6a—C7a	99.41 (8)	N3a—N4a—Cda	89.24 (8)
H5aa—C6a—H7ab	98.89 (5)	N3a—N4a—Hdaa	89.61 (5)
H5aa—C6a—H7aa	75.59 (4)	N3a—N4a—Hdba	112.70 (6)
H5aa—C6a—C8a	127.14 (6)	N3a—N4a—Cea	64.51 (5)
H5aa—C6a—H8ab	148.13 (6)	N3a—N4a—Cfa	31.72 (4)
H5aa—C6a—H8aa	121.88 (5)	N3a—N4a—Hfaa^ix	139.07 (6)
H6ab—C6a—H6aa	107.29 (12)	N3a—N4a—Cga	34.07 (7)
H6ab—C6a—C7a	109.10 (10)	N3a—N4a—Hgaa	53.08 (4)
H6ab—C6a—H7ab	92.75 (8)	N3a—N4a—Hgba	52.53 (5)
H6ab—C6a—H7aa	135.47 (9)	N3a—N4a—Cha	88.63 (8)
H6ab—C6a—C8a	93.45 (7)	N3a—N4a—Hhba	88.79 (6)
H6ab—C6a—H8ab	72.18 (6)	N3a—N4a—Hhaa	112.41 (7)
H6ab—C6a—H8aa	102.40 (7)	Cca—N4a—Hcba^ix	128.50 (5)
H6aa—C6a—C7a	107.74 (9)	Cca—N4a—Cda	57.70 (7)
H6aa—C6a—H7ab	133.78 (9)	Cca—N4a—Hdaa	61.85 (4)
H6aa—C6a—H7aa	97.80 (8)	Cca—N4a—Hdba	82.11 (5)
H6aa—C6a—C8a	84.62 (7)	Cca—N4a—Cea	50.05 (4)
H6aa—C6a—H8ab	88.06 (7)	Cca—N4a—Cfa	50.23 (4)
H6aa—C6a—H8aa	63.72 (5)	Cca—N4a—Hfaa^ix	169.51 (6)
C7a—C6a—H7ab	26.49 (5)	Cca—N4a—Cga	57.47 (7)
C7a—C6a—H7aa	26.67 (5)	Cca—N4a—Hgaa	82.42 (5)
C7a—C6a—C8a	34.10 (6)	Cca—N4a—Hgba	60.96 (4)
C7a—C6a—H8ab	50.01 (5)	Cca—N4a—Cha	98.20 (8)
C7a—C6a—H8aa	48.83 (5)	Cca—N4a—Hhba	110.79 (6)
H7ab—C6a—H7aa	45.10 (3)	Cca—N4a—Hhaa	111.11 (6)
H7ab—C6a—C8a	52.25 (4)	Hcba^ix—N4a—Cda	86.82 (8)
H7ab—C6a—H8ab	58.55 (3)	Hcba^ix—N4a—Hdaa	69.95 (5)
H7ab—C6a—H8aa	71.58 (3)	Hcba^ix—N4a—Hdba	77.96 (5)
H7aa—C6a—C8a	52.38 (4)	Hcba^ix—N4a—Cea	139.40 (5)
H7aa—C6a—H8ab	72.57 (3)	Hcba^ix—N4a—Cfa	169.70 (6)
H7aa—C6a—H8aa	57.07 (3)	Hcba^ix—N4a—Hfaa^ix	53.38 (3)
C8a—C6a—H8ab	21.52 (3)	Hcba^ix—N4a—Cga	111.86 (9)
C8a—C6a—H8aa	21.18 (3)	Hcba^ix—N4a—Hgaa	107.64 (6)
H8ab—C6a—H8aa	34.138 (13)	Hcba^ix—N4a—Hgba	88.56 (5)
C5a—C7a—H5ab	20.64 (3)	Hcba^ix—N4a—Cha	129.75 (8)
C5a—C7a—H5aa	21.27 (3)	Hcba^ix—N4a—Hhba	120.51 (6)
C5a—C7a—C6a	32.38 (6)	Hcba^ix—N4a—Hhaa	106.99 (5)
C5a—C7a—H6ab	51.38 (4)	Cda—N4a—Hdaa	27.31 (6)
C5a—C7a—H6aa	51.21 (4)	Cda—N4a—Hdba	27.49 (5)
C5a—C7a—H7ab	95.14 (7)	Cda—N4a—Cea	57.62 (7)
C5a—C7a—H7aa	87.54 (7)	Cda—N4a—Cfa	98.58 (9)
C5a—C7a—C8a	143.84 (9)	Cda—N4a—Hfaa^ix	131.24 (9)
C5a—C7a—H8ab	127.00 (6)	Cda—N4a—Cga	108.23 (9)
C5a—C7a—H8aa	124.16 (6)	Cda—N4a—Hgaa	136.05 (8)
C5a—C7a—C9a	175.34 (6)	Cda—N4a—Hgba	93.38 (7)
C5a—C7a—H9ab	158.45 (6)	Cda—N4a—Cha	107.87 (11)
C5a—C7a—H9aa	164.12 (5)	Cda—N4a—Hhba	135.18 (10)
H5ab—C7a—H5aa	33.644 (13)	Cda—N4a—Hhaa	93.92 (8)
H5ab—C7a—C6a	47.22 (5)	Hdaa—N4a—Hdba	46.94 (4)
H5ab—C7a—H6ab	56.50 (2)	Hdaa—N4a—Cea	82.04 (5)
H5ab—C7a—H6aa	70.37 (3)	Hdaa—N4a—Cfa	111.50 (6)
H5ab—C7a—H7ab	74.67 (6)	Hdaa—N4a—Hfaa^ix	122.80 (6)
H5ab—C7a—H7aa	91.39 (7)	Hdaa—N4a—Cga	94.15 (7)
H5ab—C7a—C8a	156.13 (9)	Hdaa—N4a—Hgaa	119.41 (6)
H5ab—C7a—H8ab	131.04 (5)	Hdaa—N4a—Hgba	72.09 (5)
H5ab—C7a—H8aa	143.89 (6)	Hdaa—N4a—Cha	135.17 (9)
H5ab—C7a—C9a	164.02 (6)	Hdaa—N4a—Hhba	162.45 (8)
H5ab—C7a—H9ab	153.60 (5)	Hdaa—N4a—Hhaa	118.81 (6)
H5ab—C7a—H9aa	144.29 (4)	Hdba—N4a—Cea	61.45 (5)
H5aa—C7a—C6a	47.69 (5)	Hdba—N4a—Cfa	110.74 (6)
H5aa—C7a—H6ab	71.08 (3)	Hdba—N4a—Hfaa^ix	107.96 (5)
H5aa—C7a—H6aa	56.46 (3)	Hdba—N4a—Cga	135.70 (9)
H5aa—C7a—H7ab	103.74 (7)	Hdba—N4a—Hgaa	163.50 (7)
H5aa—C7a—H7aa	66.46 (6)	Hdba—N4a—Hgba	118.67 (6)
H5aa—C7a—C8a	146.41 (8)	Hdba—N4a—Cha	93.46 (8)
H5aa—C7a—H8ab	142.28 (6)	Hdba—N4a—Hhba	118.45 (6)
H5aa—C7a—H8aa	120.27 (5)	Hdba—N4a—Hhaa	72.13 (5)
H5aa—C7a—C9a	157.10 (5)	Cea—N4a—Cfa	49.69 (4)
H5aa—C7a—H9ab	137.26 (5)	Cea—N4a—Hfaa^ix	137.17 (5)
H5aa—C7a—H9aa	164.28 (5)	Cea—N4a—Cga	98.58 (9)
C6a—C7a—H6ab	26.90 (5)	Cea—N4a—Hgaa	111.64 (6)
C6a—C7a—H6aa	26.85 (5)	Cea—N4a—Hgba	110.59 (6)
C6a—C7a—H7ab	109.47 (9)	Cea—N4a—Cha	57.12 (7)
C6a—C7a—H7aa	109.34 (10)	Cea—N4a—Hhba	81.50 (5)
C6a—C7a—C8a	112.02 (10)	Cea—N4a—Hhaa	61.54 (5)
C6a—C7a—H8ab	95.67 (8)	Cfa—N4a—Hfaa^ix	125.63 (5)
C6a—C7a—H8aa	97.61 (8)	Cfa—N4a—Cga	58.15 (8)
C6a—C7a—C9a	144.52 (9)	Cfa—N4a—Hgaa	62.46 (5)
C6a—C7a—H9ab	156.74 (8)	Cfa—N4a—Hgba	82.40 (5)
C6a—C7a—H9aa	147.49 (8)	Cfa—N4a—Cha	56.92 (7)
H6ab—C7a—H6aa	45.13 (3)	Cfa—N4a—Hhba	61.02 (5)
H6ab—C7a—H7ab	92.83 (7)	Cfa—N4a—Hhaa	81.51 (5)
H6ab—C7a—H7aa	135.94 (9)	Hfaa^ix—N4a—Cga	112.05 (8)
H6ab—C7a—C8a	99.64 (8)	Hfaa^ix—N4a—Hgaa	87.26 (5)
H6ab—C7a—H8ab	76.52 (4)	Hfaa^ix—N4a—Hgba	110.28 (6)
H6ab—C7a—H8aa	96.76 (5)	Hfaa^ix—N4a—Cha	84.39 (7)
H6ab—C7a—C9a	127.69 (6)	Hfaa^ix—N4a—Hhba	67.49 (4)
H6ab—C7a—H9ab	148.60 (6)	Hfaa^ix—N4a—Hhaa	75.65 (4)
H6ab—C7a—H9aa	122.51 (5)	Cga—N4a—Hgaa	27.82 (6)
H6aa—C7a—H7ab	135.85 (9)	Cga—N4a—Hgba	27.48 (6)
H6aa—C7a—H7aa	99.17 (8)	Cga—N4a—Cha	108.41 (11)
H6aa—C7a—C8a	93.62 (8)	Cga—N4a—Hhba	94.28 (8)
H6aa—C7a—H8ab	86.94 (5)	Cga—N4a—Hhaa	135.80 (10)
H6aa—C7a—H8aa	73.53 (4)	Hgaa—N4a—Hgba	47.50 (4)
H6aa—C7a—C9a	124.43 (6)	Hgaa—N4a—Cha	94.39 (8)
H6aa—C7a—H9ab	130.36 (5)	Hgaa—N4a—Hhba	72.75 (5)
H6aa—C7a—H9aa	138.12 (5)	Hgaa—N4a—Hhaa	119.20 (6)
H7ab—C7a—H7aa	107.88 (12)	Hgba—N4a—Cha	135.84 (9)
H7ab—C7a—C8a	109.01 (10)	Hgba—N4a—Hhba	119.77 (6)
H7ab—C7a—H8ab	96.53 (8)	Hgba—N4a—Hhaa	163.15 (8)
H7ab—C7a—H8aa	135.73 (9)	Cha—N4a—Hhba	27.32 (6)
H7ab—C7a—C9a	89.45 (7)	Cha—N4a—Hhaa	27.40 (6)
H7ab—C7a—H9ab	91.87 (7)	Hhba—N4a—Hhaa	46.66 (4)
H7ab—C7a—H9aa	69.68 (6)	Ho3a—Cca—Ho1b^xi	170.4 (4)
H7aa—C7a—C8a	109.03 (9)	Ho3a—Cca—N1a	147.3 (3)
H7aa—C7a—H8ab	135.84 (8)	Ho3a—Cca—N2a	89.1 (3)
H7aa—C7a—H8aa	94.56 (7)	Ho3a—Cca—N3a	37.0 (3)
H7aa—C7a—C9a	91.84 (7)	Ho3a—Cca—N4a	94.7 (3)
H7aa—C7a—H9ab	70.91 (6)	Ho3a—Cca—Hcba	83.5 (4)
H7aa—C7a—H9aa	101.29 (7)	Ho3a—Cca—Hcaa	93.3 (3)
C8a—C7a—H8ab	26.87 (5)	Ho3a—Cca—Cda	125.3 (4)
C8a—C7a—H8aa	26.75 (5)	Ho3a—Cca—Hdaa	124.4 (4)
C8a—C7a—C9a	32.55 (6)	Ho3a—Cca—Cea	117.5 (3)
C8a—C7a—H9ab	49.74 (6)	Ho3a—Cca—Heba	112.7 (3)
C8a—C7a—H9aa	45.10 (6)	Ho3a—Cca—Cfa	58.5 (3)
H8ab—C7a—H8aa	45.16 (2)	Ho3a—Cca—Hfaa	58.4 (3)
H8ab—C7a—C9a	51.35 (4)	Ho3a—Cca—Cga	65.9 (4)
H8ab—C7a—H9ab	72.10 (3)	Ho3a—Cca—Hgba	69.6 (4)
H8ab—C7a—H9aa	53.42 (2)	Ho1b^xi—Cca—N1a	42.2 (3)
H8aa—C7a—C9a	51.28 (4)	Ho1b^xi—Cca—N2a	100.0 (3)
H8aa—C7a—H9ab	59.62 (3)	Ho1b^xi—Cca—N3a	152.0 (3)
H8aa—C7a—H9aa	68.76 (3)	Ho1b^xi—Cca—N4a	93.3 (3)
C9a—C7a—H9ab	21.36 (3)	Ho1b^xi—Cca—Hcba	92.0 (4)
C9a—C7a—H9aa	20.14 (3)	Ho1b^xi—Cca—Hcaa	80.2 (4)
H9ab—C7a—H9aa	33.199 (13)	Ho1b^xi—Cca—Cda	62.2 (3)
C6a—C8a—H6ab	20.90 (3)	Ho1b^xi—Cca—Hdaa	59.7 (4)
C6a—C8a—H6aa	21.49 (3)	Ho1b^xi—Cca—Cea	70.8 (3)
C6a—C8a—C7a	33.88 (6)	Ho1b^xi—Cca—Heba	73.1 (3)
C6a—C8a—H7ab	52.16 (4)	Ho1b^xi—Cca—Cfa	130.2 (3)
C6a—C8a—H7aa	52.23 (4)	Ho1b^xi—Cca—Hfaa	127.5 (4)
C6a—C8a—H8ab	88.11 (7)	Ho1b^xi—Cca—Cga	120.6 (3)
C6a—C8a—H8aa	90.78 (8)	Ho1b^xi—Cca—Hgba	113.5 (4)
C6a—C8a—C9a	148.55 (9)	N1a—Cca—N2a	59.53 (5)
C6a—C8a—H9ab	127.94 (6)	N1a—Cca—N3a	111.41 (9)
C6a—C8a—H9aa	132.06 (6)	N1a—Cca—N4a	59.49 (6)
C6a—C8a—Caa	174.77 (6)	N1a—Cca—Hcba	108.88 (11)
C6a—C8a—Haab	157.97 (6)	N1a—Cca—Hcaa	109.40 (11)
C6a—C8a—Haaa	154.27 (5)	N1a—Cca—Cda	35.70 (5)
H6ab—C8a—H6aa	33.811 (14)	N1a—Cca—Hdaa	50.80 (5)
H6ab—C8a—C7a	47.39 (6)	N1a—Cca—Cea	36.03 (5)
H6ab—C8a—H7ab	55.31 (2)	N1a—Cca—Heba	51.08 (5)
H6ab—C8a—H7aa	70.67 (3)	N1a—Cca—Cfa	90.53 (6)
H6ab—C8a—H8ab	67.46 (6)	N1a—Cca—Hfaa	97.42 (6)
H6ab—C8a—H8aa	99.77 (8)	N1a—Cca—Cga	90.64 (7)
H6ab—C8a—C9a	151.15 (8)	N1a—Cca—Hgba	97.76 (7)
H6ab—C8a—H9ab	142.58 (5)	N2a—Cca—N3a	59.45 (6)
H6ab—C8a—H9aa	125.90 (5)	N2a—Cca—N4a	51.08 (4)
H6ab—C8a—Caa	161.40 (6)	N2a—Cca—Hcba	99.67 (9)
H6ab—C8a—Haab	139.54 (5)	N2a—Cca—Hcaa	150.33 (11)
H6ab—C8a—Haaa	160.34 (5)	N2a—Cca—Cda	64.79 (5)
H6aa—C8a—C7a	50.75 (6)	N2a—Cca—Hdaa	86.32 (5)
H6aa—C8a—H7ab	72.82 (3)	N2a—Cca—Cea	31.20 (4)
H6aa—C8a—H7aa	60.06 (3)	N2a—Cca—Heba	43.08 (3)
H6aa—C8a—H8ab	91.31 (7)	N2a—Cca—Cfa	31.00 (4)
H6aa—C8a—H8aa	69.57 (6)	N2a—Cca—Hfaa	42.99 (3)
H6aa—C8a—C9a	159.32 (9)	N2a—Cca—Cga	65.03 (5)
H6aa—C8a—H9ab	132.70 (5)	N2a—Cca—Hgba	86.96 (5)
H6aa—C8a—H9aa	153.17 (5)	N3a—Cca—N4a	59.31 (7)
H6aa—C8a—Caa	153.43 (6)	N3a—Cca—Hcba	109.19 (12)
H6aa—C8a—Haab	144.39 (5)	N3a—Cca—Hcaa	107.96 (12)
H6aa—C8a—Haaa	133.79 (4)	N3a—Cca—Cda	90.58 (8)
C7a—C8a—H7ab	26.53 (5)	N3a—Cca—Hdaa	97.74 (8)
C7a—C8a—H7aa	26.67 (5)	N3a—Cca—Cea	90.65 (7)
C7a—C8a—H8ab	108.57 (9)	N3a—Cca—Heba	97.61 (7)
C7a—C8a—H8aa	108.93 (10)	N3a—Cca—Cfa	36.05 (6)
C7a—C8a—C9a	114.74 (11)	N3a—Cca—Hfaa	51.44 (7)
C7a—C8a—H9ab	95.85 (8)	N3a—Cca—Cga	35.90 (7)
C7a—C8a—H9aa	103.38 (8)	N3a—Cca—Hgba	51.54 (7)
C7a—C8a—Caa	148.26 (10)	N4a—Cca—Hcba	150.75 (10)
C7a—C8a—Haab	164.44 (9)	N4a—Cca—Hcaa	99.26 (10)
C7a—C8a—Haaa	146.18 (8)	N4a—Cca—Cda	31.27 (4)
H7ab—C8a—H7aa	45.02 (2)	N4a—Cca—Hdaa	43.35 (4)
H7ab—C8a—H8ab	96.30 (7)	N4a—Cca—Cea	64.99 (5)
H7ab—C8a—H8aa	135.44 (9)	N4a—Cca—Heba	86.20 (4)
H7ab—C8a—C9a	98.50 (8)	N4a—Cca—Cfa	64.76 (5)
H7ab—C8a—H9ab	88.95 (5)	N4a—Cca—Hfaa	86.28 (4)
H7ab—C8a—H9aa	80.36 (4)	N4a—Cca—Cga	31.15 (4)
H7ab—C8a—Caa	132.15 (7)	N4a—Cca—Hgba	43.60 (4)
H7ab—C8a—Haab	139.04 (6)	Hcba—Cca—Hcaa	109.99 (12)
H7ab—C8a—Haaa	144.20 (6)	Hcba—Cca—Cda	144.56 (10)
H7aa—C8a—H8ab	135.19 (8)	Hcba—Cca—Hdaa	151.68 (10)
H7aa—C8a—H8aa	94.52 (8)	Hcba—Cca—Cea	89.87 (9)
H7aa—C8a—C9a	100.34 (8)	Hcba—Cca—Heba	67.95 (8)
H7aa—C8a—H9ab	76.01 (4)	Hcba—Cca—Cfa	90.16 (9)
H7aa—C8a—H9aa	100.62 (6)	Hcba—Cca—Hfaa	67.88 (8)
H7aa—C8a—Caa	127.47 (6)	Hcba—Cca—Cga	145.08 (11)
H7aa—C8a—Haab	149.55 (6)	Hcba—Cca—Hgba	152.25 (10)
H7aa—C8a—Haaa	119.85 (5)	Hcaa—Cca—Cda	90.21 (10)
H8ab—C8a—H8aa	107.45 (12)	Hcaa—Cca—Hdaa	68.01 (9)
H8ab—C8a—C9a	108.52 (10)	Hcaa—Cca—Cea	145.40 (11)
H8ab—C8a—H9ab	134.69 (9)	Hcaa—Cca—Heba	152.99 (10)
H8ab—C8a—H9aa	91.33 (8)	Hcaa—Cca—Cfa	144.00 (11)
H8ab—C8a—Caa	93.99 (7)	Hcaa—Cca—Hfaa	151.66 (10)
H8ab—C8a—Haab	72.81 (6)	Hcaa—Cca—Cga	89.09 (10)
H8ab—C8a—Haaa	104.90 (7)	Hcaa—Cca—Hgba	66.43 (8)
H8aa—C8a—C9a	108.39 (9)	Cda—Cca—Hdaa	22.21 (3)
H8aa—C8a—H9ab	99.35 (8)	Cda—Cca—Cea	59.93 (5)
H8aa—C8a—H9aa	134.33 (9)	Cda—Cca—Heba	80.80 (5)
H8aa—C8a—Caa	84.02 (7)	Cda—Cca—Cfa	89.45 (6)
H8aa—C8a—Haab	84.76 (6)	Cda—Cca—Hfaa	107.38 (5)
H8aa—C8a—Haaa	64.33 (5)	Cda—Cca—Cga	59.64 (5)
C9a—C8a—H9ab	26.71 (5)	Cda—Cca—Hgba	62.30 (5)
C9a—C8a—H9aa	26.62 (5)	Hdaa—Cca—Cea	81.02 (5)
C9a—C8a—Caa	34.50 (6)	Hdaa—Cca—Heba	100.63 (4)
C9a—C8a—Haab	51.97 (6)	Hdaa—Cca—Cfa	107.59 (6)
C9a—C8a—Haaa	47.62 (5)	Hdaa—Cca—Hfaa	127.80 (5)
H9ab—C8a—H9aa	45.17 (3)	Hdaa—Cca—Cga	62.19 (5)
H9ab—C8a—Caa	52.80 (4)	Hdaa—Cca—Hgba	54.92 (4)
H9ab—C8a—Haab	74.09 (3)	Cea—Cca—Heba	21.93 (4)
H9ab—C8a—Haaa	55.68 (2)	Cea—Cca—Cfa	59.42 (5)
H9aa—C8a—Caa	52.75 (4)	Cea—Cca—Hfaa	61.70 (4)
H9aa—C8a—Haab	61.10 (3)	Cea—Cca—Cga	89.82 (6)
H9aa—C8a—Haaa	70.78 (3)	Cea—Cca—Hgba	108.20 (6)
Caa—C8a—Haab	22.10 (3)	Heba—Cca—Cfa	61.88 (4)
Caa—C8a—Haaa	20.56 (3)	Heba—Cca—Hfaa	54.50 (3)
Haab—C8a—Haaa	33.979 (13)	Heba—Cca—Cga	107.62 (5)
O4a—C9a—C7a	159.83 (7)	Heba—Cca—Hgba	128.29 (5)
O4a—C9a—H7ab	139.02 (6)	Cfa—Cca—Hfaa	22.28 (4)
O4a—C9a—H7aa	154.88 (7)	Cfa—Cca—Cga	60.16 (6)
O4a—C9a—C8a	156.58 (9)	Cfa—Cca—Hgba	81.76 (5)
O4a—C9a—H8ab	130.37 (7)	Hfaa—Cca—Cga	81.40 (5)
O4a—C9a—H8aa	147.15 (7)	Hfaa—Cca—Hgba	101.76 (5)
O4a—C9a—H9ab	94.00 (9)	Cga—Cca—Hgba	22.67 (4)
O4a—C9a—H9aa	64.75 (7)	Ho1b^xi—Cda—N1a	43.0 (4)
O4a—C9a—Caa	55.30 (7)	Ho1b^xi—Cda—N2a	100.9 (4)
O4a—C9a—Haab	67.30 (5)	Ho1b^xi—Cda—N3a	94.6 (4)
O4a—C9a—Haaa	75.11 (5)	Ho1b^xi—Cda—N4a	153.5 (4)
O4a—C9a—Cba	24.37 (5)	Ho1b^xi—Cda—Cca	63.2 (4)
O4a—C9a—O4am	1.50 (4)	Ho1b^xi—Cda—Hcba^ix	139.6 (4)
C7a—C9a—H7ab	20.85 (3)	Ho1b^xi—Cda—Hcaa	61.1 (3)
C7a—C9a—H7aa	20.68 (3)	Ho1b^xi—Cda—Hdaa	78.8 (4)
C7a—C9a—C8a	32.71 (6)	Ho1b^xi—Cda—Hdba	91.1 (3)
C7a—C9a—H8ab	51.58 (4)	Ho1b^xi—Cda—Cea	71.3 (4)
C7a—C9a—H8aa	51.71 (4)	Ho1b^xi—Cda—Heaa	73.6 (4)
C7a—C9a—H9ab	86.32 (7)	Ho1b^xi—Cda—Cga	122.0 (3)
C7a—C9a—H9aa	95.91 (7)	Ho1b^xi—Cda—Hgba	114.0 (3)
C7a—C9a—Caa	142.95 (9)	Ho1b^xi—Cda—Cha	131.1 (4)
C7a—C9a—Haab	124.75 (6)	Ho1b^xi—Cda—Hhaa	128.1 (4)
C7a—C9a—Haaa	125.04 (6)	N1a—Cda—N2a	59.85 (6)
C7a—C9a—Cba	175.01 (7)	N1a—Cda—N3a	59.83 (6)
C7a—C9a—O4am	159.35 (5)	N1a—Cda—N4a	112.03 (10)
H7ab—C9a—H7aa	33.309 (13)	N1a—Cda—Cca	35.86 (5)
H7ab—C9a—C8a	48.17 (5)	N1a—Cda—Hcba^ix	170.06 (7)
H7ab—C9a—H8ab	57.45 (3)	N1a—Cda—Hcaa	51.41 (5)
H7ab—C9a—H8aa	71.31 (3)	N1a—Cda—Hdaa	108.64 (10)
H7ab—C9a—H9ab	88.89 (7)	N1a—Cda—Hdba	108.39 (12)
H7ab—C9a—H9aa	75.43 (6)	N1a—Cda—Cea	36.08 (5)
H7ab—C9a—Caa	157.15 (9)	N1a—Cda—Heaa	51.87 (5)
H7ab—C9a—Haab	131.63 (5)	N1a—Cda—Cga	91.18 (7)
H7ab—C9a—Haaa	145.62 (6)	N1a—Cda—Hgba	97.61 (6)
H7ab—C9a—Cba	162.61 (5)	N1a—Cda—Cha	91.07 (7)
H7ab—C9a—O4am	138.50 (4)	N1a—Cda—Hhaa	98.19 (7)
H7aa—C9a—C8a	47.07 (6)	N2a—Cda—N3a	51.20 (4)
H7aa—C9a—H8ab	70.47 (3)	N2a—Cda—N4a	59.79 (7)
H7aa—C9a—H8aa	56.05 (3)	N2a—Cda—Cca	65.21 (5)
H7aa—C9a—H9ab	66.07 (6)	N2a—Cda—Hcba^ix	119.51 (5)
H7aa—C9a—H9aa	105.38 (7)	N2a—Cda—Hcaa	86.75 (5)
H7aa—C9a—Caa	144.03 (8)	N2a—Cda—Hdaa	151.28 (10)
H7aa—C9a—Haab	137.70 (6)	N2a—Cda—Hdba	98.78 (9)
H7aa—C9a—Haaa	119.10 (5)	N2a—Cda—Cea	31.32 (4)
H7aa—C9a—Cba	160.75 (5)	N2a—Cda—Heaa	43.33 (4)
H7aa—C9a—O4am	155.76 (5)	N2a—Cda—Cga	65.30 (5)
C8a—C9a—H8ab	26.97 (5)	N2a—Cda—Hgba	87.03 (5)
C8a—C9a—H8aa	27.02 (5)	N2a—Cda—Cha	31.21 (5)
C8a—C9a—H9ab	109.14 (10)	N2a—Cda—Hhaa	43.36 (3)
C8a—C9a—H9aa	109.55 (9)	N3a—Cda—N4a	59.44 (7)
C8a—C9a—Caa	111.07 (10)	N3a—Cda—Cca	31.59 (4)
C8a—C9a—Haab	92.55 (8)	N3a—Cda—Hcba^ix	111.40 (5)
C8a—C9a—Haaa	99.46 (8)	N3a—Cda—Hcaa	43.42 (3)
C8a—C9a—Cba	142.38 (9)	N3a—Cda—Hdaa	100.09 (9)
C8a—C9a—O4am	155.22 (8)	N3a—Cda—Hdba	149.98 (11)
H8ab—C9a—H8aa	45.38 (3)	N3a—Cda—Cea	65.06 (5)
H8ab—C9a—H9ab	135.56 (9)	N3a—Cda—Heaa	86.88 (5)
H8ab—C9a—H9aa	92.07 (7)	N3a—Cda—Cga	31.35 (5)
H8ab—C9a—Caa	99.74 (8)	N3a—Cda—Hgba	43.33 (4)
H8ab—C9a—Haab	75.03 (4)	N3a—Cda—Cha	64.81 (5)
H8ab—C9a—Haaa	100.01 (6)	N3a—Cda—Hhaa	86.48 (5)
H8ab—C9a—Cba	124.54 (6)	N4a—Cda—Cca	91.04 (8)
H8ab—C9a—O4am	128.91 (5)	N4a—Cda—Hcba^ix	63.11 (7)
H8aa—C9a—H9ab	99.91 (8)	N4a—Cda—Hcaa	97.60 (7)
H8aa—C9a—H9aa	135.86 (9)	N4a—Cda—Hdaa	109.10 (12)
H8aa—C9a—Caa	91.90 (8)	N4a—Cda—Hdba	108.73 (11)
H8aa—C9a—Haab	82.32 (5)	N4a—Cda—Cea	91.12 (8)
H8aa—C9a—Haaa	74.55 (4)	N4a—Cda—Heaa	97.86 (8)
H8aa—C9a—Cba	123.55 (6)	N4a—Cda—Cga	35.82 (6)
H8aa—C9a—O4am	146.89 (5)	N4a—Cda—Hgba	51.74 (6)
H9ab—C9a—H9aa	107.70 (12)	N4a—Cda—Cha	36.10 (7)
H9ab—C9a—Caa	109.73 (9)	N4a—Cda—Hhaa	51.33 (6)
H9ab—C9a—Haab	136.20 (8)	Cca—Cda—Hcba^ix	134.20 (6)
H9ab—C9a—Haaa	93.09 (7)	Cca—Cda—Hcaa	22.36 (4)
H9ab—C9a—Cba	96.49 (8)	Cca—Cda—Hdaa	90.09 (9)
H9ab—C9a—O4am	95.44 (7)	Cca—Cda—Hdba	144.23 (12)
H9aa—C9a—Caa	109.58 (10)	Cca—Cda—Cea	60.08 (5)
H9aa—C9a—Haab	99.50 (8)	Cca—Cda—Heaa	81.75 (5)
H9aa—C9a—Haaa	135.45 (9)	Cca—Cda—Cga	60.06 (5)
H9aa—C9a—Cba	87.18 (7)	Cca—Cda—Hgba	61.99 (4)
H9aa—C9a—O4am	63.91 (6)	Cca—Cda—Cha	89.95 (6)
Caa—C9a—Haab	26.99 (5)	Cca—Cda—Hhaa	108.12 (6)
Caa—C9a—Haaa	26.26 (5)	Hcba^ix—Cda—Hcaa	119.37 (5)
Caa—C9a—Cba	32.09 (6)	Hcba^ix—Cda—Hdaa	66.91 (9)
Caa—C9a—O4am	55.19 (6)	Hcba^ix—Cda—Hdba	81.54 (9)
Haab—C9a—Haaa	44.89 (2)	Hcba^ix—Cda—Cea	147.46 (6)
Haab—C9a—Cba	50.66 (4)	Hcba^ix—Cda—Heaa	135.58 (5)
Haab—C9a—O4am	66.49 (3)	Hcba^ix—Cda—Cga	80.14 (5)
Haaa—C9a—Cba	50.84 (4)	Hcba^ix—Cda—Hgba	72.54 (4)
Haaa—C9a—O4am	75.49 (3)	Hcba^ix—Cda—Cha	88.78 (5)
Cba—C9a—O4am	24.66 (3)	Hcba^ix—Cda—Hhaa	85.36 (4)
O3a—Caa—O4a	55.72 (7)	Hcaa—Cda—Hdaa	67.74 (8)
O3a—Caa—C8a	172.56 (8)	Hcaa—Cda—Hdba	152.24 (11)
O3a—Caa—H8ab	166.60 (8)	Hcaa—Cda—Cea	81.46 (5)
O3a—Caa—H8aa	154.46 (7)	Hcaa—Cda—Heaa	101.95 (5)
O3a—Caa—C9a	141.90 (11)	Hcaa—Cda—Cga	62.07 (4)
O3a—Caa—H9ab	121.43 (8)	Hcaa—Cda—Hgba	54.08 (3)
O3a—Caa—H9aa	127.48 (8)	Hcaa—Cda—Cha	107.82 (6)
O3a—Caa—Haab	101.96 (9)	Hcaa—Cda—Hhaa	128.35 (6)
O3a—Caa—Haaa	81.34 (8)	Hdaa—Cda—Hdba	109.93 (14)
O3a—Caa—Cba	31.13 (7)	Hdaa—Cda—Cea	144.71 (11)
O3a—Caa—O3am	0.33 (5)	Hdaa—Cda—Heaa	151.98 (11)
O3a—Caa—O4am	56.52 (6)	Hdaa—Cda—Cga	90.25 (9)
O3a—Caa—Heab^v	100.35 (6)	Hdaa—Cda—Hgba	67.65 (8)
O4a—Caa—C8a	124.83 (7)	Hdaa—Cda—Cha	145.19 (11)
O4a—Caa—H8ab	122.51 (6)	Hdaa—Cda—Hhaa	152.06 (11)
O4a—Caa—H8aa	145.40 (7)	Hdba—Cda—Cea	89.23 (10)
O4a—Caa—C9a	93.24 (9)	Hdba—Cda—Heaa	66.56 (9)
O4a—Caa—H9ab	88.86 (7)	Hdba—Cda—Cga	144.53 (10)
O4a—Caa—H9aa	72.21 (6)	Hdba—Cda—Hgba	152.73 (11)
O4a—Caa—Haab	106.83 (9)	Hdba—Cda—Cha	89.45 (9)
O4a—Caa—Haaa	129.46 (10)	Hdba—Cda—Hhaa	67.09 (7)
O4a—Caa—Cba	24.60 (7)	Cea—Cda—Heaa	22.67 (3)
O4a—Caa—O3am	55.42 (5)	Cea—Cda—Cga	90.14 (6)
O4a—Caa—O4am	1.82 (5)	Cea—Cda—Hgba	108.07 (6)
O4a—Caa—Heab^v	67.47 (6)	Cea—Cda—Cha	59.84 (5)
C8a—Caa—H8ab	20.83 (3)	Cea—Cda—Hhaa	62.41 (4)
C8a—Caa—H8aa	22.12 (3)	Heaa—Cda—Cga	108.25 (6)
C8a—Caa—C9a	34.42 (6)	Heaa—Cda—Hgba	128.71 (6)
C8a—Caa—H9ab	52.44 (4)	Heaa—Cda—Cha	62.02 (5)
C8a—Caa—H9aa	52.64 (4)	Heaa—Cda—Hhaa	54.61 (3)
C8a—Caa—Haab	85.08 (7)	Cga—Cda—Hgba	22.61 (4)
C8a—Caa—Haaa	94.36 (8)	Cga—Cda—Cha	60.13 (5)
C8a—Caa—Cba	148.84 (9)	Cga—Cda—Hhaa	81.34 (5)
C8a—Caa—O3am	172.71 (6)	Hgba—Cda—Cha	81.82 (5)
C8a—Caa—O4am	124.29 (5)	Hgba—Cda—Hhaa	101.81 (5)
C8a—Caa—Heab^v	86.12 (4)	Cha—Cda—Hhaa	22.36 (3)
H8ab—Caa—H8aa	34.275 (14)	Ho1b^xi—Cea—N1a	31.5 (3)
H8ab—Caa—C9a	47.28 (6)	Ho1b^xi—Cea—N2a	143.4 (3)
H8ab—Caa—H9ab	70.42 (3)	Ho1b^xi—Cea—N3a	88.0 (3)
H8ab—Caa—H9aa	54.98 (2)	Ho1b^xi—Cea—N4a	87.4 (3)
H8ab—Caa—Haab	65.15 (6)	Ho1b^xi—Cea—Cca	58.2 (3)
H8ab—Caa—Haaa	105.39 (8)	Ho1b^xi—Cea—Hcba	61.7 (3)
H8ab—Caa—Cba	145.89 (7)	Ho1b^xi—Cea—Cda	57.6 (3)
H8ab—Caa—O3am	166.45 (5)	Ho1b^xi—Cea—Hdba	60.9 (3)
H8ab—Caa—O4am	121.30 (4)	Ho1b^xi—Cea—Heaa	91.3 (3)
H8ab—Caa—Heab^v	68.59 (3)	Ho1b^xi—Cea—Heba	91.8 (3)
H8aa—Caa—C9a	52.22 (6)	Ho1b^xi—Cea—Cfa	118.6 (3)
H8aa—Caa—H9ab	61.33 (3)	Ho1b^xi—Cea—Hfaa	116.9 (3)
H8aa—Caa—H9aa	74.08 (3)	Ho1b^xi—Cea—Cha	117.4 (3)
H8aa—Caa—Haab	85.74 (7)	Ho1b^xi—Cea—Hhaa	115.6 (3)
H8aa—Caa—Haaa	73.12 (6)	N1a—Cea—N2a	111.86 (10)
H8aa—Caa—Cba	165.44 (9)	N1a—Cea—N3a	59.71 (5)
H8aa—Caa—O3am	154.79 (5)	N1a—Cea—N4a	59.47 (6)
H8aa—Caa—O4am	145.22 (5)	N1a—Cea—Cca	35.92 (5)
H8aa—Caa—Heab^v	102.73 (4)	N1a—Cea—Hcba	51.28 (5)
C9a—Caa—H9ab	26.47 (5)	N1a—Cea—Cda	35.80 (5)
C9a—Caa—H9aa	26.57 (5)	N1a—Cea—Hdba	51.22 (5)
C9a—Caa—Haab	108.60 (9)	N1a—Cea—Heaa	108.36 (12)
C9a—Caa—Haaa	109.83 (10)	N1a—Cea—Heba	108.77 (10)
C9a—Caa—Cba	115.38 (11)	N1a—Cea—Cfa	91.36 (7)
C9a—Caa—O3am	141.75 (9)	N1a—Cea—Hfaa	98.28 (6)
C9a—Caa—O4am	93.18 (7)	N1a—Cea—Cha	90.78 (8)
C9a—Caa—Heab^v	84.37 (6)	N1a—Cea—Hhaa	97.73 (7)
H9ab—Caa—H9aa	45.02 (2)	N2a—Cea—N3a	59.65 (6)
H9ab—Caa—Haab	134.56 (8)	N2a—Cea—N4a	59.64 (7)
H9ab—Caa—Haaa	93.04 (8)	N2a—Cea—Cca	91.20 (7)
H9ab—Caa—Cba	104.15 (8)	N2a—Cea—Hcba	98.29 (7)
H9ab—Caa—O3am	121.40 (6)	N2a—Cea—Cda	90.89 (9)
H9ab—Caa—O4am	89.62 (5)	N2a—Cea—Hdba	97.74 (9)
H9ab—Caa—Heab^v	106.73 (4)	N2a—Cea—Heaa	107.66 (11)
H9aa—Caa—Haab	98.80 (7)	N2a—Cea—Heba	109.01 (12)
H9aa—Caa—Haaa	136.00 (9)	N2a—Cea—Cfa	35.69 (6)
H9aa—Caa—Cba	96.57 (8)	N2a—Cea—Hfaa	51.31 (6)
H9aa—Caa—O3am	127.20 (6)	N2a—Cea—Cha	35.80 (7)
H9aa—Caa—O4am	71.66 (4)	N2a—Cea—Hhaa	51.02 (6)
H9aa—Caa—Heab^v	61.71 (3)	N3a—Cea—N4a	50.94 (4)
Haab—Caa—Haaa	107.12 (12)	N3a—Cea—Cca	31.55 (4)
Haab—Caa—Cba	107.02 (10)	N3a—Cea—Hcba	43.72 (3)
Haab—Caa—O3am	101.90 (7)	N3a—Cea—Cda	64.92 (5)
Haab—Caa—O4am	105.15 (8)	N3a—Cea—Hdba	86.55 (5)
Haab—Caa—Heab^v	47.96 (5)	N3a—Cea—Heaa	149.19 (12)
Haaa—Caa—Cba	108.56 (9)	N3a—Cea—Heba	99.60 (9)
Haaa—Caa—O3am	81.66 (6)	N3a—Cea—Cfa	31.65 (4)
Haaa—Caa—O4am	131.07 (9)	N3a—Cea—Hfaa	43.69 (4)
Haaa—Caa—Heab^v	155.00 (10)	N3a—Cea—Cha	64.74 (5)
Cba—Caa—O3am	30.83 (5)	N3a—Cea—Hhaa	86.33 (5)
Cba—Caa—O4am	25.46 (5)	N4a—Cea—Cca	64.96 (5)
Cba—Caa—Heab^v	81.77 (6)	N4a—Cea—Hcba	86.61 (5)
O3am—Caa—O4am	56.21 (3)	N4a—Cea—Cda	31.26 (4)
O3am—Caa—Heab^v	100.07 (4)	N4a—Cea—Hdba	43.38 (4)
O4am—Caa—Heab^v	65.67 (3)	N4a—Cea—Heaa	98.26 (10)
O3a—Cba—Ho3a	26.5 (6)	N4a—Cea—Heba	150.54 (10)
O3a—Cba—O4a	123.51 (16)	N4a—Cea—Cfa	65.01 (5)
O3a—Cba—C9a	140.17 (12)	N4a—Cea—Hfaa	86.71 (5)
O3a—Cba—H9ab	132.55 (11)	N4a—Cea—Cha	31.31 (4)
O3a—Cba—H9aa	161.33 (12)	N4a—Cea—Hhaa	43.39 (3)
O3a—Cba—Caa	112.37 (14)	Cca—Cea—Hcba	22.36 (4)
O3a—Cba—Haab	107.39 (13)	Cca—Cea—Cda	59.99 (5)
O3a—Cba—Haaa	88.74 (11)	Cca—Cea—Hdba	81.32 (5)
O3a—Cba—O3am	1.58 (9)	Cca—Cea—Heaa	144.23 (12)
O3a—Cba—O4am	125.10 (13)	Cca—Cea—Heba	89.73 (9)
Ho3a—Cba—O4a	97.1 (6)	Cca—Cea—Cfa	60.40 (5)
Ho3a—Cba—C9a	164.4 (6)	Cca—Cea—Hfaa	62.68 (4)
Ho3a—Cba—H9ab	148.1 (6)	Cca—Cea—Cha	89.87 (6)
Ho3a—Cba—H9aa	171.5 (6)	Cca—Cea—Hhaa	107.92 (6)
Ho3a—Cba—Caa	138.6 (6)	Hcba—Cea—Cda	81.26 (5)
Ho3a—Cba—Haab	127.9 (6)	Hcba—Cea—Hdba	101.31 (5)
Ho3a—Cba—Haaa	115.0 (6)	Hcba—Cea—Heaa	152.39 (10)
Ho3a—Cba—O3am	24.9 (6)	Hcba—Cea—Heba	67.37 (7)
Ho3a—Cba—O4am	98.6 (6)	Hcba—Cea—Cfa	62.92 (4)
O4a—Cba—C9a	94.49 (11)	Hcba—Cea—Hfaa	55.34 (3)
O4a—Cba—H9ab	92.63 (11)	Hcba—Cea—Cha	108.01 (6)
O4a—Cba—H9aa	74.72 (10)	Hcba—Cea—Hhaa	128.37 (6)
O4a—Cba—Caa	124.10 (13)	Cda—Cea—Hdba	22.40 (3)
O4a—Cba—Haab	121.25 (12)	Cda—Cea—Heaa	88.90 (10)
O4a—Cba—Haaa	145.98 (12)	Cda—Cea—Heba	144.56 (10)
O4a—Cba—O3am	121.94 (13)	Cda—Cea—Cfa	90.05 (6)
O4a—Cba—O4am	3.65 (10)	Cda—Cea—Hfaa	108.17 (6)
C9a—Cba—H9ab	20.05 (3)	Cda—Cea—Cha	59.79 (5)
C9a—Cba—H9aa	21.36 (3)	Cda—Cea—Hhaa	62.23 (5)
C9a—Cba—Caa	32.52 (6)	Hdba—Cea—Heaa	66.50 (9)
C9a—Cba—Haab	51.88 (4)	Hdba—Cea—Heba	151.97 (10)
C9a—Cba—Haaa	51.92 (4)	Hdba—Cea—Cfa	108.03 (6)
C9a—Cba—O3am	141.70 (8)	Hdba—Cea—Hfaa	128.55 (6)
C9a—Cba—O4am	93.58 (6)	Hdba—Cea—Cha	62.21 (5)
H9ab—Cba—H9aa	33.145 (13)	Hdba—Cea—Hhaa	54.79 (4)
H9ab—Cba—Caa	44.96 (6)	Heaa—Cea—Heba	111.20 (14)
H9ab—Cba—Haab	69.41 (3)	Heaa—Cea—Cfa	143.31 (10)
H9ab—Cba—Haaa	54.16 (3)	Heaa—Cea—Hfaa	151.60 (10)
H9ab—Cba—O3am	133.74 (6)	Heaa—Cea—Cha	88.63 (9)
H9ab—Cba—O4am	92.99 (6)	Heaa—Cea—Hhaa	66.31 (8)
H9aa—Cba—Caa	49.75 (5)	Heba—Cea—Cfa	89.98 (10)
H9aa—Cba—Haab	59.87 (3)	Heba—Cea—Hfaa	67.48 (8)
H9aa—Cba—Haaa	72.61 (3)	Heba—Cea—Cha	144.78 (11)
H9aa—Cba—O3am	162.90 (8)	Heba—Cea—Hhaa	152.19 (10)
H9aa—Cba—O4am	73.35 (5)	Cfa—Cea—Hfaa	22.49 (4)
Caa—Cba—Haab	27.76 (5)	Cfa—Cea—Cha	59.73 (5)
Caa—Cba—Haaa	26.92 (5)	Cfa—Cea—Hhaa	80.92 (5)
Caa—Cba—O3am	113.92 (9)	Hfaa—Cea—Cha	81.21 (5)
Caa—Cba—O4am	122.29 (9)	Hfaa—Cea—Hhaa	101.13 (5)
Haab—Cba—Haaa	45.66 (3)	Cha—Cea—Hhaa	22.32 (3)
Haab—Cba—O3am	108.64 (8)	Ho3a—Cfa—N1a	98.4 (4)
Haab—Cba—O4am	118.02 (7)	Ho3a—Cfa—N2a	156.1 (4)
Haaa—Cba—O3am	90.31 (6)	Ho3a—Cfa—N3a	44.2 (4)
Haaa—Cba—O4am	145.44 (8)	Ho3a—Cfa—N4a	99.7 (4)
O3am—Cba—O4am	123.52 (9)	Ho3a—Cfa—Cca	67.5 (4)
H5aa^iv—O1b—Ho1b	91.1 (10)	Ho3a—Cfa—Hcba	66.4 (4)
H5aa^iv—O1b—O2b	86.08 (9)	Ho3a—Cfa—Cea	127.1 (4)
H5aa^iv—O1b—C1b	87.30 (11)	Ho3a—Cfa—Heba	120.7 (4)
H5aa^iv—O1b—C2b	91.04 (7)	Ho3a—Cfa—Hfaa	82.9 (4)
H5aa^iv—O1b—H2ba	111.69 (7)	Ho3a—Cfa—Hfba	85.5 (4)
H5aa^iv—O1b—H2bb	77.56 (5)	Ho3a—Cfa—Cga	69.3 (4)
H5aa^iv—O1b—O1bm	79 (4)	Ho3a—Cfa—Hgaa	68.9 (4)
H5aa^iv—O1b—O2bm	85.38 (7)	Ho3a—Cfa—Cha	129.0 (4)
H5aa^iv—O1b—N1a^ii	102.62 (6)	Ho3a—Cfa—Hhba	123.5 (4)
H5aa^iv—O1b—Hfbb^vii	149.38 (9)	N1a—Cfa—N2a	59.73 (6)
Ho1b—O1b—O2b	81.0 (10)	N1a—Cfa—N3a	59.71 (6)
Ho1b—O1b—C1b	108.0 (10)	N1a—Cfa—N4a	51.10 (4)
Ho1b—O1b—C2b	144.0 (10)	N1a—Cfa—Cca	31.47 (3)
Ho1b—O1b—H2ba	144.1 (9)	N1a—Cfa—Hcba	43.51 (3)
Ho1b—O1b—H2bb	159.7 (11)	N1a—Cfa—Cea	31.56 (4)
Ho1b—O1b—O1bm	31 (4)	N1a—Cfa—Heba	43.40 (3)
Ho1b—O1b—O2bm	80.7 (10)	N1a—Cfa—Hfaa	98.80 (9)
Ho1b—O1b—N1a^ii	13.3 (11)	N1a—Cfa—Hfba	149.99 (12)
Ho1b—O1b—Hfbb^vii	109.8 (11)	N1a—Cfa—Cga	64.70 (5)
O2b—O1b—C1b	27.00 (9)	N1a—Cfa—Hgaa	86.44 (5)
O2b—O1b—C2b	63.32 (8)	N1a—Cfa—Cha	64.99 (5)
O2b—O1b—H2ba	73.67 (7)	N1a—Cfa—Hhba	86.93 (4)
O2b—O1b—H2bb	81.45 (8)	N2a—Cfa—N3a	112.00 (11)
O2b—O1b—O1bm	108 (4)	N2a—Cfa—N4a	59.86 (8)
O2b—O1b—O2bm	0.79 (5)	N2a—Cfa—Cca	91.21 (8)
O2b—O1b—N1a^ii	88.47 (9)	N2a—Cfa—Hcba	98.13 (7)
O2b—O1b—Hfbb^vii	118.30 (9)	N2a—Cfa—Cea	35.93 (6)
C1b—O1b—C2b	36.34 (8)	N2a—Cfa—Heba	51.14 (6)
C1b—O1b—H2ba	49.17 (8)	N2a—Cfa—Hfaa	108.42 (12)
C1b—O1b—H2bb	55.35 (8)	N2a—Cfa—Hfba	108.50 (11)
C1b—O1b—O1bm	134 (5)	N2a—Cfa—Cga	91.09 (9)
C1b—O1b—O2bm	27.39 (7)	N2a—Cfa—Hgaa	98.24 (9)
C1b—O1b—N1a^ii	114.55 (13)	N2a—Cfa—Cha	36.05 (7)
C1b—O1b—Hfbb^vii	106.13 (11)	N2a—Cfa—Hhba	51.44 (7)
C2b—O1b—H2ba	21.92 (3)	N3a—Cfa—N4a	59.51 (7)
C2b—O1b—H2bb	23.12 (3)	N3a—Cfa—Cca	35.93 (6)
C2b—O1b—O1bm	168 (4)	N3a—Cfa—Hcba	51.25 (6)
C2b—O1b—O2bm	63.72 (6)	N3a—Cfa—Cea	91.27 (8)
C2b—O1b—N1a^ii	147.89 (10)	N3a—Cfa—Heba	98.05 (7)
C2b—O1b—Hfbb^vii	84.86 (7)	N3a—Cfa—Hfaa	108.43 (11)
H2ba—O1b—H2bb	35.92 (3)	N3a—Cfa—Hfba	108.30 (12)
H2ba—O1b—O1bm	169 (4)	N3a—Cfa—Cga	35.56 (7)
H2ba—O1b—O2bm	74.29 (6)	N3a—Cfa—Hgaa	50.80 (7)
H2ba—O1b—N1a^ii	139.59 (8)	N3a—Cfa—Cha	90.90 (9)
H2ba—O1b—Hfbb^vii	63.41 (5)	N3a—Cfa—Hhba	98.10 (9)
H2bb—O1b—O1bm	154 (4)	N4a—Cfa—Cca	65.02 (5)
H2bb—O1b—O2bm	81.66 (7)	N4a—Cfa—Hcba	86.57 (5)
H2bb—O1b—N1a^ii	169.89 (10)	N4a—Cfa—Cea	65.30 (5)
H2bb—O1b—Hfbb^vii	87.56 (6)	N4a—Cfa—Heba	86.58 (5)
O1bm—O1b—O2bm	108 (4)	N4a—Cfa—Hfaa	149.91 (10)
O1bm—O1b—N1a^ii	32 (4)	N4a—Cfa—Hfba	98.89 (11)
O1bm—O1b—Hfbb^vii	107 (4)	N4a—Cfa—Cga	31.24 (4)
O2bm—O1b—N1a^ii	88.27 (7)	N4a—Cfa—Hgaa	43.40 (4)
O2bm—O1b—Hfbb^vii	119.09 (8)	N4a—Cfa—Cha	31.39 (4)
N1a^ii—O1b—Hfbb^vii	96.63 (7)	N4a—Cfa—Hhba	43.81 (4)
O1b—Ho1b—O2b	75.3 (9)	Cca—Cfa—Hcba	22.27 (4)
O1b—Ho1b—C1b	43.4 (7)	Cca—Cfa—Cea	60.18 (5)
O1b—Ho1b—O1bm	0.98 (13)	Cca—Cfa—Heba	62.45 (4)
O1b—Ho1b—O2bm	75.6 (9)	Cca—Cfa—Hfaa	89.14 (9)
O1b—Ho1b—N1a^ii	160.1 (16)	Cca—Cfa—Hfba	144.21 (12)
O1b—Ho1b—Cca^ii	134.8 (12)	Cca—Cfa—Cga	59.66 (5)
O1b—Ho1b—Hcba^ii	131.0 (11)	Cca—Cfa—Hgaa	80.96 (5)
O1b—Ho1b—Hcaa^ii	114.2 (11)	Cca—Cfa—Cha	90
O1b—Ho1b—Cda^ii	131.6 (13)	Cca—Cfa—Hhba	108.41 (6)
O1b—Ho1b—Hdaa^ii	111.6 (13)	Hcba—Cfa—Cea	62.51 (4)
O1b—Ho1b—Hdba^ii	126.6 (13)	Hcba—Cfa—Heba	55.14 (3)
O1b—Ho1b—Cea^ii	174.1 (13)	Hcba—Cfa—Hfaa	66.86 (8)
O2b—Ho1b—C1b	32.0 (3)	Hcba—Cfa—Hfba	151.89 (10)
O2b—Ho1b—O1bm	76.2 (10)	Hcba—Cfa—Cga	80.86 (5)
O2b—Ho1b—O2bm	0.75 (5)	Hcba—Cfa—Hgaa	100.86 (5)
O2b—Ho1b—N1a^ii	114.8 (8)	Hcba—Cfa—Cha	108.04 (6)
O2b—Ho1b—Cca^ii	93.5 (6)	Hcba—Cfa—Hhba	128.76 (6)
O2b—Ho1b—Hcba^ii	74.0 (4)	Cea—Cfa—Heba	22.05 (4)
O2b—Ho1b—Hcaa^ii	94.6 (5)	Cea—Cfa—Hfaa	89.06 (9)
O2b—Ho1b—Cda^ii	147.0 (8)	Cea—Cfa—Hfba	144.42 (10)
O2b—Ho1b—Hdaa^ii	149.0 (7)	Cea—Cfa—Cga	89.97 (6)
O2b—Ho1b—Hdba^ii	157.8 (7)	Cea—Cfa—Hgaa	108.23 (6)
O2b—Ho1b—Cea^ii	104.3 (6)	Cea—Cfa—Cha	60.18 (5)
C1b—Ho1b—O1bm	44.3 (7)	Cea—Cfa—Hhba	81.64 (5)
C1b—Ho1b—O2bm	32.2 (3)	Heba—Cfa—Hfaa	67.01 (8)
C1b—Ho1b—N1a^ii	143.8 (10)	Heba—Cfa—Hfba	152.14 (10)
C1b—Ho1b—Cca^ii	114.5 (7)	Heba—Cfa—Cga	107.67 (6)
C1b—Ho1b—Hcba^ii	98.7 (6)	Heba—Cfa—Hgaa	128.25 (6)
C1b—Ho1b—Hcaa^ii	105.2 (6)	Heba—Cfa—Cha	81.21 (5)
C1b—Ho1b—Cda^ii	162.4 (8)	Heba—Cfa—Hhba	101.38 (5)
C1b—Ho1b—Hdaa^ii	143.1 (8)	Hfaa—Cfa—Hfba	111.21 (14)
C1b—Ho1b—Hdba^ii	169.9 (9)	Hfaa—Cfa—Cga	143.94 (10)
C1b—Ho1b—Cea^ii	136.1 (8)	Hfaa—Cfa—Hgaa	151.75 (10)
O1bm—Ho1b—O2bm	76.5 (10)	Hfaa—Cfa—Cha	144.43 (11)
O1bm—Ho1b—N1a^ii	159.9 (16)	Hfaa—Cfa—Hhba	152.07 (11)
O1bm—Ho1b—Cca^ii	135.3 (12)	Hfba—Cfa—Cga	89.60 (11)
O1bm—Ho1b—Hcba^ii	131.9 (11)	Hfba—Cfa—Hgaa	67.15 (9)
O1bm—Ho1b—Hcaa^ii	114.7 (12)	Hfba—Cfa—Cha	89.33 (10)
O1bm—Ho1b—Cda^ii	131.0 (14)	Hfba—Cfa—Hhba	66.69 (8)
O1bm—Ho1b—Hdaa^ii	111.1 (13)	Cga—Cfa—Hgaa	22.45 (3)
O1bm—Ho1b—Hdba^ii	125.7 (13)	Cga—Cfa—Cha	59.95 (6)
O1bm—Ho1b—Cea^ii	173.6 (13)	Cga—Cfa—Hhba	62.78 (5)
O2bm—Ho1b—N1a^ii	114.8 (8)	Hgaa—Cfa—Cha	62.49 (5)
O2bm—Ho1b—Cca^ii	93.8 (6)	Hgaa—Cfa—Hhba	55.33 (4)
O2bm—Ho1b—Hcba^ii	74.2 (4)	Cha—Cfa—Hhba	22.64 (4)
O2bm—Ho1b—Hcaa^ii	95.1 (5)	Ho3a—Cga—N1a	92.5 (4)
O2bm—Ho1b—Cda^ii	147.2 (8)	Ho3a—Cga—N2a	87.9 (3)
O2bm—Ho1b—Hdaa^ii	149.5 (7)	Ho3a—Cga—N3a	34.5 (4)
O2bm—Ho1b—Hdba^ii	157.4 (7)	Ho3a—Cga—N4a	145.8 (4)
O2bm—Ho1b—Cea^ii	103.9 (6)	Ho3a—Cga—Cca	63.2 (4)
N1a^ii—Ho1b—Cca^ii	33.1 (3)	Ho3a—Cga—Hcaa	66.9 (3)
N1a^ii—Ho1b—Hcba^ii	45.4 (4)	Ho3a—Cga—Cda	123.3 (4)
N1a^ii—Ho1b—Hcaa^ii	50.2 (4)	Ho3a—Cga—Hdaa	122.4 (4)
N1a^ii—Ho1b—Cda^ii	33.5 (3)	Ho3a—Cga—Cfa	57.6 (3)
N1a^ii—Ho1b—Hdaa^ii	50.7 (4)	Ho3a—Cga—Hfba	58.6 (3)
N1a^ii—Ho1b—Hdba^ii	45.9 (3)	Ho3a—Cga—Hgaa	85.7 (4)
N1a^ii—Ho1b—Cea^ii	25.2 (3)	Ho3a—Cga—Hgba	93.4 (3)
Cca^ii—Ho1b—Hcba^ii	20.33 (13)	Ho3a—Cga—Cha	116.8 (3)
Cca^ii—Ho1b—Hcaa^ii	21.62 (14)	Ho3a—Cga—Hhba	112.5 (3)
Cca^ii—Ho1b—Cda^ii	54.6 (3)	N1a—Cga—N2a	51.23 (4)
Cca^ii—Ho1b—Hdaa^ii	59.5 (4)	N1a—Cga—N3a	60.00 (6)
Cca^ii—Ho1b—Hdba^ii	73.5 (4)	N1a—Cga—N4a	59.79 (7)
Cca^ii—Ho1b—Cea^ii	51.0 (3)	N1a—Cga—Cca	31.58 (3)
Hcba^ii—Ho1b—Hcaa^ii	34.1 (2)	N1a—Cga—Hcaa	43.95 (3)
Hcba^ii—Ho1b—Cda^ii	73.3 (4)	N1a—Cga—Cda	31.44 (4)
Hcba^ii—Ho1b—Hdaa^ii	79.9 (5)	N1a—Cga—Hdaa	43.45 (3)
Hcba^ii—Ho1b—Hdba^ii	90.4 (5)	N1a—Cga—Cfa	65.06 (5)
Hcba^ii—Ho1b—Cea^ii	53.6 (3)	N1a—Cga—Hfba	86.68 (5)
Hcaa^ii—Ho1b—Cda^ii	59.4 (4)	N1a—Cga—Hgaa	151.35 (11)
Hcaa^ii—Ho1b—Hdaa^ii	54.6 (3)	N1a—Cga—Hgba	98.36 (9)
Hcaa^ii—Ho1b—Hdba^ii	79.9 (4)	N1a—Cga—Cha	64.97 (4)
Hcaa^ii—Ho1b—Cea^ii	71.7 (4)	N1a—Cga—Hhba	86.57 (4)
Cda^ii—Ho1b—Hdaa^ii	21.73 (14)	N2a—Cga—N3a	59.56 (7)
Cda^ii—Ho1b—Hdba^ii	20.55 (12)	N2a—Cga—N4a	59.58 (7)
Cda^ii—Ho1b—Cea^ii	51.1 (3)	N2a—Cga—Cca	65.16 (5)
Hdaa^ii—Ho1b—Hdba^ii	34.40 (19)	N2a—Cga—Hcaa	87.05 (5)
Hdaa^ii—Ho1b—Cea^ii	71.9 (4)	N2a—Cga—Cda	65.02 (5)
Hdba^ii—Ho1b—Cea^ii	53.6 (3)	N2a—Cga—Hdaa	86.61 (5)
H2aa—O2b—H4aa	52.03 (4)	N2a—Cga—Cfa	31.04 (4)
H2aa—O2b—O1b	95.33 (8)	N2a—Cga—Hfba	43.12 (4)
H2aa—O2b—Ho1b	82.6 (4)	N2a—Cga—Hgaa	100.11 (10)
H2aa—O2b—C1b	111.80 (12)	N2a—Cga—Hgba	149.58 (10)
H2aa—O2b—C2b	124.90 (8)	N2a—Cga—Cha	31.13 (5)
H2aa—O2b—H2ba	140.71 (8)	N2a—Cga—Hhba	43.10 (4)
H2aa—O2b—C3b	121.16 (8)	N3a—Cga—N4a	112.03 (11)
H2aa—O2b—H3ba	128.18 (8)	N3a—Cga—Cca	36.18 (6)
H2aa—O2b—O1bm	94.80 (6)	N3a—Cga—Hcaa	51.59 (6)
H2aa—O2b—O2bm	15 (4)	N3a—Cga—Cda	91.43 (8)
H2aa—O2b—Hdaa^iii	95.47 (7)	N3a—Cga—Hdaa	98.52 (7)
H2aa—O2b—Hdba^iii	60.80 (5)	N3a—Cga—Cfa	35.95 (6)
H2aa—O2b—Hhbb^viii	152.56 (9)	N3a—Cga—Hfba	51.27 (6)
H4aa—O2b—O1b	121.01 (9)	N3a—Cga—Hgaa	108.81 (13)
H4aa—O2b—Ho1b	124.5 (4)	N3a—Cga—Hgba	107.75 (12)
H4aa—O2b—C1b	110.78 (13)	N3a—Cga—Cha	90.69 (8)
H4aa—O2b—C2b	96.12 (7)	N3a—Cga—Hhba	97.29 (8)
H4aa—O2b—H2ba	112.85 (7)	N4a—Cga—Cca	91.37 (8)
H4aa—O2b—C3b	74.47 (5)	N4a—Cga—Hcaa	98.71 (7)
H4aa—O2b—H3ba	76.40 (5)	N4a—Cga—Cda	35.95 (6)
H4aa—O2b—O1bm	121.03 (8)	N4a—Cga—Hdaa	51.27 (6)
H4aa—O2b—O2bm	56 (4)	N4a—Cga—Cfa	90.62 (9)
H4aa—O2b—Hdaa^iii	99.84 (7)	N4a—Cga—Hfba	97.34 (8)
H4aa—O2b—Hdba^iii	79.28 (6)	N4a—Cga—Hgaa	108.73 (11)
H4aa—O2b—Hhbb^viii	136.04 (8)	N4a—Cga—Hgba	109.22 (12)
O1b—O2b—Ho1b	23.6 (4)	N4a—Cga—Cha	35.90 (7)
O1b—O2b—C1b	29.88 (9)	N4a—Cga—Hhba	51.31 (6)
O1b—O2b—C2b	60.94 (8)	Cca—Cga—Hcaa	22.57 (4)
O1b—O2b—H2ba	59.26 (7)	Cca—Cga—Cda	60.30 (5)
O1b—O2b—C3b	92.37 (9)	Cca—Cga—Hdaa	62.70 (5)
O1b—O2b—H3ba	108.85 (10)	Cca—Cga—Cfa	60.19 (5)
O1b—O2b—O1bm	0.73 (5)	Cca—Cga—Hfba	81.50 (6)
O1b—O2b—O2bm	82 (4)	Cca—Cga—Hgaa	144.98 (13)
O1b—O2b—Hdaa^iii	134.83 (11)	Cca—Cga—Hgba	88.39 (9)
O1b—O2b—Hdba^iii	131.09 (10)	Cca—Cga—Cha	89.97 (6)
O1b—O2b—Hhbb^viii	96.70 (9)	Cca—Cga—Hhba	107.89 (6)
Ho1b—O2b—C1b	53.5 (4)	Hcaa—Cga—Cda	63.06 (4)
Ho1b—O2b—C2b	84.5 (4)	Hcaa—Cga—Hdaa	55.59 (3)
Ho1b—O2b—H2ba	80.9 (4)	Hcaa—Cga—Cfa	81.64 (5)
Ho1b—O2b—C3b	116.0 (4)	Hcaa—Cga—Hfba	101.65 (6)
Ho1b—O2b—H3ba	132.0 (4)	Hcaa—Cga—Hgaa	151.51 (11)
Ho1b—O2b—O1bm	22.9 (4)	Hcaa—Cga—Hgba	65.82 (8)
Ho1b—O2b—O2bm	73 (4)	Hcaa—Cga—Cha	108.43 (6)
Ho1b—O2b—Hdaa^iii	116.5 (4)	Hcaa—Cga—Hhba	128.69 (6)
Ho1b—O2b—Hdba^iii	107.5 (4)	Cda—Cga—Hdaa	22.32 (4)
Ho1b—O2b—Hhbb^viii	99.2 (4)	Cda—Cga—Cfa	89.84 (6)
C1b—O2b—C2b	31.08 (8)	Cda—Cga—Hfba	107.78 (6)
C1b—O2b—H2ba	32.90 (8)	Cda—Cga—Hgaa	144.68 (10)
C1b—O2b—C3b	62.58 (10)	Cda—Cga—Hgba	89.43 (9)
C1b—O2b—H3ba	79.21 (11)	Cda—Cga—Cha	59.94 (5)
C1b—O2b—O1bm	30.60 (8)	Cda—Cga—Hhba	81.28 (5)
C1b—O2b—O2bm	97 (4)	Hdaa—Cga—Cfa	108.00 (6)
C1b—O2b—Hdaa^iii	147.44 (15)	Hdaa—Cga—Hfba	128.28 (6)
C1b—O2b—Hdba^iii	160.95 (14)	Hdaa—Cga—Hgaa	151.50 (12)
C1b—O2b—Hhbb^viii	90.29 (12)	Hdaa—Cga—Hgba	67.12 (8)
C2b—O2b—H2ba	18.11 (3)	Hdaa—Cga—Cha	81.20 (5)
C2b—O2b—C3b	31.89 (5)	Hdaa—Cga—Hhba	101.30 (5)
C2b—O2b—H3ba	48.28 (5)	Cfa—Cga—Hfba	22.38 (4)
C2b—O2b—O1bm	61.66 (6)	Cfa—Cga—Hgaa	90.40 (10)
C2b—O2b—O2bm	112 (4)	Cfa—Cga—Hgba	143.66 (12)
C2b—O2b—Hdaa^iii	137.50 (8)	Cfa—Cga—Cha	59.36 (5)
C2b—O2b—Hdba^iii	167.78 (9)	Cfa—Cga—Hhba	61.58 (5)
C2b—O2b—Hhbb^viii	82.40 (7)	Hfba—Cga—Hgaa	68.02 (9)
H2ba—O2b—C3b	41.63 (4)	Hfba—Cga—Hgba	151.79 (11)
H2ba—O2b—H3ba	51.54 (4)	Hfba—Cga—Cha	61.69 (5)
H2ba—O2b—O1bm	59.98 (5)	Hfba—Cga—Hhba	53.99 (3)
H2ba—O2b—O2bm	126 (4)	Hgaa—Cga—Hgba	110.29 (14)
H2ba—O2b—Hdaa^iii	123.79 (7)	Hgaa—Cga—Cha	90.35 (9)
H2ba—O2b—Hdba^iii	158.48 (8)	Hgaa—Cga—Hhba	67.98 (8)
H2ba—O2b—Hhbb^viii	65.78 (5)	Hgba—Cga—Cha	145.03 (11)
C3b—O2b—H3ba	20.17 (3)	Hgba—Cga—Hhba	153.50 (12)
C3b—O2b—O1bm	93.07 (8)	Cha—Cga—Hhba	22.38 (3)
C3b—O2b—O2bm	115 (4)	N1a—Cha—N2a	60.09 (6)
C3b—O2b—Hdaa^iii	118.30 (7)	N1a—Cha—N3a	51.43 (3)
C3b—O2b—Hdba^iii	136.46 (9)	N1a—Cha—N4a	59.86 (6)
C3b—O2b—Hhbb^viii	82.89 (6)	N1a—Cha—Cda	31.47 (4)
H3ba—O2b—O1bm	109.58 (8)	N1a—Cha—Hdba	43.52 (3)
H3ba—O2b—O2bm	127 (4)	N1a—Cha—Cea	31.70 (4)
H3ba—O2b—Hdaa^iii	98.13 (6)	N1a—Cha—Heaa	43.94 (3)
H3ba—O2b—Hdba^iii	119.51 (8)	N1a—Cha—Cfa	65.46 (4)
H3ba—O2b—Hhbb^viii	70.13 (5)	N1a—Cha—Hfaa^ix	122.41 (5)
O1bm—O2b—O2bm	82 (4)	N1a—Cha—Hfba	87.37 (4)
O1bm—O2b—Hdaa^iii	134.46 (9)	N1a—Cha—Cga	65.07 (4)
O1bm—O2b—Hdba^iii	130.37 (8)	N1a—Cha—Hgaa	86.99 (4)
O1bm—O2b—Hhbb^viii	96.97 (8)	N1a—Cha—Hhba	150.98 (10)
O2bm—O2b—Hdaa^iii	110 (4)	N1a—Cha—Hhaa	99.94 (9)
O2bm—O2b—Hdba^iii	75 (4)	N2a—Cha—N3a	60.17 (6)
O2bm—O2b—Hhbb^viii	162 (4)	N2a—Cha—N4a	112.57 (10)
Hdaa^iii—O2b—Hdba^iii	34.69 (3)	N2a—Cha—Cda	91.56 (8)
Hdaa^iii—O2b—Hhbb^viii	59.03 (5)	N2a—Cha—Hdba	98.27 (8)
Hdba^iii—O2b—Hhbb^viii	93.02 (7)	N2a—Cha—Cea	35.92 (6)
Ho3b—O3b—O4b	84.7 (10)	N2a—Cha—Heaa	51.62 (6)
Ho3b—O3b—H2ba^vii	87.9 (10)	N2a—Cha—Cfa	35.93 (6)
Ho3b—O3b—H4ba^vii	137.3 (10)	N2a—Cha—Hfaa^ix	170.50 (9)
Ho3b—O3b—Cab	147.2 (10)	N2a—Cha—Hfba	51.59 (6)
Ho3b—O3b—Habb	147.9 (9)	N2a—Cha—Cga	91.68 (8)
Ho3b—O3b—Haba	160.6 (11)	N2a—Cha—Hgaa	98.84 (7)
Ho3b—O3b—Cbb	111.5 (10)	N2a—Cha—Hhba	108.14 (13)
Ho3b—O3b—O3bm	34 (3)	N2a—Cha—Hhaa	108.91 (13)
Ho3b—O3b—O4bm	84.0 (10)	N3a—Cha—N4a	59.85 (7)
Ho3b—O3b—N3b	7.9 (11)	N3a—Cha—Cda	65.34 (5)
Ho3b—O3b—Hgab^iv	108.1 (11)	N3a—Cha—Hdba	87.06 (4)
Ho3b—O3b—Hgbb^iv	108.3 (11)	N3a—Cha—Cea	65.42 (5)
O4b—O3b—H2ba^vii	166.95 (10)	N3a—Cha—Heaa	87.46 (5)
O4b—O3b—H4ba^vii	137.64 (9)	N3a—Cha—Cfa	31.85 (4)
O4b—O3b—Cab	63.25 (8)	N3a—Cha—Hfaa^ix	113.24 (5)
O4b—O3b—Habb	76.27 (7)	N3a—Cha—Hfba	43.96 (3)
O4b—O3b—Haba	79.09 (8)	N3a—Cha—Cga	31.51 (5)
O4b—O3b—Cbb	26.94 (9)	N3a—Cha—Hgaa	43.76 (4)
O4b—O3b—O3bm	118 (3)	N3a—Cha—Hhba	99.56 (9)
O4b—O3b—O4bm	0.62 (5)	N3a—Cha—Hhaa	151.37 (10)
O4b—O3b—N3b	88.25 (9)	N4a—Cha—Cda	36.03 (6)
O4b—O3b—Hgab^iv	138.76 (9)	N4a—Cha—Hdba	51.57 (6)
O4b—O3b—Hgbb^iv	106.97 (9)	N4a—Cha—Cea	91.56 (8)
H2ba^vii—O3b—H4ba^vii	49.47 (4)	N4a—Cha—Heaa	98.49 (8)
H2ba^vii—O3b—Cab	124.85 (9)	N4a—Cha—Cfa	91.70 (8)
H2ba^vii—O3b—Habb	114.94 (8)	N4a—Cha—Hfaa^ix	65.78 (7)
H2ba^vii—O3b—Haba	105.84 (7)	N4a—Cha—Hfba	98.58 (7)
H2ba^vii—O3b—Cbb	159.13 (14)	N4a—Cha—Cga	35.70 (6)
H2ba^vii—O3b—O3bm	55 (3)	N4a—Cha—Hgaa	51.04 (6)
H2ba^vii—O3b—O4bm	166.53 (9)	N4a—Cha—Hhba	109.31 (12)
H2ba^vii—O3b—N3b	85.79 (6)	N4a—Cha—Hhaa	108.79 (13)
H2ba^vii—O3b—Hgab^iv	54.03 (4)	Cda—Cha—Hdba	22.49 (3)
H2ba^vii—O3b—Hgbb^iv	85.55 (6)	Cda—Cha—Cea	60.37 (5)
H4ba^vii—O3b—Cab	75.44 (6)	Cda—Cha—Heaa	62.72 (5)
H4ba^vii—O3b—Habb	68.02 (5)	Cda—Cha—Cfa	90.60 (6)
H4ba^vii—O3b—Haba	58.65 (4)	Cda—Cha—Hfaa^ix	91.41 (6)
H4ba^vii—O3b—Cbb	111.16 (12)	Cda—Cha—Hfba	108.88 (5)
H4ba^vii—O3b—O3bm	104 (3)	Cda—Cha—Cga	59.93 (5)
H4ba^vii—O3b—O4bm	138.25 (8)	Cda—Cha—Hgaa	81.37 (5)
H4ba^vii—O3b—N3b	134.11 (8)	Cda—Cha—Hhba	145.33 (12)
H4ba^vii—O3b—Hgab^iv	48.15 (4)	Cda—Cha—Hhaa	90.05 (9)
H4ba^vii—O3b—Hgbb^iv	70.44 (5)	Hdba—Cha—Cea	62.61 (5)
Cab—O3b—Habb	22.03 (3)	Hdba—Cha—Heaa	54.90 (4)
Cab—O3b—Haba	23.02 (3)	Hdba—Cha—Cfa	108.61 (6)
Cab—O3b—Cbb	36.32 (8)	Hdba—Cha—Hfaa^ix	87.86 (5)
Cab—O3b—O3bm	174 (3)	Hdba—Cha—Hfba	129.33 (5)
Cab—O3b—O4bm	63.87 (6)	Hdba—Cha—Cga	81.36 (5)
Cab—O3b—N3b	148.43 (10)	Hdba—Cha—Hgaa	101.47 (5)
Cab—O3b—Hgab^iv	93.33 (8)	Hdba—Cha—Hhba	152.59 (12)
Cab—O3b—Hgbb^iv	77.09 (6)	Hdba—Cha—Hhaa	67.57 (8)
Habb—O3b—Haba	35.96 (3)	Cea—Cha—Heaa	22.82 (3)
Habb—O3b—Cbb	51.34 (9)	Cea—Cha—Cfa	60.09 (5)
Habb—O3b—O3bm	152 (3)	Cea—Cha—Hfaa^ix	150.34 (6)
Habb—O3b—O4bm	76.86 (5)	Cea—Cha—Hfba	81.71 (5)
Habb—O3b—N3b	143.75 (8)	Cea—Cha—Cga	90.34 (6)
Habb—O3b—Hgab^iv	72.94 (5)	Cea—Cha—Hgaa	108.72 (5)
Habb—O3b—Hgbb^iv	55.19 (4)	Cea—Cha—Hhba	144.05 (13)
Haba—O3b—Cbb	53.49 (9)	Cea—Cha—Hhaa	90.26 (10)
Haba—O3b—O3bm	160 (3)	Heaa—Cha—Cfa	81.80 (5)
Haba—O3b—O4bm	79.69 (6)	Heaa—Cha—Hfaa^ix	137.27 (6)
Haba—O3b—N3b	166.83 (10)	Heaa—Cha—Hfba	102.09 (5)
Haba—O3b—Hgab^iv	91.25 (7)	Heaa—Cha—Cga	108.64 (6)
Haba—O3b—Hgbb^iv	86.77 (6)	Heaa—Cha—Hgaa	129.44 (5)
Cbb—O3b—O3bm	145 (3)	Heaa—Cha—Hhba	151.11 (12)
Cbb—O3b—O4bm	27.56 (8)	Heaa—Cha—Hhaa	67.43 (8)
Cbb—O3b—N3b	114.46 (13)	Cfa—Cha—Hfaa^ix	135.01 (6)
Cbb—O3b—Hgab^iv	122.23 (13)	Cfa—Cha—Hfba	22.69 (4)
Cbb—O3b—Hgbb^iv	95.05 (11)	Cfa—Cha—Cga	60.69 (6)
O3bm—O3b—O4bm	118 (3)	Cfa—Cha—Hgaa	63.23 (5)
O3bm—O3b—N3b	31 (3)	Cfa—Cha—Hhba	89.51 (10)
O3bm—O3b—Hgab^iv	82 (3)	Cfa—Cha—Hhaa	144.84 (13)
O3bm—O3b—Hgbb^iv	97 (3)	Hfaa^ix—Cha—Hfba	118.94 (5)
O4bm—O3b—N3b	87.64 (8)	Hfaa^ix—Cha—Cga	82.01 (5)
O4bm—O3b—Hgab^iv	139.05 (8)	Hfaa^ix—Cha—Hgaa	72.70 (4)
O4bm—O3b—Hgbb^iv	107.23 (7)	Hfaa^ix—Cha—Hhba	65.03 (9)
N3b—O3b—Hgab^iv	100.76 (7)	Hfaa^ix—Cha—Hhaa	80.11 (10)
N3b—O3b—Hgbb^iv	100.53 (7)	Hfba—Cha—Cga	63.12 (5)
Hgab^iv—O3b—Hgbb^iv	31.95 (3)	Hfba—Cha—Hgaa	55.65 (3)
O3b—Ho3b—O4b	71.9 (9)	Hfba—Cha—Hhba	66.82 (8)
O3b—Ho3b—Cbb	41.0 (6)	Hfba—Cha—Hhaa	151.70 (12)
O3b—Ho3b—O3bm	1.60 (14)	Cga—Cha—Hgaa	22.60 (3)
O3b—Ho3b—O4bm	72.8 (9)	Cga—Cha—Hhba	90.47 (9)
O3b—Ho3b—N3b	168.0 (17)	Cga—Cha—Hhaa	144.48 (12)
O3b—Ho3b—Ccb	139.9 (12)	Hgaa—Cha—Hhba	67.87 (8)
O3b—Ho3b—Hcbb	121.8 (12)	Hgaa—Cha—Hhaa	151.17 (12)
O3b—Ho3b—Hcab	131.0 (11)	Hhba—Cha—Hhaa	109.07 (12)
O3b—Ho3b—Cfb	140.6 (14)	O1a^xi—N1b—Ho1a^xi	3.5 (6)
O3b—Ho3b—Hfab	122.5 (14)	O1a^xi—N1b—O1am^xi	0.76 (4)
O3b—Ho3b—Hfbb	131.9 (12)	O1a^xi—N1b—N2b	145.96 (6)
O3b—Ho3b—Cgb	163.1 (14)	O1a^xi—N1b—N3b	147.36 (5)
O3b—Ho3b—Hgab	147.5 (13)	O1a^xi—N1b—N4b	140.68 (6)
O3b—Ho3b—Hgbb	147.3 (13)	O1a^xi—N1b—Ccb	113.14 (7)
O4b—Ho3b—Cbb	31.0 (2)	O1a^xi—N1b—Hcbb	99.07 (5)
O4b—Ho3b—O3bm	73.5 (9)	O1a^xi—N1b—Hcab	96.92 (5)
O4b—Ho3b—O4bm	0.88 (5)	O1a^xi—N1b—Cdb	106.73 (8)
O4b—Ho3b—N3b	113.1 (8)	O1a^xi—N1b—Hdab	91.93 (6)
O4b—Ho3b—Ccb	94.3 (6)	O1a^xi—N1b—Hdbb	91.77 (5)
O4b—Ho3b—Hcbb	98.4 (5)	O1a^xi—N1b—Ceb	112.21 (7)
O4b—Ho3b—Hcab	73.9 (4)	O1a^xi—N1b—Heab	95.80 (5)
O4b—Ho3b—Cfb	145.4 (8)	O1a^xi—N1b—Hebb	98.77 (6)
O4b—Ho3b—Hfab	150.2 (7)	O1a^xi—N1b—Cfb	154.97 (6)
O4b—Ho3b—Hfbb	153.8 (8)	O1a^xi—N1b—Cgb	148.99 (6)
O4b—Ho3b—Cgb	98.4 (6)	O1a^xi—N1b—Chb	148.17 (5)
O4b—Ho3b—Hgab	104.7 (7)	Ho1a^xi—N1b—O1am^xi	3.7 (6)
O4b—Ho3b—Hgbb	78.5 (5)	Ho1a^xi—N1b—N2b	143.0 (5)
Cbb—Ho3b—O3bm	42.6 (7)	Ho1a^xi—N1b—N3b	147.6 (5)
Cbb—Ho3b—O4bm	31.8 (3)	Ho1a^xi—N1b—N4b	143.6 (5)
Cbb—Ho3b—N3b	142.5 (10)	Ho1a^xi—N1b—Ccb	113.3 (5)
Cbb—Ho3b—Ccb	116.4 (7)	Ho1a^xi—N1b—Hcbb	97.8 (5)
Cbb—Ho3b—Hcbb	111.0 (6)	Ho1a^xi—N1b—Hcab	98.4 (5)
Cbb—Ho3b—Hcab	98.3 (6)	Ho1a^xi—N1b—Cdb	109.7 (5)
Cbb—Ho3b—Cfb	168.5 (8)	Ho1a^xi—N1b—Hdab	95.4 (6)
Cbb—Ho3b—Hfab	151.1 (9)	Ho1a^xi—N1b—Hdbb	93.7 (5)
Cbb—Ho3b—Hfbb	170.2 (8)	Ho1a^xi—N1b—Ceb	109.2 (5)
Cbb—Ho3b—Cgb	128.7 (8)	Ho1a^xi—N1b—Heab	93.7 (5)
Cbb—Ho3b—Hgab	130.4 (8)	Ho1a^xi—N1b—Hebb	95.3 (6)
Cbb—Ho3b—Hgbb	109.0 (7)	Ho1a^xi—N1b—Cfb	151.9 (5)
O3bm—Ho3b—O4bm	74.4 (9)	Ho1a^xi—N1b—Cgb	152.2 (5)
O3bm—Ho3b—N3b	167.2 (17)	Ho1a^xi—N1b—Chb	148.2 (5)
O3bm—Ho3b—Ccb	140.3 (13)	O1am^xi—N1b—N2b	145.65 (4)
O3bm—Ho3b—Hcbb	121.9 (13)	O1am^xi—N1b—N3b	148.09 (4)
O3bm—Ho3b—Hcab	132.1 (11)	O1am^xi—N1b—N4b	140.16 (5)
O3bm—Ho3b—Cfb	139.1 (14)	O1am^xi—N1b—Ccb	113.88 (5)
O3bm—Ho3b—Hfab	121.1 (14)	O1am^xi—N1b—Hcbb	99.81 (3)
O3bm—Ho3b—Hfbb	130.4 (13)	O1am^xi—N1b—Hcab	97.54 (3)
O3bm—Ho3b—Cgb	163.9 (15)	O1am^xi—N1b—Cdb	106.22 (6)
O3bm—Ho3b—Hgab	147.5 (13)	O1am^xi—N1b—Hdab	91.69 (3)
O3bm—Ho3b—Hgbb	148.7 (14)	O1am^xi—N1b—Hdbb	91.08 (3)
O4bm—Ho3b—N3b	112.3 (8)	O1am^xi—N1b—Ceb	111.95 (6)
O4bm—Ho3b—Ccb	93.7 (5)	O1am^xi—N1b—Heab	95.28 (3)
O4bm—Ho3b—Hcbb	98.0 (5)	O1am^xi—N1b—Hebb	98.83 (3)
O4bm—Ho3b—Hcab	73.2 (4)	O1am^xi—N1b—Cfb	155.45 (4)
O4bm—Ho3b—Cfb	144.6 (8)	O1am^xi—N1b—Cgb	149.13 (4)
O4bm—Ho3b—Hfab	149.7 (7)	O1am^xi—N1b—Chb	147.42 (4)
O4bm—Ho3b—Hfbb	153.0 (8)	N2b—N1b—N3b	59.95 (4)
O4bm—Ho3b—Cgb	97.5 (6)	N2b—N1b—N4b	60.03 (5)
O4bm—Ho3b—Hgab	103.9 (6)	N2b—N1b—Ccb	89.07 (6)
O4bm—Ho3b—Hgbb	77.7 (5)	N2b—N1b—Hcbb	89.30 (4)
N3b—Ho3b—Ccb	32.0 (3)	N2b—N1b—Hcab	112.34 (4)
N3b—Ho3b—Hcbb	47.8 (4)	N2b—N1b—Cdb	88.77 (6)
N3b—Ho3b—Hcab	45.7 (4)	N2b—N1b—Hdab	112.56 (5)
N3b—Ho3b—Cfb	32.5 (3)	N2b—N1b—Hdbb	88.72 (4)
N3b—Ho3b—Hfab	47.8 (4)	N2b—N1b—Ceb	33.91 (6)
N3b—Ho3b—Hfbb	46.2 (3)	N2b—N1b—Heab	52.32 (4)
N3b—Ho3b—Cgb	28.9 (3)	N2b—N1b—Hebb	52.30 (4)
N3b—Ho3b—Hgab	43.6 (4)	N2b—N1b—Cfb	31.07 (4)
N3b—Ho3b—Hgbb	42.9 (4)	N2b—N1b—Cgb	64.62 (4)
Ccb—Ho3b—Hcbb	20.96 (13)	N2b—N1b—Chb	31.30 (4)
Ccb—Ho3b—Hcab	20.57 (13)	N3b—N1b—N4b	59.80 (4)
Ccb—Ho3b—Cfb	54.1 (3)	N3b—N1b—Ccb	34.34 (5)
Ccb—Ho3b—Hfab	57.3 (3)	N3b—N1b—Hcbb	53.03 (4)
Ccb—Ho3b—Hfbb	73.4 (4)	N3b—N1b—Hcab	52.58 (4)
Ccb—Ho3b—Cgb	52.5 (3)	N3b—N1b—Cdb	88.80 (6)
Ccb—Ho3b—Hgab	71.7 (4)	N3b—N1b—Hdab	89.40 (5)
Ccb—Ho3b—Hgbb	54.7 (3)	N3b—N1b—Hdbb	112.36 (5)
Hcbb—Ho3b—Hcab	33.8 (2)	N3b—N1b—Ceb	88.72 (6)
Hcbb—Ho3b—Cfb	57.7 (3)	N3b—N1b—Heab	112.14 (4)
Hcbb—Ho3b—Hfab	51.8 (3)	N3b—N1b—Hebb	89.01 (5)
Hcbb—Ho3b—Hfbb	78.4 (4)	N3b—N1b—Cfb	31.65 (4)
Hcbb—Ho3b—Cgb	72.5 (4)	N3b—N1b—Cgb	31.42 (4)
Hcbb—Ho3b—Hgab	90.6 (5)	N3b—N1b—Chb	64.18 (4)
Hcbb—Ho3b—Hgbb	75.6 (4)	N4b—N1b—Ccb	89.04 (6)
Hcab—Ho3b—Cfb	73.3 (4)	N4b—N1b—Hcbb	112.65 (5)
Hcab—Ho3b—Hfab	77.9 (4)	N4b—N1b—Hcab	88.90 (4)
Hcab—Ho3b—Hfbb	91.1 (5)	N4b—N1b—Cdb	33.95 (6)
Hcab—Ho3b—Cgb	55.1 (3)	N4b—N1b—Hdab	52.75 (4)
Hcab—Ho3b—Hgab	75.1 (4)	N4b—N1b—Hdbb	52.69 (4)
Hcab—Ho3b—Hgbb	48.5 (3)	N4b—N1b—Ceb	88.98 (6)
Cfb—Ho3b—Hfab	20.93 (12)	N4b—N1b—Heab	88.56 (4)
Cfb—Ho3b—Hfbb	20.65 (11)	N4b—N1b—Hebb	112.16 (4)
Cfb—Ho3b—Cgb	52.9 (3)	N4b—N1b—Cfb	64.33 (4)
Cfb—Ho3b—Hgab	55.9 (3)	N4b—N1b—Cgb	31.27 (4)
Cfb—Ho3b—Hgbb	71.6 (4)	N4b—N1b—Chb	31.46 (4)
Hfab—Ho3b—Hfbb	34.11 (18)	Ccb—N1b—Hcbb	27.41 (6)
Hfab—Ho3b—Cgb	72.7 (4)	Ccb—N1b—Hcab	27.25 (6)
Hfab—Ho3b—Hgab	76.8 (4)	Ccb—N1b—Cdb	108.43 (8)
Hfab—Ho3b—Hgbb	90.1 (5)	Ccb—N1b—Hdab	94.47 (7)
Hfbb—Ho3b—Cgb	55.7 (3)	Ccb—N1b—Hdbb	135.99 (7)
Hfbb—Ho3b—Hgab	49.8 (3)	Ccb—N1b—Ceb	108.04 (8)
Hfbb—Ho3b—Hgbb	75.5 (4)	Ccb—N1b—Heab	135.68 (7)
Cgb—Ho3b—Hgab	20.07 (12)	Ccb—N1b—Hebb	94.03 (7)
Cgb—Ho3b—Hgbb	19.87 (13)	Ccb—N1b—Cfb	58.00 (6)
Hgab—Ho3b—Hgbb	32.6 (2)	Ccb—N1b—Cgb	57.78 (6)
O3b—O4b—Ho3b	23.4 (4)	Ccb—N1b—Chb	98.52 (6)
O3b—O4b—H8bb^ix	137.57 (10)	Hcbb—N1b—Hcab	46.91 (3)
O3b—O4b—C9b	92.91 (9)	Hcbb—N1b—Cdb	135.83 (7)
O3b—O4b—H9bb	101.43 (9)	Hcbb—N1b—Hdab	119.48 (4)
O3b—O4b—H9ba	106.25 (10)	Hcbb—N1b—Hdbb	163.34 (5)
O3b—O4b—Cab	60.99 (8)	Hcbb—N1b—Ceb	93.87 (7)
O3b—O4b—Habb	56.87 (7)	Hcbb—N1b—Heab	119.41 (5)
O3b—O4b—Cbb	29.83 (9)	Hcbb—N1b—Hebb	72.63 (4)
O3b—O4b—O3bm	1.02 (5)	Hcbb—N1b—Cfb	62.09 (4)
O3b—O4b—O4bm	145 (3)	Hcbb—N1b—Cgb	82.28 (4)
O3b—O4b—Hfaa	134.75 (10)	Hcbb—N1b—Chb	111.14 (4)
O3b—O4b—Hfba	147.27 (10)	Hcab—N1b—Cdb	94.08 (6)
O3b—O4b—Hhba^iv	92.01 (9)	Hcab—N1b—Hdab	72.81 (4)
Ho3b—O4b—H8bb^ix	136.0 (4)	Hcab—N1b—Hdbb	119.44 (5)
Ho3b—O4b—C9b	116.2 (4)	Hcab—N1b—Ceb	135.28 (7)
Ho3b—O4b—H9bb	124.2 (4)	Hcab—N1b—Heab	162.81 (5)
Ho3b—O4b—H9ba	127.9 (4)	Hcab—N1b—Hebb	119.15 (5)
Ho3b—O4b—Cab	84.3 (4)	Hcab—N1b—Cfb	82.14 (4)
Ho3b—O4b—Habb	78.4 (4)	Hcab—N1b—Cgb	61.38 (4)
Ho3b—O4b—Cbb	53.2 (4)	Hcab—N1b—Chb	110.80 (4)
Ho3b—O4b—O3bm	22.4 (4)	Cdb—N1b—Hdab	27.43 (5)
Ho3b—O4b—O4bm	121 (3)	Cdb—N1b—Hdbb	27.58 (5)
Ho3b—O4b—Hfaa	118.7 (4)	Cdb—N1b—Ceb	108.12 (8)
Ho3b—O4b—Hfba	123.8 (4)	Cdb—N1b—Heab	93.27 (6)
Ho3b—O4b—Hhba^iv	94.9 (4)	Cdb—N1b—Hebb	135.07 (6)
H8bb^ix—O4b—C9b	85.37 (6)	Cdb—N1b—Cfb	98.28 (6)
H8bb^ix—O4b—H9bb	67.06 (4)	Cdb—N1b—Cgb	57.38 (6)
H8bb^ix—O4b—H9ba	85.71 (5)	Cdb—N1b—Chb	57.47 (6)
H8bb^ix—O4b—Cab	109.72 (8)	Hdab—N1b—Hdbb	47.00 (3)
H8bb^ix—O4b—Habb	124.66 (7)	Hdab—N1b—Ceb	135.55 (7)
H8bb^ix—O4b—Cbb	128.46 (14)	Hdab—N1b—Heab	118.27 (4)
H8bb^ix—O4b—O3bm	137.72 (8)	Hdab—N1b—Hebb	162.48 (4)
H8bb^ix—O4b—O4bm	54 (3)	Hdab—N1b—Cfb	111.38 (4)
H8bb^ix—O4b—Hfaa	84.69 (6)	Hdab—N1b—Cgb	61.71 (4)
H8bb^ix—O4b—Hfba	56.68 (5)	Hdab—N1b—Chb	82.05 (4)
H8bb^ix—O4b—Hhba^iv	128.29 (7)	Hdbb—N1b—Ceb	93.69 (6)
C9b—O4b—H9bb	19.71 (3)	Hdbb—N1b—Heab	71.56 (4)
C9b—O4b—H9ba	20.19 (3)	Hdbb—N1b—Hebb	118.35 (4)
C9b—O4b—Cab	31.96 (4)	Hdbb—N1b—Cfb	110.59 (4)
C9b—O4b—Habb	41.00 (4)	Hdbb—N1b—Cgb	81.93 (4)
C9b—O4b—Cbb	63.08 (10)	Hdbb—N1b—Chb	61.43 (4)
C9b—O4b—O3bm	93.93 (8)	Ceb—N1b—Heab	27.67 (6)
C9b—O4b—O4bm	123 (3)	Ceb—N1b—Hebb	26.96 (6)
C9b—O4b—Hfaa	109.01 (6)	Ceb—N1b—Cfb	57.08 (6)
C9b—O4b—Hfba	119.50 (7)	Ceb—N1b—Cgb	98.53 (6)
C9b—O4b—Hhba^iv	76.79 (6)	Ceb—N1b—Chb	57.52 (6)
H9bb—O4b—H9ba	32.69 (2)	Heab—N1b—Hebb	47.09 (3)
H9bb—O4b—Cab	44.65 (4)	Heab—N1b—Cfb	81.45 (4)
H9bb—O4b—Habb	57.78 (4)	Heab—N1b—Cgb	110.62 (4)
H9bb—O4b—Cbb	73.11 (10)	Heab—N1b—Chb	61.07 (4)
H9bb—O4b—O3bm	102.42 (8)	Hebb—N1b—Cfb	61.22 (4)
H9bb—O4b—O4bm	112 (3)	Hebb—N1b—Cgb	110.99 (4)
H9bb—O4b—Hfaa	112.48 (6)	Hebb—N1b—Chb	81.55 (4)
H9bb—O4b—Hfba	110.78 (7)	Cfb—N1b—Cgb	50.24 (4)
H9bb—O4b—Hhba^iv	94.30 (6)	Cfb—N1b—Chb	49.55 (4)
H9ba—O4b—Cab	47.16 (4)	Cgb—N1b—Chb	49.95 (4)
H9ba—O4b—Habb	49.63 (4)	Hcaa^x—N2b—Hdaa^x	51.39 (3)
H9ba—O4b—Cbb	77.36 (11)	Hcaa^x—N2b—Hgba^x	50.54 (3)
H9ba—O4b—O3bm	107.20 (8)	Hcaa^x—N2b—N1b	133.42 (6)
H9ba—O4b—O4bm	108 (2)	Hcaa^x—N2b—N3b	122.80 (6)
H9ba—O4b—Hfaa	88.97 (5)	Hcaa^x—N2b—N4b	166.67 (6)
H9ba—O4b—Hfba	104.02 (6)	Hcaa^x—N2b—Ccb	125.56 (6)
H9ba—O4b—Hhba^iv	62.08 (4)	Hcaa^x—N2b—Cdb	161.28 (6)
Cab—O4b—Habb	16.76 (3)	Hcaa^x—N2b—Ceb	103.80 (8)
Cab—O4b—Cbb	31.17 (8)	Hcaa^x—N2b—Heab	100.87 (5)
Cab—O4b—O3bm	62.00 (6)	Hcaa^x—N2b—Hebb	81.04 (5)
Cab—O4b—O4bm	155 (3)	Hcaa^x—N2b—Cfb	90.09 (8)
Cab—O4b—Hfaa	129.95 (8)	Hcaa^x—N2b—Hfab	70.53 (5)
Cab—O4b—Hfba	150.99 (8)	Hcaa^x—N2b—Hfbb	84.08 (5)
Cab—O4b—Hhba^iv	78.08 (7)	Hcaa^x—N2b—Cgb	145.68 (6)
Habb—O4b—Cbb	30.09 (8)	Hcaa^x—N2b—Chb	135.20 (8)
Habb—O4b—O3bm	57.79 (5)	Hcaa^x—N2b—Hhbb	113.81 (5)
Habb—O4b—O4bm	155 (2)	Hcaa^x—N2b—Hhab	121.70 (5)
Habb—O4b—Hfaa	119.17 (7)	Hdaa^x—N2b—Hgba^x	49.80 (3)
Habb—O4b—Hfba	149.13 (7)	Hdaa^x—N2b—N1b	167.45 (6)
Habb—O4b—Hhba^iv	63.47 (5)	Hdaa^x—N2b—N3b	129.84 (5)
Cbb—O4b—O3bm	30.84 (7)	Hdaa^x—N2b—N4b	116.00 (5)
Cbb—O4b—O4bm	174 (3)	Hdaa^x—N2b—Ccb	160.34 (5)
Cbb—O4b—Hfaa	141.98 (14)	Hdaa^x—N2b—Cdb	140.22 (6)
Cbb—O4b—Hfba	174.85 (15)	Hdaa^x—N2b—Ceb	140.13 (8)
Cbb—O4b—Hhba^iv	85.00 (12)	Hdaa^x—N2b—Heab	117.01 (5)
O3bm—O4b—O4bm	143 (3)	Hdaa^x—N2b—Hebb	128.67 (6)
O3bm—O4b—Hfaa	134.15 (9)	Hdaa^x—N2b—Cfb	102.82 (7)
O3bm—O4b—Hfba	146.25 (9)	Hdaa^x—N2b—Hfab	103.23 (5)
O3bm—O4b—Hhba^iv	92.15 (8)	Hdaa^x—N2b—Hfbb	77.91 (4)
O4bm—O4b—Hfaa	40 (3)	Hdaa^x—N2b—Cgb	119.32 (5)
O4bm—O4b—Hfba	6 (3)	Hdaa^x—N2b—Chb	84.27 (7)
O4bm—O4b—Hhba^iv	97 (3)	Hdaa^x—N2b—Hhbb	63.47 (4)
Hfaa—O4b—Hfba	33.89 (3)	Hdaa^x—N2b—Hhab	79.81 (4)
Hfaa—O4b—Hhba^iv	57.50 (4)	Hgba^x—N2b—N1b	121.61 (5)
Hfba—O4b—Hhba^iv	91.27 (6)	Hgba^x—N2b—N3b	172.90 (7)
O1b—C1b—Ho1b	28.6 (5)	Hgba^x—N2b—N4b	127.31 (6)
O1b—C1b—O2b	123.13 (15)	Hgba^x—N2b—Ccb	147.36 (5)
O1b—C1b—C2b	112.31 (14)	Hgba^x—N2b—Cdb	120.98 (5)
O1b—C1b—H2ba	101.01 (12)	Hgba^x—N2b—Ceb	90.46 (7)
O1b—C1b—H2bb	92.44 (11)	Hgba^x—N2b—Heab	68.66 (4)
O1b—C1b—C3b	143.94 (12)	Hgba^x—N2b—Hebb	87.13 (5)
O1b—C1b—H3bb	142.28 (11)	Hgba^x—N2b—Cfb	139.96 (9)
O1b—C1b—H3ba	161.06 (12)	Hgba^x—N2b—Hfab	120.01 (6)
O1b—C1b—O1bm	0.91 (9)	Hgba^x—N2b—Hfbb	124.24 (6)
O1b—C1b—O2bm	122.41 (12)	Hgba^x—N2b—Cgb	155.55 (6)
O1b—C1b—Hhbb^viii	113.32 (10)	Hgba^x—N2b—Chb	98.40 (7)
Ho1b—C1b—O2b	94.5 (5)	Hgba^x—N2b—Hhbb	96.22 (5)
Ho1b—C1b—C2b	140.7 (5)	Hgba^x—N2b—Hhab	74.86 (4)
Ho1b—C1b—H2ba	124.4 (5)	N1b—N2b—N3b	60.02 (4)
Ho1b—C1b—H2bb	120.2 (5)	N1b—N2b—N4b	59.87 (4)
Ho1b—C1b—C3b	172.2 (5)	N1b—N2b—Ccb	31.40 (3)
Ho1b—C1b—H3bb	157.6 (5)	N1b—N2b—Cdb	31.38 (3)
Ho1b—C1b—H3ba	166.0 (5)	N1b—N2b—Ceb	34.23 (6)
Ho1b—C1b—O1bm	27.8 (5)	N1b—N2b—Heab	53.04 (4)
Ho1b—C1b—O2bm	93.9 (5)	N1b—N2b—Hebb	52.60 (4)
Ho1b—C1b—Hhbb^viii	102.1 (5)	N1b—N2b—Cfb	89.19 (7)
O2b—C1b—C2b	124.52 (14)	N1b—N2b—Hfab	89.08 (5)
O2b—C1b—H2ba	128.11 (12)	N1b—N2b—Hfbb	112.91 (5)
O2b—C1b—H2bb	141.13 (13)	N1b—N2b—Cgb	64.15 (4)
O2b—C1b—C3b	92.64 (12)	N1b—N2b—Chb	88.61 (8)
O2b—C1b—H3bb	87.08 (12)	N1b—N2b—Hhbb	112.70 (6)
O2b—C1b—H3ba	74.62 (11)	N1b—N2b—Hhab	89.12 (5)
O2b—C1b—O1bm	122.24 (12)	N3b—N2b—N4b	59.78 (5)
O2b—C1b—O2bm	1.45 (9)	N3b—N2b—Ccb	31.48 (4)
O2b—C1b—Hhbb^viii	65.81 (10)	N3b—N2b—Cdb	64.41 (5)
C2b—C1b—H2ba	27.78 (5)	N3b—N2b—Ceb	89.07 (7)
C2b—C1b—H2bb	26.92 (5)	N3b—N2b—Heab	112.93 (6)
C2b—C1b—C3b	32.57 (6)	N3b—N2b—Hebb	89.25 (5)
C2b—C1b—H3bb	44.96 (6)	N3b—N2b—Cfb	34.32 (7)
C2b—C1b—H3ba	50.13 (6)	N3b—N2b—Hfab	52.97 (5)
C2b—C1b—O1bm	113.21 (10)	N3b—N2b—Hfbb	53.04 (4)
C2b—C1b—O2bm	125.28 (11)	N3b—N2b—Cgb	31.29 (4)
C2b—C1b—Hhbb^viii	91.91 (6)	N3b—N2b—Chb	88.47 (8)
H2ba—C1b—H2bb	45.70 (2)	N3b—N2b—Hhbb	89.01 (6)
H2ba—C1b—C3b	51.93 (4)	N3b—N2b—Hhab	112.24 (7)
H2ba—C1b—H3bb	69.45 (3)	N4b—N2b—Ccb	64.35 (5)
H2ba—C1b—H3ba	60.19 (3)	N4b—N2b—Cdb	31.32 (4)
H2ba—C1b—O1bm	101.89 (8)	N4b—N2b—Ceb	89.10 (8)
H2ba—C1b—O2bm	129.43 (8)	N4b—N2b—Heab	88.89 (6)
H2ba—C1b—Hhbb^viii	72.85 (3)	N4b—N2b—Hebb	112.29 (6)
H2bb—C1b—C3b	51.96 (4)	N4b—N2b—Cfb	89.00 (8)
H2bb—C1b—H3bb	54.10 (3)	N4b—N2b—Hfab	112.59 (6)
H2bb—C1b—H3ba	72.96 (3)	N4b—N2b—Hfbb	88.96 (6)
H2bb—C1b—O1bm	93.22 (7)	N4b—N2b—Cgb	31.13 (4)
H2bb—C1b—O2bm	141.16 (9)	N4b—N2b—Chb	33.80 (6)
H2bb—C1b—Hhbb^viii	117.27 (4)	N4b—N2b—Hhbb	53.01 (5)
C3b—C1b—H3bb	20.09 (3)	N4b—N2b—Hhab	52.67 (5)
C3b—C1b—H3ba	21.65 (3)	Ccb—N2b—Cdb	50.00 (4)
C3b—C1b—O1bm	144.78 (8)	Ccb—N2b—Ceb	57.60 (6)
C3b—C1b—O2bm	93.24 (8)	Ccb—N2b—Heab	82.44 (5)
C3b—C1b—Hhbb^viii	83.65 (4)	Ccb—N2b—Hebb	61.55 (4)
H3bb—C1b—H3ba	33.381 (14)	Ccb—N2b—Cfb	57.79 (6)
H3bb—C1b—O1bm	142.77 (7)	Ccb—N2b—Hfab	61.60 (4)
H3bb—C1b—O2bm	87.22 (7)	Ccb—N2b—Hfbb	82.45 (5)
H3bb—C1b—Hhbb^viii	98.93 (4)	Ccb—N2b—Cgb	49.81 (4)
H3ba—C1b—O1bm	161.97 (8)	Ccb—N2b—Chb	98.15 (8)
H3ba—C1b—O2bm	75.49 (6)	Ccb—N2b—Hhbb	111.23 (6)
H3ba—C1b—Hhbb^viii	65.55 (3)	Ccb—N2b—Hhab	111.05 (6)
O1bm—C1b—O2bm	121.51 (8)	Cdb—N2b—Ceb	57.78 (7)
O1bm—C1b—Hhbb^viii	113.32 (6)	Cdb—N2b—Heab	61.55 (5)
O2bm—C1b—Hhbb^viii	67.21 (5)	Cdb—N2b—Hebb	81.87 (5)
O1b—C2b—O2b	55.74 (8)	Cdb—N2b—Cfb	98.73 (8)
O1b—C2b—C1b	31.35 (8)	Cdb—N2b—Hfab	111.15 (5)
O1b—C2b—H2ba	94.10 (9)	Cdb—N2b—Hfbb	111.19 (6)
O1b—C2b—H2bb	85.78 (8)	Cdb—N2b—Cgb	49.68 (4)
O1b—C2b—C3b	145.55 (10)	Cdb—N2b—Chb	57.23 (7)
O1b—C2b—H3bb	127.46 (7)	Cdb—N2b—Hhbb	82.22 (5)
O1b—C2b—H3ba	126.91 (8)	Cdb—N2b—Hhab	61.55 (5)
O1b—C2b—C4b	179.83 (8)	Ceb—N2b—Heab	28.09 (5)
O1b—C2b—H4bb	158.45 (7)	Ceb—N2b—Hebb	27.03 (6)
O1b—C2b—H4ba	158.66 (7)	Ceb—N2b—Cfb	108.38 (9)
O1b—C2b—O1bm	0.15 (5)	Ceb—N2b—Hfab	93.66 (8)
O1b—C2b—O2bm	55.47 (6)	Ceb—N2b—Hfbb	136.14 (8)
O2b—C2b—C1b	24.40 (8)	Ceb—N2b—Cgb	98.38 (8)
O2b—C2b—H2ba	112.01 (9)	Ceb—N2b—Chb	108.29 (11)
O2b—C2b—H2bb	125.40 (9)	Ceb—N2b—Hhbb	136.11 (10)
O2b—C2b—C3b	91.32 (9)	Ceb—N2b—Hhab	94.30 (8)
O2b—C2b—H3bb	84.65 (7)	Heab—N2b—Hebb	47.43 (4)
O2b—C2b—H3ba	71.70 (6)	Heab—N2b—Cfb	136.44 (8)
O2b—C2b—C4b	124.10 (8)	Heab—N2b—Hfab	119.49 (6)
O2b—C2b—H4bb	141.17 (7)	Heab—N2b—Hfbb	164.13 (6)
O2b—C2b—H4ba	127.09 (7)	Heab—N2b—Cgb	110.82 (6)
O2b—C2b—O1bm	55.63 (5)	Heab—N2b—Chb	93.46 (8)
O2b—C2b—O2bm	0.68 (5)	Heab—N2b—Hhbb	118.69 (7)
C1b—C2b—H2ba	106.28 (10)	Heab—N2b—Hhab	71.98 (5)
C1b—C2b—H2bb	108.76 (9)	Hebb—N2b—Cfb	94.22 (8)
C1b—C2b—C3b	115.13 (11)	Hebb—N2b—Hfab	72.32 (5)
C1b—C2b—H3bb	103.86 (8)	Hebb—N2b—Hfbb	119.76 (7)
C1b—C2b—H3ba	95.95 (8)	Hebb—N2b—Cgb	110.82 (5)
C1b—C2b—C4b	148.49 (10)	Hebb—N2b—Chb	135.30 (9)
C1b—C2b—H4bb	162.39 (9)	Hebb—N2b—Hhbb	163.10 (8)
C1b—C2b—H4ba	148.03 (8)	Hebb—N2b—Hhab	119.07 (7)
C1b—C2b—O1bm	31.24 (6)	Cfb—N2b—Hfab	27.66 (6)
C1b—C2b—O2bm	24.12 (6)	Cfb—N2b—Hfbb	27.78 (5)
H2ba—C2b—H2bb	107.42 (12)	Cfb—N2b—Cgb	57.87 (8)
H2ba—C2b—C3b	109.12 (9)	Cfb—N2b—Chb	108.03 (11)
H2ba—C2b—H3bb	135.32 (9)	Cfb—N2b—Hhbb	93.79 (8)
H2ba—C2b—H3ba	99.09 (8)	Cfb—N2b—Hhab	135.46 (10)
H2ba—C2b—C4b	85.92 (7)	Hfab—N2b—Hfbb	47.74 (4)
H2ba—C2b—H4bb	89.40 (6)	Hfab—N2b—Cgb	82.32 (5)
H2ba—C2b—H4ba	64.83 (5)	Hfab—N2b—Chb	135.66 (9)
H2ba—C2b—O1bm	94.25 (7)	Hfab—N2b—Hhbb	119.16 (6)
H2ba—C2b—O2bm	112.58 (8)	Hfab—N2b—Hhab	163.06 (7)
H2bb—C2b—C3b	109.82 (10)	Hfbb—N2b—Cgb	61.90 (5)
H2bb—C2b—H3bb	92.93 (8)	Hfbb—N2b—Chb	93.48 (8)
H2bb—C2b—H3ba	136.22 (9)	Hfbb—N2b—Hhbb	71.72 (5)
H2bb—C2b—C4b	94.38 (7)	Hfbb—N2b—Hhab	118.37 (7)
H2bb—C2b—H4bb	72.90 (6)	Cgb—N2b—Chb	57.19 (7)
H2bb—C2b—H4ba	103.15 (7)	Cgb—N2b—Hhbb	61.83 (5)
H2bb—C2b—O1bm	85.78 (7)	Cgb—N2b—Hhab	81.74 (6)
H2bb—C2b—O2bm	124.74 (8)	Chb—N2b—Hhbb	27.83 (6)
C3b—C2b—H3bb	26.64 (4)	Chb—N2b—Hhab	27.44 (6)
C3b—C2b—H3ba	26.85 (5)	Hhbb—N2b—Hhab	46.96 (4)
C3b—C2b—C4b	34.31 (6)	O3b—N3b—Ho3b	4.1 (6)
C3b—C2b—H4bb	50.27 (5)	O3b—N3b—O3bm	0.50 (4)
C3b—C2b—H4ba	49.33 (5)	O3b—N3b—N1b	140.04 (6)
C3b—C2b—O1bm	145.42 (8)	O3b—N3b—N2b	139.14 (8)
C3b—C2b—O2bm	91.47 (7)	O3b—N3b—N4b	153.64 (8)
H3bb—C2b—H3ba	45.25 (3)	O3b—N3b—Ccb	106.28 (8)
H3bb—C2b—C4b	52.47 (4)	O3b—N3b—Hcbb	88.60 (6)
H3bb—C2b—H4bb	58.62 (3)	O3b—N3b—Hcab	94.67 (6)
H3bb—C2b—H4ba	72.07 (3)	O3b—N3b—Cdb	154.84 (7)
H3bb—C2b—O1bm	127.30 (5)	O3b—N3b—Ceb	141.80 (8)
H3bb—C2b—O2bm	84.50 (4)	O3b—N3b—Cfb	105.88 (9)
H3ba—C2b—C4b	52.92 (4)	O3b—N3b—Hfab	88.59 (7)
H3ba—C2b—H4bb	73.21 (3)	O3b—N3b—Hfbb	94.41 (7)
H3ba—C2b—H4ba	58.00 (3)	O3b—N3b—Cgb	119.75 (9)
H3ba—C2b—O1bm	126.82 (5)	O3b—N3b—Hgab	103.29 (6)
H3ba—C2b—O2bm	72.05 (4)	O3b—N3b—Hgbb	103.90 (7)
C4b—C2b—H4bb	21.72 (3)	O3b—N3b—Chb	153.71 (7)
C4b—C2b—H4ba	21.33 (3)	Ho3b—N3b—O3bm	4.3 (6)
C4b—C2b—O1bm	179.72 (7)	Ho3b—N3b—N1b	142.8 (5)
C4b—C2b—O2bm	124.36 (6)	Ho3b—N3b—N2b	141.4 (5)
H4bb—C2b—H4ba	34.315 (13)	Ho3b—N3b—N4b	149.5 (6)
H4bb—C2b—O1bm	158.47 (5)	Ho3b—N3b—Ccb	108.7 (5)
H4bb—C2b—O2bm	141.22 (5)	Ho3b—N3b—Hcbb	92.1 (5)
H4ba—C2b—O1bm	158.80 (5)	Ho3b—N3b—Hcab	95.4 (5)
H4ba—C2b—O2bm	127.60 (5)	Ho3b—N3b—Cdb	153.8 (5)
O1bm—C2b—O2bm	55.37 (2)	Ho3b—N3b—Ceb	145.9 (6)
O2b—C3b—C1b	24.78 (5)	Ho3b—N3b—Cfb	107.8 (5)
O2b—C3b—C2b	56.79 (7)	Ho3b—N3b—Hfab	91.8 (6)
O2b—C3b—H2ba	70.28 (5)	Ho3b—N3b—Hfbb	94.6 (5)
O2b—C3b—H2bb	75.03 (5)	Ho3b—N3b—Cgb	115.6 (6)
O2b—C3b—H3bb	88.78 (8)	Ho3b—N3b—Hgab	99.4 (6)
O2b—C3b—H3ba	66.28 (7)	Ho3b—N3b—Hgbb	100.3 (6)
O2b—C3b—C4b	161.65 (9)	Ho3b—N3b—Chb	152.2 (5)
O2b—C3b—H4bb	151.53 (7)	O3bm—N3b—N1b	140.30 (5)
O2b—C3b—H4ba	135.15 (6)	O3bm—N3b—N2b	138.67 (6)
O2b—C3b—C5b	156.64 (7)	O3bm—N3b—N4b	153.78 (6)
O2b—C3b—H5bb	150.34 (7)	O3bm—N3b—Ccb	106.60 (7)
O2b—C3b—H5ba	135.47 (6)	O3bm—N3b—Hcbb	88.76 (5)
O2b—C3b—O2bm	0.56 (4)	O3bm—N3b—Hcab	95.12 (4)
C1b—C3b—C2b	32.29 (6)	O3bm—N3b—Cdb	155.34 (5)
C1b—C3b—H2ba	50.37 (4)	O3bm—N3b—Ceb	141.63 (6)
C1b—C3b—H2bb	51.15 (4)	O3bm—N3b—Cfb	105.40 (8)
C1b—C3b—H3bb	95.88 (7)	O3bm—N3b—Hfab	88.18 (5)
C1b—C3b—H3ba	86.68 (7)	O3bm—N3b—Hfbb	93.92 (5)
C1b—C3b—C4b	143.06 (9)	O3bm—N3b—Cgb	119.90 (8)
C1b—C3b—H4bb	126.83 (6)	O3bm—N3b—Hgab	103.24 (5)
C1b—C3b—H4ba	122.78 (6)	O3bm—N3b—Hgbb	104.24 (5)
C1b—C3b—C5b	173.68 (6)	O3bm—N3b—Chb	153.28 (5)
C1b—C3b—H5bb	165.62 (5)	N1b—N3b—N2b	60.03 (4)
C1b—C3b—H5ba	156.82 (5)	N1b—N3b—N4b	59.99 (4)
C1b—C3b—O2bm	24.73 (3)	N1b—N3b—Ccb	34.25 (5)
C2b—C3b—H2ba	26.67 (5)	N1b—N3b—Hcbb	52.78 (4)
C2b—C3b—H2bb	26.41 (5)	N1b—N3b—Hcab	53.11 (4)
C2b—C3b—H3bb	109.11 (9)	N1b—N3b—Cdb	31.37 (4)
C2b—C3b—H3ba	109.43 (10)	N1b—N3b—Ceb	31.56 (3)
C2b—C3b—C4b	111.57 (10)	N1b—N3b—Cfb	88.65 (7)
C2b—C3b—H4bb	95.34 (8)	N1b—N3b—Hfab	88.59 (5)
C2b—C3b—H4ba	96.79 (7)	N1b—N3b—Hfbb	112.20 (5)
C2b—C3b—C5b	144.10 (9)	N1b—N3b—Cgb	88.58 (8)
C2b—C3b—H5bb	149.00 (8)	N1b—N3b—Hgab	112.60 (6)
C2b—C3b—H5ba	154.48 (7)	N1b—N3b—Hgbb	88.52 (5)
C2b—C3b—O2bm	56.81 (5)	N1b—N3b—Chb	64.39 (4)
H2ba—C3b—H2bb	44.91 (3)	N2b—N3b—N4b	60.12 (5)
H2ba—C3b—H3bb	135.34 (9)	N2b—N3b—Ccb	89.08 (7)
H2ba—C3b—H3ba	99.45 (8)	N2b—N3b—Hcbb	89.21 (5)
H2ba—C3b—C4b	93.48 (8)	N2b—N3b—Hcab	112.95 (6)
H2ba—C3b—H4bb	87.02 (5)	N2b—N3b—Cdb	64.39 (5)
H2ba—C3b—H4ba	73.05 (4)	N2b—N3b—Ceb	31.28 (4)
H2ba—C3b—C5b	124.02 (6)	N2b—N3b—Cfb	33.68 (6)
H2ba—C3b—H5bb	139.33 (5)	N2b—N3b—Hfab	52.16 (5)
H2ba—C3b—H5ba	128.20 (5)	N2b—N3b—Hfbb	52.32 (4)
H2ba—C3b—O2bm	70.54 (3)	N2b—N3b—Cgb	89.16 (8)
H2bb—C3b—H3bb	92.42 (7)	N2b—N3b—Hgab	89.66 (5)
H2bb—C3b—H3ba	135.40 (9)	N2b—N3b—Hgbb	112.99 (6)
H2bb—C3b—C4b	99.82 (8)	N2b—N3b—Chb	31.36 (4)
H2bb—C3b—H4bb	76.75 (4)	N4b—N3b—Ccb	89.14 (8)
H2bb—C3b—H4ba	96.31 (5)	N4b—N3b—Hcbb	112.58 (6)
H2bb—C3b—C5b	128.32 (6)	N4b—N3b—Hcab	89.36 (6)
H2bb—C3b—H5bb	124.61 (5)	N4b—N3b—Cdb	31.32 (4)
H2bb—C3b—H5ba	148.73 (5)	N4b—N3b—Ceb	64.55 (5)
H2bb—C3b—O2bm	74.85 (3)	N4b—N3b—Cfb	88.78 (8)
H3bb—C3b—H3ba	107.61 (12)	N4b—N3b—Hfab	112.13 (6)
H3bb—C3b—C4b	109.20 (9)	N4b—N3b—Hfbb	88.76 (5)
H3bb—C3b—H4bb	96.18 (7)	N4b—N3b—Cgb	33.90 (6)
H3bb—C3b—H4ba	135.97 (9)	N4b—N3b—Hgab	52.83 (5)
H3bb—C3b—C5b	90.42 (7)	N4b—N3b—Hgbb	52.97 (5)
H3bb—C3b—H5bb	69.97 (6)	N4b—N3b—Chb	31.52 (4)
H3bb—C3b—H5ba	94.60 (7)	Ccb—N3b—Hcbb	27.25 (6)
H3bb—C3b—O2bm	88.26 (6)	Ccb—N3b—Hcab	27.71 (6)
H3ba—C3b—C4b	109.83 (9)	Ccb—N3b—Cdb	57.83 (7)
H3ba—C3b—H4bb	136.82 (8)	Ccb—N3b—Ceb	57.80 (6)
H3ba—C3b—H4ba	95.82 (7)	Ccb—N3b—Cfb	108.02 (10)
H3ba—C3b—C5b	91.83 (7)	Ccb—N3b—Hfab	93.57 (8)
H3ba—C3b—H5bb	99.83 (7)	Ccb—N3b—Hfbb	135.54 (9)
H3ba—C3b—H5ba	70.44 (6)	Ccb—N3b—Cgb	107.92 (11)
H3ba—C3b—O2bm	66.65 (5)	Ccb—N3b—Hgab	135.64 (10)
C4b—C3b—H4bb	27.02 (5)	Ccb—N3b—Hgbb	93.13 (9)
C4b—C3b—H4ba	26.78 (5)	Ccb—N3b—Chb	98.64 (7)
C4b—C3b—C5b	32.54 (6)	Hcbb—N3b—Hcab	47.00 (4)
C4b—C3b—H5bb	46.19 (6)	Hcbb—N3b—Cdb	82.09 (5)
C4b—C3b—H5ba	49.21 (6)	Hcbb—N3b—Ceb	61.76 (4)
C4b—C3b—O2bm	162.11 (8)	Hcbb—N3b—Cfb	93.96 (8)
H4bb—C3b—H4ba	45.18 (2)	Hcbb—N3b—Hfab	72.27 (5)
H4bb—C3b—C5b	51.66 (4)	Hcbb—N3b—Hfbb	119.22 (7)
H4bb—C3b—H5bb	55.02 (2)	Hcbb—N3b—Cgb	135.17 (9)
H4bb—C3b—H5ba	72.22 (3)	Hcbb—N3b—Hgab	162.87 (8)
H4bb—C3b—O2bm	151.41 (6)	Hcbb—N3b—Hgbb	117.99 (6)
H4ba—C3b—C5b	51.24 (4)	Hcbb—N3b—Chb	111.11 (6)
H4ba—C3b—H5bb	69.64 (3)	Hcab—N3b—Cdb	62.06 (4)
H4ba—C3b—H5ba	58.49 (2)	Hcab—N3b—Ceb	82.54 (5)
H4ba—C3b—O2bm	135.65 (5)	Hcab—N3b—Cfb	135.73 (9)
C5b—C3b—H5bb	20.57 (3)	Hcab—N3b—Hfab	118.97 (7)
C5b—C3b—H5ba	21.51 (3)	Hcab—N3b—Hfbb	163.20 (7)
C5b—C3b—O2bm	156.83 (6)	Hcab—N3b—Cgb	93.54 (8)
H5bb—C3b—H5ba	33.679 (13)	Hcab—N3b—Hgab	118.64 (7)
H5bb—C3b—O2bm	150.11 (5)	Hcab—N3b—Hgbb	71.30 (5)
H5ba—C3b—O2bm	135.72 (5)	Hcab—N3b—Chb	111.45 (6)
C2b—C4b—H2ba	21.71 (3)	Cdb—N3b—Ceb	50.02 (4)
C2b—C4b—H2bb	20.58 (3)	Cdb—N3b—Cfb	98.07 (8)
C2b—C4b—C3b	34.12 (6)	Cdb—N3b—Hfab	110.43 (6)
C2b—C4b—H3bb	52.19 (4)	Cdb—N3b—Hfbb	110.54 (5)
C2b—C4b—H3ba	52.50 (4)	Cdb—N3b—Cgb	57.21 (7)
C2b—C4b—H4bb	88.22 (7)	Cdb—N3b—Hgab	82.01 (5)
C2b—C4b—H4ba	90.11 (7)	Cdb—N3b—Hgbb	61.35 (5)
C2b—C4b—C5b	148.91 (9)	Cdb—N3b—Chb	49.85 (4)
C2b—C4b—H5bb	131.32 (6)	Ceb—N3b—Cfb	57.09 (7)
C2b—C4b—H5ba	128.64 (6)	Ceb—N3b—Hfab	60.89 (5)
C2b—C4b—C6b	176.15 (6)	Ceb—N3b—Hfbb	81.57 (5)
C2b—C4b—H6bb	158.82 (6)	Ceb—N3b—Cgb	98.45 (8)
C2b—C4b—H6ba	155.24 (5)	Ceb—N3b—Hgab	111.46 (6)
H2ba—C4b—H2bb	33.766 (13)	Ceb—N3b—Hgbb	111.01 (6)
H2ba—C4b—C3b	51.20 (6)	Ceb—N3b—Chb	49.84 (4)
H2ba—C4b—H3bb	73.09 (3)	Cfb—N3b—Hfab	27.33 (6)
H2ba—C4b—H3ba	60.57 (3)	Cfb—N3b—Hfbb	27.53 (6)
H2ba—C4b—H4bb	91.54 (7)	Cfb—N3b—Cgb	108.49 (10)
H2ba—C4b—H4ba	68.64 (6)	Cfb—N3b—Hgab	94.55 (8)
H2ba—C4b—C5b	158.85 (8)	Cfb—N3b—Hgbb	136.38 (9)
H2ba—C4b—H5bb	152.33 (5)	Cfb—N3b—Chb	57.26 (7)
H2ba—C4b—H5ba	131.97 (5)	Hfab—N3b—Hfbb	47.22 (4)
H2ba—C4b—C6b	154.44 (5)	Hfab—N3b—Cgb	135.79 (8)
H2ba—C4b—H6bb	147.83 (5)	Hfab—N3b—Hgab	119.63 (6)
H2ba—C4b—H6ba	133.89 (4)	Hfab—N3b—Hgbb	163.55 (7)
H2bb—C4b—C3b	47.29 (6)	Hfab—N3b—Chb	81.53 (5)
H2bb—C4b—H3bb	55.09 (2)	Hfbb—N3b—Cgb	94.18 (8)
H2bb—C4b—H3ba	70.56 (3)	Hfbb—N3b—Hgab	72.71 (5)
H2bb—C4b—H4bb	67.87 (6)	Hfbb—N3b—Hgbb	119.89 (6)
H2bb—C4b—H4ba	98.82 (7)	Hfbb—N3b—Chb	61.16 (4)
H2bb—C4b—C5b	152.13 (8)	Cgb—N3b—Hgab	27.71 (6)
H2bb—C4b—H5bb	126.32 (5)	Cgb—N3b—Hgbb	27.92 (6)
H2bb—C4b—H5ba	144.04 (5)	Cgb—N3b—Chb	57.80 (7)
H2bb—C4b—C6b	160.52 (6)	Hgab—N3b—Hgbb	47.56 (4)
H2bb—C4b—H6bb	139.33 (5)	Hgab—N3b—Chb	62.12 (4)
H2bb—C4b—H6ba	157.86 (5)	Hgbb—N3b—Chb	82.62 (5)
C3b—C4b—H3bb	26.51 (5)	N1b—N4b—N2b	60.10 (4)
C3b—C4b—H3ba	26.62 (5)	N1b—N4b—N3b	60.21 (4)
C3b—C4b—H4bb	108.59 (9)	N1b—N4b—Ccb	31.47 (3)
C3b—C4b—H4ba	108.89 (9)	N1b—N4b—Hcbb^ix	113.63 (5)
C3b—C4b—C5b	114.81 (10)	N1b—N4b—Cdb	34.02 (6)
C3b—C4b—H5bb	101.64 (8)	N1b—N4b—Hdab	52.63 (4)
C3b—C4b—H5ba	97.00 (8)	N1b—N4b—Hdbb	52.62 (4)
C3b—C4b—C6b	148.18 (9)	N1b—N4b—Ceb	31.55 (3)
C3b—C4b—H6bb	159.76 (8)	N1b—N4b—Cfb	64.57 (4)
C3b—C4b—H6ba	150.14 (8)	N1b—N4b—Hfab^ix	152.52 (6)
H3bb—C4b—H3ba	45.03 (2)	N1b—N4b—Cgb	88.94 (7)
H3bb—C4b—H4bb	95.88 (7)	N1b—N4b—Hgab	113.07 (6)
H3bb—C4b—H4ba	135.40 (9)	N1b—N4b—Hgbb	88.40 (5)
H3bb—C4b—C5b	99.22 (8)	N1b—N4b—Chb	88.68 (8)
H3bb—C4b—H5bb	79.32 (4)	N1b—N4b—Hhbb	112.20 (6)
H3bb—C4b—H5ba	91.47 (5)	N1b—N4b—Hhab	89.18 (5)
H3bb—C4b—C6b	131.37 (6)	N2b—N4b—N3b	60.10 (5)
H3bb—C4b—H6bb	134.19 (5)	N2b—N4b—Ccb	64.57 (5)
H3bb—C4b—H6ba	147.02 (6)	N2b—N4b—Hcbb^ix	154.57 (6)
H3ba—C4b—H4bb	135.18 (8)	N2b—N4b—Cdb	88.89 (8)
H3ba—C4b—H4ba	95.04 (7)	N2b—N4b—Hdab	112.51 (6)
H3ba—C4b—C5b	99.84 (8)	N2b—N4b—Hdbb	88.73 (6)
H3ba—C4b—H5bb	97.98 (5)	N2b—N4b—Ceb	31.27 (4)
H3ba—C4b—H5ba	76.20 (4)	N2b—N4b—Cfb	31.14 (4)
H3ba—C4b—C6b	128.08 (6)	N2b—N4b—Hfab^ix	119.33 (5)
H3ba—C4b—H6bb	148.50 (6)	N2b—N4b—Cgb	89.29 (9)
H3ba—C4b—H6ba	123.82 (5)	N2b—N4b—Hgab	89.80 (6)
H4bb—C4b—H4ba	107.02 (12)	N2b—N4b—Hgbb	112.53 (6)
H4bb—C4b—C5b	109.05 (10)	N2b—N4b—Chb	33.63 (6)
H4bb—C4b—H5bb	93.36 (7)	N2b—N4b—Hhbb	52.27 (5)
H4bb—C4b—H5ba	135.89 (9)	N2b—N4b—Hhab	52.50 (5)
H4bb—C4b—C6b	92.65 (7)	N3b—N4b—Ccb	31.54 (4)
H4bb—C4b—H6bb	71.59 (6)	N3b—N4b—Hcbb^ix	141.46 (6)
H4bb—C4b—H6ba	100.92 (7)	N3b—N4b—Cdb	89.24 (8)
H4ba—C4b—C5b	108.22 (9)	N3b—N4b—Hdab	89.61 (5)
H4ba—C4b—H5bb	134.81 (8)	N3b—N4b—Hdbb	112.70 (6)
H4ba—C4b—H5ba	97.34 (7)	N3b—N4b—Ceb	64.51 (5)
H4ba—C4b—C6b	86.05 (7)	N3b—N4b—Cfb	31.72 (4)
H4ba—C4b—H6bb	89.83 (6)	N3b—N4b—Hfab^ix	146.26 (6)
H4ba—C4b—H6ba	65.26 (5)	N3b—N4b—Cgb	34.07 (7)
C5b—C4b—H5bb	26.84 (5)	N3b—N4b—Hgab	53.08 (4)
C5b—C4b—H5ba	27.01 (5)	N3b—N4b—Hgbb	52.53 (5)
C5b—C4b—C6b	33.75 (6)	N3b—N4b—Chb	88.63 (8)
C5b—C4b—H6bb	49.45 (5)	N3b—N4b—Hhbb	88.79 (6)
C5b—C4b—H6ba	48.44 (5)	N3b—N4b—Hhab	112.41 (7)
H5bb—C4b—H5ba	45.53 (3)	Ccb—N4b—Hcbb^ix	124.61 (5)
H5bb—C4b—C6b	52.39 (4)	Ccb—N4b—Cdb	57.70 (7)
H5bb—C4b—H6bb	58.51 (3)	Ccb—N4b—Hdab	61.85 (4)
H5bb—C4b—H6ba	71.59 (3)	Ccb—N4b—Hdbb	82.11 (5)
H5ba—C4b—C6b	52.35 (4)	Ccb—N4b—Ceb	50.05 (4)
H5ba—C4b—H6bb	72.31 (3)	Ccb—N4b—Cfb	50.23 (4)
H5ba—C4b—H6ba	56.98 (2)	Ccb—N4b—Hfab^ix	174.96 (6)
C6b—C4b—H6bb	21.24 (3)	Ccb—N4b—Cgb	57.47 (7)
C6b—C4b—H6ba	20.97 (3)	Ccb—N4b—Hgab	82.42 (5)
H6bb—C4b—H6ba	33.647 (12)	Ccb—N4b—Hgbb	60.96 (4)
C3b—C5b—H3bb	20.75 (3)	Ccb—N4b—Chb	98.20 (8)
C3b—C5b—H3ba	20.89 (3)	Ccb—N4b—Hhbb	110.79 (6)
C3b—C5b—C4b	32.65 (6)	Ccb—N4b—Hhab	111.11 (6)
C3b—C5b—H4bb	51.61 (4)	Hcbb^ix—N4b—Cdb	79.91 (8)
C3b—C5b—H4ba	51.67 (4)	Hcbb^ix—N4b—Hdab	64.38 (4)
C3b—C5b—H5bb	93.49 (7)	Hcbb^ix—N4b—Hdbb	70.85 (5)
C3b—C5b—H5ba	88.05 (7)	Hcbb^ix—N4b—Ceb	132.29 (5)
C3b—C5b—C6b	144.94 (9)	Hcbb^ix—N4b—Cfb	173.17 (5)
C3b—C5b—H6bb	127.64 (6)	Hcbb^ix—N4b—Hfab^ix	53.48 (3)
C3b—C5b—H6ba	125.52 (6)	Hcbb^ix—N4b—Cgb	115.85 (9)
C3b—C5b—C7b	176.50 (6)	Hcbb^ix—N4b—Hgab	114.10 (6)
C3b—C5b—H7bb	162.49 (5)	Hcbb^ix—N4b—Hgbb	91.02 (5)
C3b—C5b—H7ba	158.24 (6)	Hcbb^ix—N4b—Chb	129.91 (8)
H3bb—C5b—H3ba	33.345 (13)	Hcbb^ix—N4b—Hhbb	124.55 (6)
H3bb—C5b—C4b	47.73 (5)	Hcbb^ix—N4b—Hhab	105.20 (5)
H3bb—C5b—H4bb	57.03 (3)	Cdb—N4b—Hdab	27.31 (6)
H3bb—C5b—H4ba	71.01 (3)	Cdb—N4b—Hdbb	27.49 (5)
H3bb—C5b—H5bb	72.85 (6)	Cdb—N4b—Ceb	57.62 (7)
H3bb—C5b—H5ba	92.23 (7)	Cdb—N4b—Cfb	98.58 (8)
H3bb—C5b—C6b	156.33 (9)	Cdb—N4b—Hfab^ix	124.11 (9)
H3bb—C5b—H6bb	130.98 (5)	Cdb—N4b—Cgb	108.23 (9)
H3bb—C5b—H6ba	145.16 (6)	Cdb—N4b—Hgab	136.05 (8)
H3bb—C5b—C7b	162.74 (6)	Cdb—N4b—Hgbb	93.38 (7)
H3bb—C5b—H7bb	142.05 (5)	Cdb—N4b—Chb	107.87 (10)
H3bb—C5b—H7ba	154.27 (5)	Cdb—N4b—Hhbb	135.18 (9)
H3ba—C5b—C4b	47.56 (5)	Cdb—N4b—Hhab	93.92 (8)
H3ba—C5b—H4bb	70.90 (3)	Hdab—N4b—Hdbb	46.94 (4)
H3ba—C5b—H4ba	56.62 (3)	Hdab—N4b—Ceb	82.04 (5)
H3ba—C5b—H5bb	101.51 (7)	Hdab—N4b—Cfb	111.50 (6)
H3ba—C5b—H5ba	67.28 (6)	Hdab—N4b—Hfab^ix	117.27 (6)
H3ba—C5b—C6b	148.25 (8)	Hdab—N4b—Cgb	94.15 (7)
H3ba—C5b—H6bb	143.25 (6)	Hdab—N4b—Hgab	119.41 (6)
H3ba—C5b—H6ba	122.26 (5)	Hdab—N4b—Hgbb	72.09 (5)
H3ba—C5b—C7b	157.89 (6)	Hdab—N4b—Chb	135.17 (9)
H3ba—C5b—H7bb	161.43 (5)	Hdab—N4b—Hhbb	162.45 (8)
H3ba—C5b—H7ba	137.37 (5)	Hdab—N4b—Hhab	118.81 (6)
C4b—C5b—H4bb	26.93 (5)	Hdbb—N4b—Ceb	61.45 (5)
C4b—C5b—H4ba	27.06 (5)	Hdbb—N4b—Cfb	110.74 (6)
C4b—C5b—H5bb	109.11 (9)	Hdbb—N4b—Hfab^ix	100.85 (5)
C4b—C5b—H5ba	109.23 (10)	Hdbb—N4b—Cgb	135.70 (8)
C4b—C5b—C6b	112.63 (10)	Hdbb—N4b—Hgab	163.50 (7)
C4b—C5b—H6bb	96.36 (8)	Hdbb—N4b—Hgbb	118.67 (6)
C4b—C5b—H6ba	98.04 (8)	Hdbb—N4b—Chb	93.46 (8)
C4b—C5b—C7b	145.08 (9)	Hdbb—N4b—Hhbb	118.45 (6)
C4b—C5b—H7bb	149.87 (8)	Hdbb—N4b—Hhab	72.13 (5)
C4b—C5b—H7ba	155.16 (8)	Ceb—N4b—Cfb	49.69 (4)
H4bb—C5b—H4ba	45.30 (3)	Ceb—N4b—Hfab^ix	134.97 (5)
H4bb—C5b—H5bb	93.37 (7)	Ceb—N4b—Cgb	98.58 (9)
H4bb—C5b—H5ba	135.98 (9)	Ceb—N4b—Hgab	111.64 (6)
H4bb—C5b—C6b	99.44 (8)	Ceb—N4b—Hgbb	110.59 (6)
H4bb—C5b—H6bb	76.59 (4)	Ceb—N4b—Chb	57.12 (7)
H4bb—C5b—H6ba	96.17 (5)	Ceb—N4b—Hhbb	81.50 (5)
H4bb—C5b—C7b	127.76 (6)	Ceb—N4b—Hhab	61.54 (5)
H4bb—C5b—H7bb	124.33 (5)	Cfb—N4b—Hfab^ix	131.19 (5)
H4bb—C5b—H7ba	147.83 (6)	Cfb—N4b—Cgb	58.15 (8)
H4ba—C5b—H5bb	135.91 (9)	Cfb—N4b—Hgab	62.46 (5)
H4ba—C5b—H5ba	98.22 (8)	Cfb—N4b—Hgbb	82.40 (5)
H4ba—C5b—C6b	94.64 (8)	Cfb—N4b—Chb	56.92 (7)
H4ba—C5b—H6bb	88.25 (5)	Cfb—N4b—Hhbb	61.02 (5)
H4ba—C5b—H6ba	74.21 (4)	Cfb—N4b—Hhab	81.51 (5)
H4ba—C5b—C7b	125.08 (6)	Hfab^ix—N4b—Cgb	118.34 (8)
H4ba—C5b—H7bb	141.01 (5)	Hfab^ix—N4b—Hgab	94.20 (5)
H4ba—C5b—H7ba	128.56 (5)	Hfab^ix—N4b—Hgbb	114.00 (6)
H5bb—C5b—H5ba	107.63 (12)	Hfab^ix—N4b—Chb	85.75 (7)
H5bb—C5b—C6b	109.35 (10)	Hfab^ix—N4b—Hhbb	71.51 (4)
H5bb—C5b—H6bb	96.98 (8)	Hfab^ix—N4b—Hhab	73.79 (4)
H5bb—C5b—H6ba	135.94 (9)	Cgb—N4b—Hgab	27.82 (5)
H5bb—C5b—C7b	89.98 (7)	Cgb—N4b—Hgbb	27.48 (6)
H5bb—C5b—H7bb	69.20 (6)	Cgb—N4b—Chb	108.41 (11)
H5bb—C5b—H7ba	94.11 (7)	Cgb—N4b—Hhbb	94.28 (8)
H5ba—C5b—C6b	108.77 (9)	Cgb—N4b—Hhab	135.80 (10)
H5ba—C5b—H6bb	135.41 (8)	Hgab—N4b—Hgbb	47.50 (4)
H5ba—C5b—H6ba	94.63 (7)	Hgab—N4b—Chb	94.39 (8)
H5ba—C5b—C7b	91.34 (7)	Hgab—N4b—Hhbb	72.75 (5)
H5ba—C5b—H7bb	99.45 (7)	Hgab—N4b—Hhab	119.20 (6)
H5ba—C5b—H7ba	70.22 (6)	Hgbb—N4b—Chb	135.84 (10)
C6b—C5b—H6bb	26.68 (5)	Hgbb—N4b—Hhbb	119.77 (7)
C6b—C5b—H6ba	26.61 (5)	Hgbb—N4b—Hhab	163.15 (8)
C6b—C5b—C7b	32.49 (6)	Chb—N4b—Hhbb	27.32 (6)
C6b—C5b—H7bb	46.69 (6)	Chb—N4b—Hhab	27.40 (6)
C6b—C5b—H7ba	48.70 (6)	Hhbb—N4b—Hhab	46.66 (4)
H6bb—C5b—H6ba	44.78 (2)	Ho1a^xi—Ccb—Ho3b	172.6 (5)
H6bb—C5b—C7b	51.29 (4)	Ho1a^xi—Ccb—N1b	36.1 (3)
H6bb—C5b—H7bb	55.30 (3)	Ho1a^xi—Ccb—N2b	91.7 (3)
H6bb—C5b—H7ba	71.47 (3)	Ho1a^xi—Ccb—N3b	147.6 (3)
H6ba—C5b—C7b	51.10 (4)	Ho1a^xi—Ccb—N4b	91.8 (3)
H6ba—C5b—H7bb	69.96 (3)	Ho1a^xi—Ccb—Hcbb	88.7 (3)
H6ba—C5b—H7ba	57.90 (3)	Ho1a^xi—Ccb—Hcab	89.9 (3)
C7b—C5b—H7bb	20.89 (3)	Ho1a^xi—Ccb—Cdb	61.7 (3)
C7b—C5b—H7ba	21.24 (3)	Ho1a^xi—Ccb—Hdab	63.4 (3)
H7bb—C5b—H7ba	33.676 (13)	Ho1a^xi—Ccb—Ceb	61.7 (3)
C4b—C6b—H4bb	20.98 (3)	Ho1a^xi—Ccb—Hebb	63.4 (3)
C4b—C6b—H4ba	21.68 (3)	Ho1a^xi—Ccb—Cfb	121.1 (3)
C4b—C6b—C5b	33.62 (6)	Ho1a^xi—Ccb—Hfab	117.9 (3)
C4b—C6b—H5bb	52.11 (4)	Ho1a^xi—Ccb—Cgb	121.4 (3)
C4b—C6b—H5ba	52.37 (4)	Ho1a^xi—Ccb—Hgbb	118.2 (3)
C4b—C6b—H6bb	88.35 (7)	Ho3b—Ccb—N1b	150.5 (3)
C4b—C6b—H6ba	90.65 (8)	Ho3b—Ccb—N2b	93.1 (3)
C4b—C6b—C7b	148.43 (9)	Ho3b—Ccb—N3b	39.3 (3)
C4b—C6b—H7bb	129.97 (6)	Ho3b—Ccb—N4b	95.6 (4)
C4b—C6b—H7ba	128.91 (6)	Ho3b—Ccb—Hcbb	84.9 (4)
C4b—C6b—C8b	177.15 (7)	Ho3b—Ccb—Hcab	88.9 (3)
C4b—C6b—H8bb	158.52 (6)	Ho3b—Ccb—Cdb	125.5 (4)
C4b—C6b—H8ba	155.91 (6)	Ho3b—Ccb—Hdab	122.6 (4)
H4bb—C6b—H4ba	33.982 (14)	Ho3b—Ccb—Ceb	121.9 (3)
H4bb—C6b—C5b	47.57 (6)	Ho3b—Ccb—Hebb	117.1 (4)
H4bb—C6b—H5bb	55.77 (2)	Ho3b—Ccb—Cfb	62.7 (3)
H4bb—C6b—H5ba	71.17 (3)	Ho3b—Ccb—Hfab	62.9 (3)
H4bb—C6b—H6bb	67.55 (6)	Ho3b—Ccb—Cgb	65.9 (4)
H4bb—C6b—H6ba	99.03 (8)	Ho3b—Ccb—Hgbb	67.7 (4)
H4bb—C6b—C7b	151.97 (8)	N1b—Ccb—N2b	59.53 (5)
H4bb—C6b—H7bb	125.60 (5)	N1b—Ccb—N3b	111.41 (9)
H4bb—C6b—H7ba	144.94 (5)	N1b—Ccb—N4b	59.49 (5)
H4bb—C6b—C8b	159.19 (6)	N1b—Ccb—Hcbb	108.88 (11)
H4bb—C6b—H8bb	138.00 (5)	N1b—Ccb—Hcab	109.40 (12)
H4bb—C6b—H8ba	155.92 (5)	N1b—Ccb—Cdb	35.70 (5)
H4ba—C6b—C5b	50.41 (6)	N1b—Ccb—Hdab	50.80 (5)
H4ba—C6b—H5bb	72.84 (3)	N1b—Ccb—Ceb	36.03 (5)
H4ba—C6b—H5ba	59.71 (3)	N1b—Ccb—Hebb	51.08 (5)
H4ba—C6b—H6bb	92.06 (8)	N1b—Ccb—Cfb	90.53 (6)
H4ba—C6b—H6ba	69.15 (6)	N1b—Ccb—Hfab	97.42 (6)
H4ba—C6b—C7b	158.35 (9)	N1b—Ccb—Cgb	90.64 (7)
H4ba—C6b—H7bb	150.76 (5)	N1b—Ccb—Hgbb	97.76 (7)
H4ba—C6b—H7ba	131.78 (5)	N2b—Ccb—N3b	59.45 (6)
H4ba—C6b—C8b	155.50 (5)	N2b—Ccb—N4b	51.08 (4)
H4ba—C6b—H8bb	149.97 (5)	N2b—Ccb—Hcbb	99.67 (9)
H4ba—C6b—H8ba	134.33 (5)	N2b—Ccb—Hcab	150.33 (11)
C5b—C6b—H5bb	26.69 (5)	N2b—Ccb—Cdb	64.79 (5)
C5b—C6b—H5ba	27.10 (5)	N2b—Ccb—Hdab	86.32 (5)
C5b—C6b—H6bb	108.63 (9)	N2b—Ccb—Ceb	31.20 (4)
C5b—C6b—H6ba	108.91 (10)	N2b—Ccb—Hebb	43.08 (3)
C5b—C6b—C7b	114.85 (11)	N2b—Ccb—Cfb	31.00 (4)
C5b—C6b—H7bb	100.78 (8)	N2b—Ccb—Hfab	42.99 (4)
C5b—C6b—H7ba	97.66 (8)	N2b—Ccb—Cgb	65.03 (5)
C5b—C6b—C8b	148.57 (10)	N2b—Ccb—Hgbb	86.96 (4)
C5b—C6b—H8bb	157.63 (8)	N3b—Ccb—N4b	59.31 (7)
C5b—C6b—H8ba	152.56 (9)	N3b—Ccb—Hcbb	109.19 (12)
H5bb—C6b—H5ba	45.45 (2)	N3b—Ccb—Hcab	107.96 (12)
H5bb—C6b—H6bb	96.32 (7)	N3b—Ccb—Cdb	90.58 (8)
H5bb—C6b—H6ba	135.58 (9)	N3b—Ccb—Hdab	97.74 (8)
H5bb—C6b—C7b	98.65 (8)	N3b—Ccb—Ceb	90.65 (7)
H5bb—C6b—H7bb	78.04 (4)	N3b—Ccb—Hebb	97.61 (7)
H5bb—C6b—H7ba	91.53 (5)	N3b—Ccb—Cfb	36.05 (6)
H5bb—C6b—C8b	130.70 (6)	N3b—Ccb—Hfab	51.44 (7)
H5bb—C6b—H8bb	131.59 (5)	N3b—Ccb—Cgb	35.90 (7)
H5bb—C6b—H8ba	148.04 (6)	N3b—Ccb—Hgbb	51.54 (7)
H5ba—C6b—H6bb	135.69 (8)	N4b—Ccb—Hcbb	150.75 (10)
H5ba—C6b—H6ba	94.48 (8)	N4b—Ccb—Hcab	99.26 (10)
H5ba—C6b—C7b	99.93 (8)	N4b—Ccb—Cdb	31.27 (4)
H5ba—C6b—H7bb	97.46 (5)	N4b—Ccb—Hdab	43.35 (4)
H5ba—C6b—H7ba	76.64 (4)	N4b—Ccb—Ceb	64.99 (5)
H5ba—C6b—C8b	128.66 (7)	N4b—Ccb—Hebb	86.20 (4)
H5ba—C6b—H8bb	148.30 (6)	N4b—Ccb—Cfb	64.76 (5)
H5ba—C6b—H8ba	125.76 (5)	N4b—Ccb—Hfab	86.28 (4)
H6bb—C6b—H6ba	107.03 (12)	N4b—Ccb—Cgb	31.15 (4)
H6bb—C6b—C7b	108.86 (10)	N4b—Ccb—Hgbb	43.60 (3)
H6bb—C6b—H7bb	93.69 (8)	Hcbb—Ccb—Hcab	109.99 (12)
H6bb—C6b—H7ba	135.59 (9)	Hcbb—Ccb—Cdb	144.56 (11)
H6bb—C6b—C8b	91.64 (7)	Hcbb—Ccb—Hdab	151.68 (10)
H6bb—C6b—H8bb	70.46 (6)	Hcbb—Ccb—Ceb	89.87 (9)
H6bb—C6b—H8ba	98.51 (7)	Hcbb—Ccb—Hebb	67.95 (8)
H6ba—C6b—C7b	108.29 (9)	Hcbb—Ccb—Cfb	90.16 (9)
H6ba—C6b—H7bb	135.30 (9)	Hcbb—Ccb—Hfab	67.88 (8)
H6ba—C6b—H7ba	96.92 (8)	Hcbb—Ccb—Cgb	145.08 (11)
H6ba—C6b—C8b	86.62 (7)	Hcbb—Ccb—Hgbb	152.25 (11)
H6ba—C6b—H8bb	92.21 (7)	Hcab—Ccb—Cdb	90.21 (10)
H6ba—C6b—H8ba	65.26 (5)	Hcab—Ccb—Hdab	68.01 (9)
C7b—C6b—H7bb	27.15 (5)	Hcab—Ccb—Ceb	145.40 (12)
C7b—C6b—H7ba	26.82 (5)	Hcab—Ccb—Hebb	152.99 (10)
C7b—C6b—C8b	33.94 (6)	Hcab—Ccb—Cfb	144.00 (11)
C7b—C6b—H8bb	48.75 (5)	Hcab—Ccb—Hfab	151.66 (10)
C7b—C6b—H8ba	49.69 (5)	Hcab—Ccb—Cgb	89.09 (10)
H7bb—C6b—H7ba	45.51 (3)	Hcab—Ccb—Hgbb	66.43 (8)
H7bb—C6b—C8b	52.88 (4)	Cdb—Ccb—Hdab	22.21 (3)
H7bb—C6b—H8bb	57.60 (3)	Cdb—Ccb—Ceb	59.93 (5)
H7bb—C6b—H8ba	72.90 (3)	Cdb—Ccb—Hebb	80.80 (5)
H7ba—C6b—C8b	52.40 (4)	Cdb—Ccb—Cfb	89.45 (6)
H7ba—C6b—H8bb	71.80 (3)	Cdb—Ccb—Hfab	107.38 (5)
H7ba—C6b—H8ba	58.45 (3)	Cdb—Ccb—Cgb	59.64 (5)
C8b—C6b—H8bb	21.19 (3)	Cdb—Ccb—Hgbb	62.30 (5)
C8b—C6b—H8ba	21.38 (3)	Hdab—Ccb—Ceb	81.02 (5)
H8bb—C6b—H8ba	34.048 (13)	Hdab—Ccb—Hebb	100.63 (5)
C5b—C7b—H5bb	21.06 (3)	Hdab—Ccb—Cfb	107.59 (6)
C5b—C7b—H5ba	21.09 (3)	Hdab—Ccb—Hfab	127.80 (5)
C5b—C7b—C6b	32.66 (6)	Hdab—Ccb—Cgb	62.19 (5)
C5b—C7b—H6bb	51.43 (4)	Hdab—Ccb—Hgbb	54.92 (4)
C5b—C7b—H6ba	51.58 (4)	Ceb—Ccb—Hebb	21.93 (4)
C5b—C7b—H7bb	92.24 (7)	Ceb—Ccb—Cfb	59.42 (5)
C5b—C7b—H7ba	88.75 (7)	Ceb—Ccb—Hfab	61.70 (4)
C5b—C7b—C8b	144.75 (9)	Ceb—Ccb—Cgb	89.82 (6)
C5b—C7b—H8bb	128.24 (7)	Ceb—Ccb—Hgbb	108.20 (6)
C5b—C7b—H8ba	124.50 (6)	Hebb—Ccb—Cfb	61.88 (4)
C5b—C7b—C9b	174.78 (6)	Hebb—Ccb—Hfab	54.50 (3)
C5b—C7b—H9bb	156.24 (6)	Hebb—Ccb—Cgb	107.62 (5)
C5b—C7b—H9ba	164.17 (5)	Hebb—Ccb—Hgbb	128.29 (5)
H5bb—C7b—H5ba	33.738 (13)	Cfb—Ccb—Hfab	22.28 (4)
H5bb—C7b—C6b	48.25 (5)	Cfb—Ccb—Cgb	60.16 (5)
H5bb—C7b—H6bb	57.45 (3)	Cfb—Ccb—Hgbb	81.76 (5)
H5bb—C7b—H6ba	71.35 (3)	Hfab—Ccb—Cgb	81.40 (5)
H5bb—C7b—H7bb	71.30 (6)	Hfab—Ccb—Hgbb	101.76 (5)
H5bb—C7b—H7ba	92.93 (7)	Cgb—Ccb—Hgbb	22.67 (4)
H5bb—C7b—C8b	155.78 (9)	Ho1a^xi—Cdb—N1b	38.2 (4)
H5bb—C7b—H8bb	130.51 (5)	Ho1a^xi—Cdb—N2b	93.2 (4)
H5bb—C7b—H8ba	144.04 (6)	Ho1a^xi—Cdb—N3b	94.7 (4)
H5bb—C7b—C9b	164.04 (6)	Ho1a^xi—Cdb—N4b	150.2 (4)
H5bb—C7b—H9bb	156.04 (5)	Ho1a^xi—Cdb—Ccb	64.3 (4)
H5bb—C7b—H9ba	143.13 (5)	Ho1a^xi—Cdb—Hcbb^ix	140.0 (4)
H5ba—C7b—C6b	47.45 (5)	Ho1a^xi—Cdb—Hcab	66.3 (3)
H5ba—C7b—H6bb	70.72 (3)	Ho1a^xi—Cdb—Hdab	88.5 (3)
H5ba—C7b—H6ba	56.23 (3)	Ho1a^xi—Cdb—Hdbb	86.2 (3)
H5ba—C7b—H7bb	100.37 (7)	Ho1a^xi—Cdb—Ceb	62.7 (4)
H5ba—C7b—H7ba	67.79 (6)	Ho1a^xi—Cdb—Heab	63.8 (3)
H5ba—C7b—C8b	148.57 (8)	Ho1a^xi—Cdb—Cgb	124.4 (4)
H5ba—C7b—H8bb	144.69 (6)	Ho1a^xi—Cdb—Hgbb	120.3 (3)
H5ba—C7b—H8ba	122.18 (5)	Ho1a^xi—Cdb—Chb	122.4 (4)
H5ba—C7b—C9b	156.01 (6)	Ho1a^xi—Cdb—Hhab	118.2 (3)
H5ba—C7b—H9bb	135.24 (5)	N1b—Cdb—N2b	59.85 (6)
H5ba—C7b—H9ba	158.64 (5)	N1b—Cdb—N3b	59.83 (6)
C6b—C7b—H6bb	26.70 (5)	N1b—Cdb—N4b	112.03 (10)
C6b—C7b—H6ba	26.92 (5)	N1b—Cdb—Ccb	35.86 (5)
C6b—C7b—H7bb	108.70 (9)	N1b—Cdb—Hcbb^ix	172.84 (7)
C6b—C7b—H7ba	109.35 (10)	N1b—Cdb—Hcab	51.41 (5)
C6b—C7b—C8b	112.28 (10)	N1b—Cdb—Hdab	108.64 (10)
C6b—C7b—H8bb	97.58 (8)	N1b—Cdb—Hdbb	108.39 (12)
C6b—C7b—H8ba	96.06 (7)	N1b—Cdb—Ceb	36.08 (5)
C6b—C7b—C9b	144.67 (9)	N1b—Cdb—Heab	51.87 (5)
C6b—C7b—H9bb	150.57 (8)	N1b—Cdb—Cgb	91.18 (7)
C6b—C7b—H9ba	153.62 (8)	N1b—Cdb—Hgbb	97.61 (7)
H6bb—C7b—H6ba	44.98 (3)	N1b—Cdb—Chb	91.07 (7)
H6bb—C7b—H7bb	93.80 (8)	N1b—Cdb—Hhab	98.19 (7)
H6bb—C7b—H7ba	135.96 (9)	N2b—Cdb—N3b	51.20 (4)
H6bb—C7b—C8b	98.64 (8)	N2b—Cdb—N4b	59.79 (7)
H6bb—C7b—H8bb	76.99 (5)	N2b—Cdb—Ccb	65.21 (5)
H6bb—C7b—H8ba	93.24 (5)	N2b—Cdb—Hcbb^ix	124.84 (5)
H6bb—C7b—C9b	128.55 (6)	N2b—Cdb—Hcab	86.75 (5)
H6bb—C7b—H9bb	146.49 (6)	N2b—Cdb—Hdab	151.28 (11)
H6bb—C7b—H9ba	128.63 (5)	N2b—Cdb—Hdbb	98.78 (9)
H6ba—C7b—H7bb	135.47 (9)	N2b—Cdb—Ceb	31.32 (4)
H6ba—C7b—H7ba	97.84 (8)	N2b—Cdb—Heab	43.33 (4)
H6ba—C7b—C8b	94.93 (8)	N2b—Cdb—Cgb	65.30 (5)
H6ba—C7b—H8bb	90.67 (5)	N2b—Cdb—Hgbb	87.03 (5)
H6ba—C7b—H8ba	73.01 (4)	N2b—Cdb—Chb	31.21 (4)
H6ba—C7b—C9b	124.00 (6)	N2b—Cdb—Hhab	43.36 (4)
H6ba—C7b—H9bb	123.95 (5)	N3b—Cdb—N4b	59.44 (7)
H6ba—C7b—H9ba	142.34 (5)	N3b—Cdb—Ccb	31.59 (4)
H7bb—C7b—H7ba	107.40 (12)	N3b—Cdb—Hcbb^ix	117.82 (5)
H7bb—C7b—C8b	109.98 (10)	N3b—Cdb—Hcab	43.42 (3)
H7bb—C7b—H8bb	95.57 (8)	N3b—Cdb—Hdab	100.09 (9)
H7bb—C7b—H8ba	136.74 (9)	N3b—Cdb—Hdbb	149.98 (11)
H7bb—C7b—C9b	92.96 (7)	N3b—Cdb—Ceb	65.06 (5)
H7bb—C7b—H9bb	99.62 (8)	N3b—Cdb—Heab	86.88 (5)
H7bb—C7b—H9ba	71.96 (6)	N3b—Cdb—Cgb	31.35 (5)
H7ba—C7b—C8b	109.01 (9)	N3b—Cdb—Hgbb	43.33 (4)
H7ba—C7b—H8bb	135.87 (8)	N3b—Cdb—Chb	64.81 (5)
H7ba—C7b—H8ba	96.45 (7)	N3b—Cdb—Hhab	86.48 (5)
H7ba—C7b—C9b	89.27 (7)	N4b—Cdb—Ccb	91.04 (8)
H7ba—C7b—H9bb	68.12 (6)	N4b—Cdb—Hcbb^ix	69.66 (7)
H7ba—C7b—H9ba	94.96 (7)	N4b—Cdb—Hcab	97.60 (7)
C8b—C7b—H8bb	26.88 (5)	N4b—Cdb—Hdab	109.10 (12)
C8b—C7b—H8ba	26.80 (5)	N4b—Cdb—Hdbb	108.73 (11)
C8b—C7b—C9b	32.46 (6)	N4b—Cdb—Ceb	91.12 (8)
C8b—C7b—H9bb	47.90 (6)	N4b—Cdb—Heab	97.86 (8)
C8b—C7b—H9ba	47.42 (6)	N4b—Cdb—Cgb	35.82 (6)
H8bb—C7b—H8ba	45.16 (2)	N4b—Cdb—Hgbb	51.74 (6)
H8bb—C7b—C9b	51.58 (4)	N4b—Cdb—Chb	36.10 (6)
H8bb—C7b—H9bb	71.27 (3)	N4b—Cdb—Hhab	51.33 (6)
H8bb—C7b—H9ba	56.66 (3)	Ccb—Cdb—Hcbb^ix	138.74 (6)
H8ba—C7b—C9b	50.99 (3)	Ccb—Cdb—Hcab	22.36 (4)
H8ba—C7b—H9bb	56.45 (2)	Ccb—Cdb—Hdab	90.09 (9)
H8ba—C7b—H9ba	70.44 (3)	Ccb—Cdb—Hdbb	144.23 (12)
C9b—C7b—H9bb	21.16 (3)	Ccb—Cdb—Ceb	60.08 (5)
C9b—C7b—H9ba	21.00 (3)	Ccb—Cdb—Heab	81.75 (5)
H9bb—C7b—H9ba	33.790 (13)	Ccb—Cdb—Cgb	60.06 (5)
C6b—C8b—H6bb	20.87 (3)	Ccb—Cdb—Hgbb	61.99 (5)
C6b—C8b—H6ba	21.52 (3)	Ccb—Cdb—Chb	89.95 (6)
C6b—C8b—C7b	33.78 (6)	Ccb—Cdb—Hhab	108.12 (6)
C6b—C8b—H7bb	52.11 (4)	Hcbb^ix—Cdb—Hcab	121.85 (5)
C6b—C8b—H7ba	52.33 (4)	Hcbb^ix—Cdb—Hdab	64.58 (9)
C6b—C8b—H8bb	90.20 (7)	Hcbb^ix—Cdb—Hdbb	76.96 (9)
C6b—C8b—H8ba	88.31 (7)	Hcbb^ix—Cdb—Ceb	150.61 (5)
C6b—C8b—C9b	148.62 (9)	Hcbb^ix—Cdb—Heab	135.26 (5)
C6b—C8b—H9bb	128.50 (6)	Hcbb^ix—Cdb—Cgb	86.67 (5)
C6b—C8b—H9ba	130.81 (6)	Hcbb^ix—Cdb—Hgbb	77.90 (4)
C6b—C8b—Cab	176.47 (7)	Hcbb^ix—Cdb—Chb	93.77 (5)
C6b—C8b—Habb	158.14 (6)	Hcbb^ix—Cdb—Hhab	88.24 (4)
C6b—C8b—Haba	155.74 (5)	Hcab—Cdb—Hdab	67.74 (8)
H6bb—C8b—H6ba	33.782 (13)	Hcab—Cdb—Hdbb	152.24 (10)
H6bb—C8b—C7b	47.90 (6)	Hcab—Cdb—Ceb	81.46 (5)
H6bb—C8b—H7bb	56.13 (2)	Hcab—Cdb—Heab	101.95 (5)
H6bb—C8b—H7ba	71.16 (3)	Hcab—Cdb—Cgb	62.07 (4)
H6bb—C8b—H8bb	69.35 (6)	Hcab—Cdb—Hgbb	54.08 (3)
H6bb—C8b—H8ba	95.22 (7)	Hcab—Cdb—Chb	107.82 (6)
H6bb—C8b—C9b	155.78 (8)	Hcab—Cdb—Hhab	128.35 (6)
H6bb—C8b—H9bb	146.78 (5)	Hdab—Cdb—Hdbb	109.93 (14)
H6bb—C8b—H9ba	129.60 (5)	Hdab—Cdb—Ceb	144.71 (11)
H6bb—C8b—Cab	158.86 (6)	Hdab—Cdb—Heab	151.98 (10)
H6bb—C8b—Habb	137.68 (5)	Hdab—Cdb—Cgb	90.25 (9)
H6bb—C8b—Haba	154.66 (5)	Hdab—Cdb—Hgbb	67.65 (8)
H6ba—C8b—C7b	50.16 (6)	Hdab—Cdb—Chb	145.19 (11)
H6ba—C8b—H7bb	72.55 (3)	Hdab—Cdb—Hhab	152.06 (11)
H6ba—C8b—H7ba	59.27 (3)	Hdbb—Cdb—Ceb	89.23 (10)
H6ba—C8b—H8bb	95.64 (7)	Hdbb—Cdb—Heab	66.56 (9)
H6ba—C8b—H8ba	66.81 (6)	Hdbb—Cdb—Cgb	144.53 (10)
H6ba—C8b—C9b	154.67 (8)	Hdbb—Cdb—Hgbb	152.73 (11)
H6ba—C8b—H9bb	127.85 (5)	Hdbb—Cdb—Chb	89.45 (8)
H6ba—C8b—H9ba	149.79 (5)	Hdbb—Cdb—Hhab	67.09 (7)
H6ba—C8b—Cab	155.08 (5)	Ceb—Cdb—Heab	22.67 (4)
H6ba—C8b—Habb	150.10 (5)	Ceb—Cdb—Cgb	90.14 (6)
H6ba—C8b—Haba	134.25 (4)	Ceb—Cdb—Hgbb	108.07 (6)
C7b—C8b—H7bb	26.62 (5)	Ceb—Cdb—Chb	59.84 (5)
C7b—C8b—H7ba	26.85 (5)	Ceb—Cdb—Hhab	62.41 (4)
C7b—C8b—H8bb	108.49 (9)	Heab—Cdb—Cgb	108.25 (6)
C7b—C8b—H8ba	108.57 (10)	Heab—Cdb—Hgbb	128.71 (6)
C7b—C8b—C9b	114.93 (10)	Heab—Cdb—Chb	62.02 (5)
C7b—C8b—H9bb	98.94 (8)	Heab—Cdb—Hhab	54.61 (3)
C7b—C8b—H9ba	99.64 (8)	Cgb—Cdb—Hgbb	22.61 (4)
C7b—C8b—Cab	149.15 (9)	Cgb—Cdb—Chb	60.13 (5)
C7b—C8b—Habb	157.70 (8)	Cgb—Cdb—Hhab	81.34 (5)
C7b—C8b—Haba	153.46 (8)	Hgbb—Cdb—Chb	81.82 (5)
H7bb—C8b—H7ba	45.24 (2)	Hgbb—Cdb—Hhab	101.81 (5)
H7bb—C8b—H8bb	94.33 (7)	Chb—Cdb—Hhab	22.36 (4)
H7bb—C8b—H8ba	135.15 (9)	Ho1a^xi—Ceb—N1b	38.4 (4)
H7bb—C8b—C9b	100.73 (8)	Ho1a^xi—Ceb—N2b	150.2 (4)
H7bb—C8b—H9bb	95.71 (5)	Ho1a^xi—Ceb—N3b	94.6 (4)
H7bb—C8b—H9ba	78.72 (4)	Ho1a^xi—Ceb—N4b	93.1 (4)
H7bb—C8b—Cab	131.41 (6)	Ho1a^xi—Ceb—Ccb	64.3 (3)
H7bb—C8b—Habb	131.69 (5)	Ho1a^xi—Ceb—Hcbb	65.8 (3)
H7bb—C8b—Haba	148.85 (6)	Ho1a^xi—Ceb—Cdb	62.7 (4)
H7ba—C8b—H8bb	135.32 (8)	Ho1a^xi—Ceb—Hdbb	63.5 (3)
H7ba—C8b—H8ba	96.01 (8)	Ho1a^xi—Ceb—Heab	86.7 (3)
H7ba—C8b—C9b	98.28 (8)	Ho1a^xi—Ceb—Hebb	88.7 (4)
H7ba—C8b—H9bb	76.28 (4)	Ho1a^xi—Ceb—Cfb	124.7 (4)
H7ba—C8b—H9ba	93.65 (5)	Ho1a^xi—Ceb—Hfab	121.1 (3)
H7ba—C8b—Cab	129.27 (6)	Ho1a^xi—Ceb—Chb	122.4 (4)
H7ba—C8b—Habb	148.70 (6)	Ho1a^xi—Ceb—Hhab	118.1 (3)
H7ba—C8b—Haba	126.88 (5)	N1b—Ceb—N2b	111.86 (10)
H8bb—C8b—H8ba	107.49 (12)	N1b—Ceb—N3b	59.71 (5)
H8bb—C8b—C9b	109.36 (10)	N1b—Ceb—N4b	59.47 (6)
H8bb—C8b—H9bb	136.38 (9)	N1b—Ceb—Ccb	35.92 (5)
H8bb—C8b—H9ba	95.64 (7)	N1b—Ceb—Hcbb	51.28 (5)
H8bb—C8b—Cab	89.69 (7)	N1b—Ceb—Cdb	35.80 (5)
H8bb—C8b—Habb	68.58 (6)	N1b—Ceb—Hdbb	51.22 (5)
H8bb—C8b—Haba	97.43 (7)	N1b—Ceb—Heab	108.36 (12)
H8ba—C8b—C9b	107.76 (9)	N1b—Ceb—Hebb	108.77 (10)
H8ba—C8b—H9bb	94.50 (8)	N1b—Ceb—Cfb	91.36 (7)
H8ba—C8b—H9ba	134.76 (9)	N1b—Ceb—Hfab	98.28 (6)
H8ba—C8b—Cab	88.35 (7)	N1b—Ceb—Chb	90.78 (7)
H8ba—C8b—Habb	93.03 (7)	N1b—Ceb—Hhab	97.73 (7)
H8ba—C8b—Haba	67.43 (5)	N2b—Ceb—N3b	59.65 (6)
C9b—C8b—H9bb	27.02 (5)	N2b—Ceb—N4b	59.63 (7)
C9b—C8b—H9ba	27.01 (5)	N2b—Ceb—Ccb	91.20 (8)
C9b—C8b—Cab	34.21 (6)	N2b—Ceb—Hcbb	98.29 (7)
C9b—C8b—Habb	50.47 (5)	N2b—Ceb—Cdb	90.89 (9)
C9b—C8b—Haba	48.13 (5)	N2b—Ceb—Hdbb	97.74 (9)
H9bb—C8b—H9ba	45.66 (3)	N2b—Ceb—Heab	107.66 (10)
H9bb—C8b—Cab	52.99 (4)	N2b—Ceb—Hebb	109.01 (13)
H9bb—C8b—Habb	73.18 (3)	N2b—Ceb—Cfb	35.69 (6)
H9bb—C8b—Haba	56.62 (2)	N2b—Ceb—Hfab	51.31 (6)
H9ba—C8b—Cab	52.71 (4)	N2b—Ceb—Chb	35.80 (7)
H9ba—C8b—Habb	59.70 (3)	N2b—Ceb—Hhab	51.02 (7)
H9ba—C8b—Haba	71.50 (3)	N3b—Ceb—N4b	50.94 (4)
Cab—C8b—Habb	21.19 (3)	N3b—Ceb—Ccb	31.55 (4)
Cab—C8b—Haba	20.99 (3)	N3b—Ceb—Hcbb	43.72 (3)
Habb—C8b—Haba	33.684 (13)	N3b—Ceb—Cdb	64.92 (5)
O4b—C9b—C7b	158.46 (7)	N3b—Ceb—Hdbb	86.55 (5)
O4b—C9b—H7bb	139.94 (6)	N3b—Ceb—Heab	149.19 (12)
O4b—C9b—H7ba	145.42 (7)	N3b—Ceb—Hebb	99.60 (9)
O4b—C9b—C8b	165.96 (9)	N3b—Ceb—Cfb	31.65 (4)
O4b—C9b—H8bb	140.40 (7)	N3b—Ceb—Hfab	43.69 (4)
O4b—C9b—H8ba	149.48 (6)	N3b—Ceb—Chb	64.74 (5)
O4b—C9b—H9bb	83.53 (8)	N3b—Ceb—Hhab	86.33 (5)
O4b—C9b—H9ba	71.71 (7)	N4b—Ceb—Ccb	64.96 (5)
O4b—C9b—Cab	56.56 (7)	N4b—Ceb—Hcbb	86.61 (5)
O4b—C9b—Habb	71.68 (5)	N4b—Ceb—Cdb	31.26 (4)
O4b—C9b—Haba	73.48 (5)	N4b—Ceb—Hdbb	43.38 (4)
O4b—C9b—Cbb	24.72 (5)	N4b—Ceb—Heab	98.26 (10)
O4b—C9b—O4bm	0.70 (4)	N4b—Ceb—Hebb	150.54 (10)
C7b—C9b—H7bb	20.78 (3)	N4b—Ceb—Cfb	65.01 (5)
C7b—C9b—H7ba	21.17 (3)	N4b—Ceb—Hfab	86.71 (5)
C7b—C9b—C8b	32.61 (6)	N4b—Ceb—Chb	31.31 (4)
C7b—C9b—H8bb	51.41 (4)	N4b—Ceb—Hhab	43.38 (3)
C7b—C9b—H8ba	51.51 (4)	Ccb—Ceb—Hcbb	22.36 (4)
C7b—C9b—H9bb	90.14 (7)	Ccb—Ceb—Cdb	59.99 (5)
C7b—C9b—H9ba	90.88 (7)	Ccb—Ceb—Hdbb	81.32 (5)
C7b—C9b—Cab	144.21 (9)	Ccb—Ceb—Heab	144.23 (12)
C7b—C9b—Habb	124.80 (6)	Ccb—Ceb—Hebb	89.73 (9)
C7b—C9b—Haba	127.68 (6)	Ccb—Ceb—Cfb	60.40 (5)
C7b—C9b—Cbb	174.80 (7)	Ccb—Ceb—Hfab	62.68 (5)
C7b—C9b—O4bm	157.77 (6)	Ccb—Ceb—Chb	89.87 (6)
H7bb—C9b—H7ba	33.535 (12)	Ccb—Ceb—Hhab	107.92 (6)
H7bb—C9b—C8b	47.06 (5)	Hcbb—Ceb—Cdb	81.26 (5)
H7bb—C9b—H8bb	55.93 (2)	Hcbb—Ceb—Hdbb	101.31 (5)
H7bb—C9b—H8ba	70.56 (3)	Hcbb—Ceb—Heab	152.39 (10)
H7bb—C9b—H9bb	96.85 (7)	Hcbb—Ceb—Hebb	67.37 (7)
H7bb—C9b—H9ba	70.10 (5)	Hcbb—Ceb—Cfb	62.92 (4)
H7bb—C9b—Cab	151.17 (8)	Hcbb—Ceb—Hfab	55.34 (3)
H7bb—C9b—Habb	125.44 (5)	Hcbb—Ceb—Chb	108.01 (6)
H7bb—C9b—Haba	145.75 (6)	Hcbb—Ceb—Hhab	128.37 (6)
H7bb—C9b—Cbb	158.26 (5)	Cdb—Ceb—Hdbb	22.40 (3)
H7bb—C9b—O4bm	139.33 (4)	Cdb—Ceb—Heab	88.90 (10)
H7ba—C9b—C8b	48.43 (5)	Cdb—Ceb—Hebb	144.56 (10)
H7ba—C9b—H8bb	71.32 (3)	Cdb—Ceb—Cfb	90.05 (6)
H7ba—C9b—H8ba	57.55 (3)	Cdb—Ceb—Hfab	108.17 (6)
H7ba—C9b—H9bb	68.98 (6)	Cdb—Ceb—Chb	59.79 (5)
H7ba—C9b—H9ba	96.50 (7)	Cdb—Ceb—Hhab	62.23 (5)
H7ba—C9b—Cab	152.45 (8)	Hdbb—Ceb—Heab	66.50 (9)
H7ba—C9b—Habb	142.89 (6)	Hdbb—Ceb—Hebb	151.97 (10)
H7ba—C9b—Haba	127.32 (5)	Hdbb—Ceb—Cfb	108.03 (6)
H7ba—C9b—Cbb	163.84 (6)	Hdbb—Ceb—Hfab	128.55 (6)
H7ba—C9b—O4bm	144.79 (5)	Hdbb—Ceb—Chb	62.21 (5)
C8b—C9b—H8bb	26.66 (5)	Hdbb—Ceb—Hhab	54.79 (4)
C8b—C9b—H8ba	27.15 (5)	Heab—Ceb—Hebb	111.20 (14)
C8b—C9b—H9bb	109.02 (9)	Heab—Ceb—Cfb	143.31 (10)
C8b—C9b—H9ba	108.90 (9)	Heab—Ceb—Hfab	151.60 (10)
C8b—C9b—Cab	111.60 (10)	Heab—Ceb—Chb	88.63 (9)
C8b—C9b—Habb	94.51 (8)	Heab—Ceb—Hhab	66.31 (8)
C8b—C9b—Haba	98.70 (7)	Hebb—Ceb—Cfb	89.98 (10)
C8b—C9b—Cbb	143.16 (9)	Hebb—Ceb—Hfab	67.48 (8)
C8b—C9b—O4bm	166.52 (8)	Hebb—Ceb—Chb	144.78 (11)
H8bb—C9b—H8ba	45.27 (3)	Hebb—Ceb—Hhab	152.19 (10)
H8bb—C9b—H9bb	135.68 (9)	Cfb—Ceb—Hfab	22.49 (4)
H8bb—C9b—H9ba	95.42 (7)	Cfb—Ceb—Chb	59.73 (5)
H8bb—C9b—Cab	96.27 (8)	Cfb—Ceb—Hhab	80.92 (5)
H8bb—C9b—Habb	73.50 (4)	Hfab—Ceb—Chb	81.21 (5)
H8bb—C9b—Haba	94.43 (5)	Hfab—Ceb—Hhab	101.13 (5)
H8bb—C9b—Cbb	123.45 (6)	Chb—Ceb—Hhab	22.32 (4)
H8bb—C9b—O4bm	140.80 (5)	Ho3b—Cfb—N1b	94.0 (4)
H8ba—C9b—H9bb	95.59 (7)	Ho3b—Cfb—N2b	151.5 (4)
H8ba—C9b—H9ba	136.05 (9)	Ho3b—Cfb—N3b	39.7 (4)
H8ba—C9b—Cab	96.03 (8)	Ho3b—Cfb—N4b	96.0 (4)
H8ba—C9b—Habb	88.99 (5)	Ho3b—Cfb—Ccb	63.2 (3)
H8ba—C9b—Haba	76.18 (4)	Ho3b—Cfb—Hcbb	63.2 (3)
H8ba—C9b—Cbb	126.36 (6)	Ho3b—Cfb—Ceb	123.1 (3)
H8ba—C9b—O4bm	150.10 (5)	Ho3b—Cfb—Hebb	118.0 (3)
H9bb—C9b—H9ba	107.77 (12)	Ho3b—Cfb—Hfab	84.8 (4)
H9bb—C9b—Cab	110.09 (9)	Ho3b—Cfb—Hfbb	88.8 (3)
H9bb—C9b—Habb	136.13 (8)	Ho3b—Cfb—Cgb	65.9 (4)
H9bb—C9b—Haba	94.21 (7)	Ho3b—Cfb—Hgab	67.1 (4)
H9bb—C9b—Cbb	94.88 (7)	Ho3b—Cfb—Chb	125.8 (4)
H9bb—C9b—O4bm	83.20 (7)	Ho3b—Cfb—Hhbb	122.3 (4)
H9ba—C9b—Cab	109.36 (9)	N1b—Cfb—N2b	59.73 (6)
H9ba—C9b—Habb	98.21 (8)	N1b—Cfb—N3b	59.71 (6)
H9ba—C9b—Haba	135.89 (8)	N1b—Cfb—N4b	51.10 (4)
H9ba—C9b—Cbb	88.90 (7)	N1b—Cfb—Ccb	31.47 (4)
H9ba—C9b—O4bm	71.25 (6)	N1b—Cfb—Hcbb	43.51 (3)
Cab—C9b—Habb	26.27 (5)	N1b—Cfb—Ceb	31.56 (4)
Cab—C9b—Haba	26.68 (5)	N1b—Cfb—Hebb	43.40 (3)
Cab—C9b—Cbb	31.87 (6)	N1b—Cfb—Hfab	98.80 (9)
Cab—C9b—O4bm	57.26 (6)	N1b—Cfb—Hfbb	149.99 (12)
Habb—C9b—Haba	44.71 (2)	N1b—Cfb—Cgb	64.70 (5)
Habb—C9b—Cbb	50.15 (4)	N1b—Cfb—Hgab	86.44 (5)
Habb—C9b—O4bm	72.32 (3)	N1b—Cfb—Chb	64.99 (5)
Haba—C9b—Cbb	50.65 (3)	N1b—Cfb—Hhbb	86.93 (5)
Haba—C9b—O4bm	74.13 (3)	N2b—Cfb—N3b	112.00 (11)
Cbb—C9b—O4bm	25.43 (3)	N2b—Cfb—N4b	59.86 (8)
O3b—Cab—O4b	55.76 (8)	N2b—Cfb—Ccb	91.21 (8)
O3b—Cab—C8b	177.59 (8)	N2b—Cfb—Hcbb	98.13 (7)
O3b—Cab—H8bb	156.23 (7)	N2b—Cfb—Ceb	35.93 (6)
O3b—Cab—H8ba	159.24 (7)	N2b—Cfb—Hebb	51.14 (6)
O3b—Cab—C9b	147.11 (10)	N2b—Cfb—Hfab	108.42 (12)
O3b—Cab—H9bb	129.65 (8)	N2b—Cfb—Hfbb	108.50 (11)
O3b—Cab—H9ba	127.68 (8)	N2b—Cfb—Cgb	91.09 (9)
O3b—Cab—Habb	90.83 (9)	N2b—Cfb—Hgab	98.24 (9)
O3b—Cab—Haba	88.18 (8)	N2b—Cfb—Chb	36.05 (7)
O3b—Cab—Cbb	31.32 (7)	N2b—Cfb—Hhbb	51.44 (6)
O3b—Cab—O3bm	0.12 (5)	N3b—Cfb—N4b	59.51 (7)
O3b—Cab—O4bm	56.19 (6)	N3b—Cfb—Ccb	35.93 (6)
O4b—Cab—C8b	125.22 (7)	N3b—Cfb—Hcbb	51.25 (6)
O4b—Cab—H8bb	131.96 (6)	N3b—Cfb—Ceb	91.27 (8)
O4b—Cab—H8ba	138.84 (7)	N3b—Cfb—Hebb	98.05 (7)
O4b—Cab—C9b	91.48 (9)	N3b—Cfb—Hfab	108.43 (11)
O4b—Cab—H9bb	81.39 (7)	N3b—Cfb—Hfbb	108.30 (12)
O4b—Cab—H9ba	74.84 (6)	N3b—Cfb—Cgb	35.56 (7)
O4b—Cab—Habb	116.89 (9)	N3b—Cfb—Hgab	50.80 (6)
O4b—Cab—Haba	120.99 (10)	N3b—Cfb—Chb	90.90 (9)
O4b—Cab—Cbb	24.44 (7)	N3b—Cfb—Hhbb	98.10 (9)
O4b—Cab—O3bm	55.79 (5)	N4b—Cfb—Ccb	65.02 (5)
O4b—Cab—O4bm	0.43 (5)	N4b—Cfb—Hcbb	86.57 (5)
C8b—Cab—H8bb	21.37 (3)	N4b—Cfb—Ceb	65.30 (5)
C8b—Cab—H8ba	21.48 (3)	N4b—Cfb—Hebb	86.58 (5)
C8b—Cab—C9b	34.18 (6)	N4b—Cfb—Hfab	149.91 (10)
C8b—Cab—H9bb	52.49 (4)	N4b—Cfb—Hfbb	98.89 (11)
C8b—Cab—H9ba	52.47 (4)	N4b—Cfb—Cgb	31.24 (4)
C8b—Cab—Habb	86.78 (7)	N4b—Cfb—Hgab	43.40 (4)
C8b—Cab—Haba	92.83 (7)	N4b—Cfb—Chb	31.39 (4)
C8b—Cab—Cbb	149.65 (9)	N4b—Cfb—Hhbb	43.81 (4)
C8b—Cab—O3bm	177.47 (6)	Ccb—Cfb—Hcbb	22.27 (4)
C8b—Cab—O4bm	124.80 (6)	Ccb—Cfb—Ceb	60.18 (5)
H8bb—Cab—H8ba	34.264 (13)	Ccb—Cfb—Hebb	62.45 (4)
H8bb—Cab—C9b	49.60 (6)	Ccb—Cfb—Hfab	89.14 (9)
H8bb—Cab—H9bb	72.31 (3)	Ccb—Cfb—Hfbb	144.21 (12)
H8bb—Cab—H9ba	57.96 (2)	Ccb—Cfb—Cgb	59.66 (5)
H8bb—Cab—Habb	65.50 (6)	Ccb—Cfb—Hgab	80.96 (5)
H8bb—Cab—Haba	100.51 (7)	Ccb—Cfb—Chb	90
H8bb—Cab—Cbb	151.79 (7)	Ccb—Cfb—Hhbb	108.41 (6)
H8bb—Cab—O3bm	156.11 (5)	Hcbb—Cfb—Ceb	62.51 (4)
H8bb—Cab—O4bm	131.59 (4)	Hcbb—Cfb—Hebb	55.14 (3)
H8ba—Cab—C9b	49.50 (5)	Hcbb—Cfb—Hfab	66.86 (8)
H8ba—Cab—H9bb	57.87 (3)	Hcbb—Cfb—Hfbb	151.89 (10)
H8ba—Cab—H9ba	72.34 (3)	Hcbb—Cfb—Cgb	80.86 (5)
H8ba—Cab—Habb	91.63 (7)	Hcbb—Cfb—Hgab	100.86 (5)
H8ba—Cab—Haba	71.42 (6)	Hcbb—Cfb—Chb	108.04 (6)
H8ba—Cab—Cbb	159.98 (9)	Hcbb—Cfb—Hhbb	128.76 (6)
H8ba—Cab—O3bm	159.29 (5)	Ceb—Cfb—Hebb	22.05 (4)
H8ba—Cab—O4bm	138.44 (5)	Ceb—Cfb—Hfab	89.06 (9)
C9b—Cab—H9bb	26.64 (5)	Ceb—Cfb—Hfbb	144.42 (11)
C9b—Cab—H9ba	26.83 (5)	Ceb—Cfb—Cgb	89.97 (6)
C9b—Cab—Habb	108.96 (9)	Ceb—Cfb—Hgab	108.23 (7)
C9b—Cab—Haba	109.41 (9)	Ceb—Cfb—Chb	60.18 (5)
C9b—Cab—Cbb	115.85 (11)	Ceb—Cfb—Hhbb	81.64 (5)
C9b—Cab—O3bm	147.15 (9)	Hebb—Cfb—Hfab	67.01 (8)
C9b—Cab—O4bm	91.05 (7)	Hebb—Cfb—Hfbb	152.14 (10)
H9bb—Cab—H9ba	45.42 (2)	Hebb—Cfb—Cgb	107.67 (6)
H9bb—Cab—Habb	135.38 (8)	Hebb—Cfb—Hgab	128.25 (6)
H9bb—Cab—Haba	93.61 (7)	Hebb—Cfb—Chb	81.21 (5)
H9bb—Cab—Cbb	102.80 (8)	Hebb—Cfb—Hhbb	101.38 (5)
H9bb—Cab—O3bm	129.74 (6)	Hfab—Cfb—Hfbb	111.21 (15)
H9bb—Cab—O4bm	81.01 (4)	Hfab—Cfb—Cgb	143.94 (10)
H9ba—Cab—Habb	97.58 (7)	Hfab—Cfb—Hgab	151.75 (10)
H9ba—Cab—Haba	136.08 (9)	Hfab—Cfb—Chb	144.43 (11)
H9ba—Cab—Cbb	98.27 (8)	Hfab—Cfb—Hhbb	152.07 (10)
H9ba—Cab—O3bm	127.67 (6)	Hfbb—Cfb—Cgb	89.60 (10)
H9ba—Cab—O4bm	74.43 (4)	Hfbb—Cfb—Hgab	67.15 (9)
Habb—Cab—Haba	107.37 (12)	Hfbb—Cfb—Chb	89.33 (10)
Habb—Cab—Cbb	107.35 (10)	Hfbb—Cfb—Hhbb	66.69 (8)
Habb—Cab—O3bm	90.72 (7)	Cgb—Cfb—Hgab	22.45 (3)
Habb—Cab—O4bm	117.03 (8)	Cgb—Cfb—Chb	59.95 (6)
Haba—Cab—Cbb	107.57 (9)	Cgb—Cfb—Hhbb	62.78 (5)
Haba—Cab—O3bm	88.25 (6)	Hgab—Cfb—Chb	62.49 (5)
Haba—Cab—O4bm	121.18 (8)	Hgab—Cfb—Hhbb	55.33 (4)
Cbb—Cab—O3bm	31.36 (5)	Chb—Cfb—Hhbb	22.64 (4)
Cbb—Cab—O4bm	24.87 (5)	Ho3b—Cgb—N1b	91.8 (3)
O3bm—Cab—O4bm	56.22 (3)	Ho3b—Cgb—N2b	91.0 (3)
O3b—Cbb—Ho3b	27.5 (6)	Ho3b—Cgb—N3b	35.5 (4)
O3b—Cbb—O4b	123.23 (16)	Ho3b—Cgb—N4b	147.5 (4)
O3b—Cbb—C9b	144.57 (13)	Ho3b—Cgb—Ccb	61.6 (3)
O3b—Cbb—H9bb	148.53 (11)	Ho3b—Cgb—Hcab	63.6 (3)
O3b—Cbb—H9ba	155.61 (13)	Ho3b—Cgb—Cdb	121.9 (3)
O3b—Cbb—Cab	112.36 (14)	Ho3b—Cgb—Hdab	119.2 (3)
O3b—Cbb—Habb	97.78 (12)	Ho3b—Cgb—Cfb	61.2 (3)
O3b—Cbb—Haba	95.02 (11)	Ho3b—Cgb—Hfbb	63.1 (3)
O3b—Cbb—O3bm	1.10 (9)	Ho3b—Cgb—Hgab	88.6 (3)
O3b—Cbb—O4bm	123.04 (13)	Ho3b—Cgb—Hgbb	88.9 (3)
O3b—Cbb—Hhba^iv	110.89 (11)	Ho3b—Cgb—Chb	120.5 (3)
Ho3b—Cbb—O4b	95.8 (6)	Ho3b—Cgb—Hhbb	117.0 (3)
Ho3b—Cbb—C9b	171.6 (6)	N1b—Cgb—N2b	51.23 (3)
Ho3b—Cbb—H9bb	164.0 (5)	N1b—Cgb—N3b	60.00 (6)
Ho3b—Cbb—H9ba	161.4 (5)	N1b—Cgb—N4b	59.79 (6)
Ho3b—Cbb—Cab	139.5 (6)	N1b—Cgb—Ccb	31.58 (4)
Ho3b—Cbb—Habb	120.7 (6)	N1b—Cgb—Hcab	43.95 (3)
Ho3b—Cbb—Haba	121.6 (5)	N1b—Cgb—Cdb	31.44 (4)
Ho3b—Cbb—O3bm	26.4 (5)	N1b—Cgb—Hdab	43.45 (3)
Ho3b—Cbb—O4bm	95.7 (6)	N1b—Cgb—Cfb	65.06 (5)
Ho3b—Cbb—Hhba^iv	101.3 (5)	N1b—Cgb—Hfbb	86.68 (5)
O4b—Cbb—C9b	92.19 (11)	N1b—Cgb—Hgab	151.35 (11)
O4b—Cbb—H9bb	82.88 (11)	N1b—Cgb—Hgbb	98.36 (9)
O4b—Cbb—H9ba	77.20 (10)	N1b—Cgb—Chb	64.97 (4)
O4b—Cbb—Cab	124.39 (13)	N1b—Cgb—Hhbb	86.57 (4)
O4b—Cbb—Habb	132.44 (11)	N2b—Cgb—N3b	59.56 (7)
O4b—Cbb—Haba	137.13 (12)	N2b—Cgb—N4b	59.58 (7)
O4b—Cbb—O3bm	122.15 (13)	N2b—Cgb—Ccb	65.16 (5)
O4b—Cbb—O4bm	0.19 (9)	N2b—Cgb—Hcab	87.05 (5)
O4b—Cbb—Hhba^iv	70.81 (11)	N2b—Cgb—Cdb	65.02 (5)
C9b—Cbb—H9bb	20.53 (3)	N2b—Cgb—Hdab	86.61 (5)
C9b—Cbb—H9ba	21.30 (3)	N2b—Cgb—Cfb	31.04 (4)
C9b—Cbb—Cab	32.28 (6)	N2b—Cgb—Hfbb	43.12 (4)
C9b—Cbb—Habb	51.35 (4)	N2b—Cgb—Hgab	100.11 (10)
C9b—Cbb—Haba	51.96 (4)	N2b—Cgb—Hgbb	149.58 (10)
C9b—Cbb—O3bm	145.66 (9)	N2b—Cgb—Chb	31.13 (5)
C9b—Cbb—O4bm	92.38 (6)	N2b—Cgb—Hhbb	43.10 (3)
C9b—Cbb—Hhba^iv	79.15 (4)	N3b—Cgb—N4b	112.03 (11)
H9bb—Cbb—H9ba	33.513 (13)	N3b—Cgb—Ccb	36.18 (6)
H9bb—Cbb—Cab	45.96 (6)	N3b—Cgb—Hcab	51.59 (6)
H9bb—Cbb—Habb	69.73 (3)	N3b—Cgb—Cdb	91.43 (8)
H9bb—Cbb—Haba	55.24 (2)	N3b—Cgb—Hdab	98.52 (7)
H9bb—Cbb—O3bm	149.48 (7)	N3b—Cgb—Cfb	35.95 (6)
H9bb—Cbb—O4bm	83.06 (5)	N3b—Cgb—Hfbb	51.27 (6)
H9bb—Cbb—Hhba^iv	93.32 (3)	N3b—Cgb—Hgab	108.81 (13)
H9ba—Cbb—Cab	48.71 (5)	N3b—Cgb—Hgbb	107.75 (11)
H9ba—Cbb—Habb	58.35 (3)	N3b—Cgb—Chb	90.69 (8)
H9ba—Cbb—Haba	72.30 (3)	N3b—Cgb—Hhbb	97.29 (8)
H9ba—Cbb—O3bm	156.37 (8)	N4b—Cgb—Ccb	91.37 (8)
H9ba—Cbb—O4bm	77.39 (5)	N4b—Cgb—Hcab	98.71 (7)
H9ba—Cbb—Hhba^iv	60.11 (2)	N4b—Cgb—Cdb	35.95 (6)
Cab—Cbb—Habb	27.02 (5)	N4b—Cgb—Hdab	51.27 (6)
Cab—Cbb—Haba	27.53 (5)	N4b—Cgb—Cfb	90.62 (9)
Cab—Cbb—O3bm	113.44 (10)	N4b—Cgb—Hfbb	97.34 (8)
Cab—Cbb—O4bm	124.58 (9)	N4b—Cgb—Hgab	108.73 (11)
Cab—Cbb—Hhba^iv	89.22 (6)	N4b—Cgb—Hgbb	109.22 (13)
Habb—Cbb—Haba	45.55 (3)	N4b—Cgb—Chb	35.90 (7)
Habb—Cbb—O3bm	98.69 (7)	N4b—Cgb—Hhbb	51.31 (6)
Habb—Cbb—O4bm	132.61 (7)	Ccb—Cgb—Hcab	22.57 (4)
Habb—Cbb—Hhba^iv	72.77 (4)	Ccb—Cgb—Cdb	60.30 (5)
Haba—Cbb—O3bm	96.10 (7)	Ccb—Cgb—Hdab	62.70 (5)
Haba—Cbb—O4bm	137.28 (8)	Ccb—Cgb—Cfb	60.19 (5)
Haba—Cbb—Hhba^iv	115.94 (5)	Ccb—Cgb—Hfbb	81.50 (6)
O3bm—Cbb—O4bm	121.95 (9)	Ccb—Cgb—Hgab	144.98 (13)
O3bm—Cbb—Hhba^iv	110.54 (6)	Ccb—Cgb—Hgbb	88.39 (9)
O4bm—Cbb—Hhba^iv	70.88 (5)	Ccb—Cgb—Chb	89.97 (6)
O1a—O1am—Ho1a	73 (3)	Ccb—Cgb—Hhbb	107.89 (6)
O1a—O1am—O2a	20 (3)	Hcab—Cgb—Cdb	63.06 (4)
O1a—O1am—C1a	39 (3)	Hcab—Cgb—Hdab	55.59 (3)
O1a—O1am—C2a	71 (3)	Hcab—Cgb—Cfb	81.64 (5)
O1a—O1am—H2aa	69 (3)	Hcab—Cgb—Hfbb	101.65 (6)
O1a—O1am—H2ab	95 (3)	Hcab—Cgb—Hgab	151.51 (11)
O1a—O1am—H7ab^i	145 (3)	Hcab—Cgb—Hgbb	65.82 (8)
O1a—O1am—O2am	19 (3)	Hcab—Cgb—Chb	108.43 (6)
O1a—O1am—Heaa^ii	83 (3)	Hcab—Cgb—Hhbb	128.69 (6)
O1a—O1am—N1b^ii	76 (3)	Cdb—Cgb—Hdab	22.32 (4)
Ho1a—O1am—O2a	81.5 (8)	Cdb—Cgb—Cfb	89.84 (6)
Ho1a—O1am—C1a	108.0 (8)	Cdb—Cgb—Hfbb	107.78 (6)
Ho1a—O1am—C2a	143.8 (8)	Cdb—Cgb—Hgab	144.68 (11)
Ho1a—O1am—H2aa	140.6 (8)	Cdb—Cgb—Hgbb	89.43 (9)
Ho1a—O1am—H2ab	164.1 (9)	Cdb—Cgb—Chb	59.94 (5)
Ho1a—O1am—H7ab^i	127.3 (8)	Cdb—Cgb—Hhbb	81.28 (5)
Ho1a—O1am—O2am	80.9 (8)	Hdab—Cgb—Cfb	108.00 (6)
Ho1a—O1am—Heaa^ii	88.8 (10)	Hdab—Cgb—Hfbb	128.28 (6)
Ho1a—O1am—N1b^ii	6.4 (10)	Hdab—Cgb—Hgab	151.50 (12)
O2a—O1am—C1a	26.55 (7)	Hdab—Cgb—Hgbb	67.12 (8)
O2a—O1am—C2a	62.47 (6)	Hdab—Cgb—Chb	81.20 (5)
O2a—O1am—H2aa	67.18 (5)	Hdab—Cgb—Hhbb	101.30 (5)
O2a—O1am—H2ab	83.95 (5)	Cfb—Cgb—Hfbb	22.38 (4)
O2a—O1am—H7ab^i	126.31 (5)	Cfb—Cgb—Hgab	90.40 (10)
O2a—O1am—O2am	0.68 (5)	Cfb—Cgb—Hgbb	143.66 (12)
O2a—O1am—Heaa^ii	101.55 (5)	Cfb—Cgb—Chb	59.36 (6)
O2a—O1am—N1b^ii	85.47 (5)	Cfb—Cgb—Hhbb	61.58 (5)
C1a—O1am—C2a	35.93 (6)	Hfbb—Cgb—Hgab	68.02 (9)
C1a—O1am—H2aa	43.34 (5)	Hfbb—Cgb—Hgbb	151.79 (11)
C1a—O1am—H2ab	57.72 (5)	Hfbb—Cgb—Chb	61.69 (5)
C1a—O1am—H7ab^i	107.71 (5)	Hfbb—Cgb—Hhbb	53.99 (3)
C1a—O1am—O2am	27.11 (5)	Hgab—Cgb—Hgbb	110.30 (14)
C1a—O1am—Heaa^ii	100.81 (5)	Hgab—Cgb—Chb	90.35 (9)
C1a—O1am—N1b^ii	111.83 (5)	Hgab—Cgb—Hhbb	67.98 (7)
C2a—O1am—H2aa	19.94 (3)	Hgbb—Cgb—Chb	145.03 (12)
C2a—O1am—H2ab	23.31 (3)	Hgbb—Cgb—Hhbb	153.50 (12)
C2a—O1am—H7ab^i	80.66 (3)	Chb—Cgb—Hhbb	22.38 (3)
C2a—O1am—O2am	63.02 (3)	N1b—Chb—N2b	60.09 (6)
C2a—O1am—Heaa^ii	95.26 (3)	N1b—Chb—N3b	51.43 (3)
C2a—O1am—N1b^ii	147.00 (3)	N1b—Chb—N4b	59.86 (6)
H2aa—O1am—H2ab	34.225	N1b—Chb—Cdb	31.47 (4)
H2aa—O1am—H7ab^i	91.317	N1b—Chb—Hdbb	43.52 (3)
H2aa—O1am—O2am	67.548	N1b—Chb—Ceb	31.70 (4)
H2aa—O1am—Heaa^ii	75.327 (12)	N1b—Chb—Heab	43.94 (3)
H2aa—O1am—N1b^ii	140.245 (14)	N1b—Chb—Cfb	65.46 (4)
H2ab—O1am—H7ab^i	58.345	N1b—Chb—Hfab^ix	117.82 (5)
H2ab—O1am—O2am	84.56	N1b—Chb—Hfbb	87.37 (4)
H2ab—O1am—Heaa^ii	100.452 (13)	N1b—Chb—Cgb	65.07 (4)
H2ab—O1am—N1b^ii	169.331 (16)	N1b—Chb—Hgab	86.99 (4)
H7ab^i—O1am—O2am	126.965	N1b—Chb—Hhbb	150.98 (10)
H7ab^i—O1am—Heaa^ii	120.434 (14)	N1b—Chb—Hhab	99.94 (9)
H7ab^i—O1am—N1b^ii	128.437 (14)	N2b—Chb—N3b	60.17 (6)
O2am—O1am—Heaa^ii	101.144 (14)	N2b—Chb—N4b	112.57 (10)
O2am—O1am—N1b^ii	84.874 (15)	N2b—Chb—Cdb	91.56 (8)
Heaa^ii—O1am—N1b^ii	83.05 (2)	N2b—Chb—Hdbb	98.27 (7)
O1a—O2am—Ho1a	24.7 (4)	N2b—Chb—Ceb	35.92 (6)
O1a—O2am—O2a	88 (4)	N2b—Chb—Heab	51.62 (6)
O1a—O2am—C1a	30.13 (7)	N2b—Chb—Cfb	35.93 (6)
O1a—O2am—C2a	60.84 (6)	N2b—Chb—Hfab^ix	175.19 (8)
O1a—O2am—H2aa	64.86 (5)	N2b—Chb—Hfbb	51.59 (6)
O1a—O2am—C3a	89.15 (6)	N2b—Chb—Cgb	91.68 (8)
O1a—O2am—H3aa	107.84 (5)	N2b—Chb—Hgab	98.84 (8)
O1a—O2am—O1am	0.31 (5)	N2b—Chb—Hhbb	108.14 (13)
O1a—O2am—Heaa^iii	157.01 (5)	N2b—Chb—Hhab	108.91 (12)
O1a—O2am—Hhaa^iii	124.20 (6)	N3b—Chb—N4b	59.85 (7)
O1a—O2am—Hcbb^ii	89.71 (5)	N3b—Chb—Cdb	65.34 (5)
O1a—O2am—Hdab^iii	141.19 (5)	N3b—Chb—Hdbb	87.06 (4)
O1a—O2am—Hdbb^iii	116.58 (5)	N3b—Chb—Ceb	65.42 (5)
Ho1a—O2am—O2a	108 (4)	N3b—Chb—Heab	87.46 (5)
Ho1a—O2am—C1a	54.9 (4)	N3b—Chb—Cfb	31.85 (4)
Ho1a—O2am—C2a	85.5 (4)	N3b—Chb—Hfab^ix	115.04 (5)
Ho1a—O2am—H2aa	87.8 (4)	N3b—Chb—Hfbb	43.96 (4)
Ho1a—O2am—C3a	113.4 (4)	N3b—Chb—Cgb	31.51 (5)
Ho1a—O2am—H3aa	132.4 (4)	N3b—Chb—Hgab	43.76 (3)
Ho1a—O2am—O1am	24.8 (4)	N3b—Chb—Hhbb	99.56 (9)
Ho1a—O2am—Heaa^iii	168.2 (4)	N3b—Chb—Hhab	151.37 (10)
Ho1a—O2am—Hhaa^iii	113.1 (4)	N4b—Chb—Cdb	36.03 (6)
Ho1a—O2am—Hcbb^ii	65.3 (4)	N4b—Chb—Hdbb	51.57 (6)
Ho1a—O2am—Hdab^iii	117.1 (4)	N4b—Chb—Ceb	91.56 (8)
Ho1a—O2am—Hdbb^iii	98.1 (4)	N4b—Chb—Heab	98.49 (7)
O2a—O2am—C1a	63 (5)	N4b—Chb—Cfb	91.70 (8)
O2a—O2am—C2a	44 (5)	N4b—Chb—Hfab^ix	63.55 (7)
O2a—O2am—H2aa	60 (5)	N4b—Chb—Hfbb	98.58 (8)
O2a—O2am—C3a	23 (4)	N4b—Chb—Cgb	35.70 (7)
O2a—O2am—H3aa	35 (4)	N4b—Chb—Hgab	51.04 (6)
O2a—O2am—O1am	87 (4)	N4b—Chb—Hhbb	109.31 (12)
O2a—O2am—Heaa^iii	82 (4)	N4b—Chb—Hhab	108.79 (13)
O2a—O2am—Hhaa^iii	134 (4)	Cdb—Chb—Hdbb	22.49 (3)
O2a—O2am—Hcbb^ii	155 (4)	Cdb—Chb—Ceb	60.37 (5)
O2a—O2am—Hdab^iii	116 (5)	Cdb—Chb—Heab	62.72 (5)
O2a—O2am—Hdbb^iii	101 (4)	Cdb—Chb—Cfb	90.60 (6)
C1a—O2am—C2a	30.74 (6)	Cdb—Chb—Hfab^ix	86.46 (6)
C1a—O2am—H2aa	38.35 (5)	Cdb—Chb—Hfbb	108.88 (5)
C1a—O2am—C3a	59.66 (6)	Cdb—Chb—Cgb	59.93 (5)
C1a—O2am—H3aa	77.81 (5)	Cdb—Chb—Hgab	81.37 (5)
C1a—O2am—O1am	30.01 (5)	Cdb—Chb—Hhbb	145.33 (12)
C1a—O2am—Heaa^iii	128.69 (5)	Cdb—Chb—Hhab	90.05 (9)
C1a—O2am—Hhaa^iii	128.92 (6)	Hdbb—Chb—Ceb	62.61 (5)
C1a—O2am—Hcbb^ii	119.42 (5)	Hdbb—Chb—Heab	54.90 (3)
C1a—O2am—Hdab^iii	167.72 (5)	Hdbb—Chb—Cfb	108.61 (5)
C1a—O2am—Hdbb^iii	134.78 (5)	Hdbb—Chb—Hfab^ix	81.52 (5)
C2a—O2am—H2aa	19.45 (3)	Hdbb—Chb—Hfbb	129.33 (5)
C2a—O2am—C3a	31.03 (4)	Hdbb—Chb—Cgb	81.36 (5)
C2a—O2am—H3aa	47.49 (3)	Hdbb—Chb—Hgab	101.47 (5)
C2a—O2am—O1am	60.73 (3)	Hdbb—Chb—Hhbb	152.59 (12)
C2a—O2am—Heaa^iii	98.34 (3)	Hdbb—Chb—Hhab	67.57 (8)
C2a—O2am—Hhaa^iii	119.78 (3)	Ceb—Chb—Heab	22.82 (4)
C2a—O2am—Hcbb^ii	148.65 (3)	Ceb—Chb—Cfb	60.09 (5)
C2a—O2am—Hdab^iii	155.77 (3)	Ceb—Chb—Hfab^ix	144.13 (7)
C2a—O2am—Hdbb^iii	142.15 (3)	Ceb—Chb—Hfbb	81.71 (5)
H2aa—O2am—C3a	41.40 (3)	Ceb—Chb—Cgb	90.34 (6)
H2aa—O2am—H3aa	51.155	Ceb—Chb—Hgab	108.72 (5)
H2aa—O2am—O1am	64.861	Ceb—Chb—Hhbb	144.05 (13)
H2aa—O2am—Heaa^iii	92.251 (15)	Ceb—Chb—Hhab	90.26 (10)
H2aa—O2am—Hhaa^iii	101.171 (17)	Heab—Chb—Cfb	81.80 (5)
H2aa—O2am—Hcbb^ii	139.441 (16)	Heab—Chb—Hfab^ix	130.52 (6)
H2aa—O2am—Hdab^iii	153.237 (13)	Heab—Chb—Hfbb	102.09 (5)
H2aa—O2am—Hdbb^iii	160.594 (14)	Heab—Chb—Cgb	108.64 (5)
C3a—O2am—H3aa	19.67 (2)	Heab—Chb—Hgab	129.44 (5)
C3a—O2am—O1am	88.97 (2)	Heab—Chb—Hhbb	151.11 (12)
C3a—O2am—Heaa^iii	73.55 (3)	Heab—Chb—Hhab	67.43 (8)
C3a—O2am—Hhaa^iii	115.98 (3)	Cfb—Chb—Hfab^ix	139.62 (6)
C3a—O2am—Hcbb^ii	177.65 (2)	Cfb—Chb—Hfbb	22.69 (4)
C3a—O2am—Hdab^iii	124.82 (3)	Cfb—Chb—Cgb	60.69 (6)
C3a—O2am—Hdbb^iii	120.20 (3)	Cfb—Chb—Hgab	63.23 (5)
H3aa—O2am—O1am	107.686	Cfb—Chb—Hhbb	89.51 (10)
H3aa—O2am—Heaa^iii	53.897 (14)	Cfb—Chb—Hhab	144.84 (12)
H3aa—O2am—Hhaa^iii	99.282 (15)	Hfab^ix—Chb—Hfbb	125.08 (5)
H3aa—O2am—Hcbb^ii	161.971 (14)	Hfab^ix—Chb—Cgb	83.54 (6)
H3aa—O2am—Hdab^iii	108.660 (14)	Hfab^ix—Chb—Hgab	76.54 (4)
H3aa—O2am—Hdbb^iii	114.191 (14)	Hfab^ix—Chb—Hhbb	71.54 (9)
O1am—O2am—Heaa^iii	157.038 (15)	Hfab^ix—Chb—Hhab	75.49 (9)
O1am—O2am—Hhaa^iii	124.507 (19)	Hfbb—Chb—Cgb	63.12 (5)
O1am—O2am—Hcbb^ii	89.885 (15)	Hfbb—Chb—Hgab	55.65 (4)
O1am—O2am—Hdab^iii	141.240 (13)	Hfbb—Chb—Hhbb	66.82 (9)
O1am—O2am—Hdbb^iii	116.469 (13)	Hfbb—Chb—Hhab	151.70 (12)
Heaa^iii—O2am—Hhaa^iii	55.31 (2)	Cgb—Chb—Hgab	22.60 (3)
Heaa^iii—O2am—Hcbb^ii	108.08 (2)	Cgb—Chb—Hhbb	90.47 (9)
Heaa^iii—O2am—Hdab^iii	61.34 (2)	Cgb—Chb—Hhab	144.48 (12)
Heaa^iii—O2am—Hdbb^iii	85.65 (2)	Hgab—Chb—Hhbb	67.87 (8)
Hhaa^iii—O2am—Hcbb^ii	66.34 (2)	Hgab—Chb—Hhab	151.17 (12)
Hhaa^iii—O2am—Hdab^iii	61.39 (2)	Hhbb—Chb—Hhab	109.07 (12)
Hhaa^iii—O2am—Hdbb^iii	93.49 (2)

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

(123K)

Crystal data

C17H32N4O4	F(000) = 1552
Mr = 356.5	Dx = 1.264 (1) Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71069 Å
a = 5.8970 (3) Å	Cell parameters from 40268 reflections
b = 27.7416 (19) Å	θ = 1.9–24.7°
c = 23.4968 (12) Å	µ = 0.09 mm^−1
β = 102.981 (5)°	T = 123 K
V = 3745.7 (4) Å^3	Platelets, transparent
Z = 8	0.30 × 0.23 × 0.20 mm

Data collection

Stoe-IPDS diffractometer	5542 reflections with I > 2σ(I)
Radiation source: Sealed tube	Rint = 0.076
Graphite monochromator	θmax = 24.7°, θmin = 1.9°
Oscillation scans	h = −6→6
40268 measured reflections	k = −32→32
6835 independent reflections	l = −27→27

Refinement

Refinement on F^2	H atoms treated by a mixture of independent and constrained refinement
R[F^2 > 2σ(F^2)] = 0.035	Weighting scheme based on measured s.u.'s w = 1/(σ^2(I) + 0.0016I^2)
wR(F^2) = 0.088	(Δ/σ)max = 0.007
S = 1.24	Δρmax = 0.31 e Å^−3
6835 reflections	Δρmin = −0.25 e Å^−3
439 parameters

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

	x	y	z	Uiso*/Ueq
O1a	1.9993 (4)	0.35398 (8)	1.07286 (9)	0.0253 (3)
Ho1a	2.034 (3)	0.3262 (6)	1.0986 (7)	0.035658 (2)*
O2a	1.6407 (4)	0.32435 (8)	1.05310 (9)	0.0321 (3)
O3a	0.2554 (4)	0.63303 (8)	0.65728 (9)	0.0303 (3)
Ho3a	0.146 (3)	0.6547 (7)	0.6482 (7)	0.043221 (2)*
O4a	0.2758 (4)	0.65770 (9)	0.74765 (9)	0.0459 (4)
C1a	1.7793 (2)	0.35451 (4)	1.04520 (5)	0.0183 (4)
C2a	1.7196 (2)	0.39485 (4)	1.00158 (5)	0.0211 (4)
H2aa	1.7472	0.3828	0.9647	0.030960 (3)*
H2ab	1.8285	0.4214	1.0144	0.030960 (3)*
C3a	1.4705 (2)	0.41251 (4)	0.99082 (5)	0.0223 (4)
H3ab	1.4446	0.4272	1.0272	0.032714 (3)*
H3aa	1.3623	0.3851	0.981	0.032714 (3)*
C4a	1.4165 (2)	0.44925 (4)	0.94129 (5)	0.0220 (4)
H4ab	1.5303	0.4752	0.9507	0.032093 (3)*
H4aa	1.4354	0.4334	0.9055	0.032093 (3)*
C5a	1.1745 (2)	0.47066 (4)	0.93045 (5)	0.0212 (4)
H5ab	1.1579	0.488	0.9659	0.030957 (3)*
H5aa	1.0563	0.4443	0.9229	0.030957 (3)*
C6a	1.1263 (2)	0.50514 (4)	0.87868 (5)	0.0226 (4)
H6ab	1.2448	0.5311	0.8862	0.032777 (3)*
H6aa	1.1455	0.4877	0.8444	0.032777 (3)*
C7a	0.8856 (2)	0.52768 (4)	0.86480 (5)	0.0218 (4)
H7ab	0.8716	0.5495	0.896	0.031602 (3)*
H7aa	0.7668	0.5023	0.8624	0.031602 (3)*
C8a	0.8380 (2)	0.55554 (4)	0.80730 (5)	0.0233 (4)
H8ab	0.9625	0.5798	0.8092	0.033915 (3)*
H8aa	0.8446	0.533	0.7754	0.033915 (3)*
C9a	0.6042 (2)	0.58097 (4)	0.79215 (5)	0.0223 (4)
H9ab	0.4814	0.5584	0.7967	0.032566 (3)*
H9aa	0.6037	0.6082	0.8196	0.032566 (3)*
Caa	0.5528 (2)	0.59992 (4)	0.72967 (5)	0.0209 (4)
Haab	0.6902	0.6179	0.7238	0.030407 (3)*
Haaa	0.5292	0.5733	0.7024	0.030407 (3)*
Cba	0.3463 (2)	0.63304 (4)	0.71334 (5)	0.0204 (4)
O1b	2.0067 (4)	0.36770 (7)	0.83562 (9)	0.0259 (3)
Ho1b	2.032 (3)	0.3443 (6)	0.8646 (7)	0.038474 (2)*
O2b	1.6433 (4)	0.36024 (8)	0.84599 (9)	0.0355 (4)
O3b	0.2559 (4)	0.61942 (8)	0.38635 (9)	0.0263 (3)
Ho3b	0.129 (3)	0.6405 (6)	0.3735 (7)	0.039390 (2)*
O4b	0.1690 (4)	0.62314 (8)	0.47305 (9)	0.0351 (4)
C1b	1.7817 (3)	0.37774 (4)	0.82163 (5)	0.0178 (4)
C2b	1.7202 (2)	0.41193 (4)	0.77066 (5)	0.0205 (4)
H2ba	1.7376	0.3942	0.7364	0.030624 (3)*
H2bb	1.8352	0.4381	0.7767	0.030624 (3)*
C3b	1.4764 (2)	0.43281 (4)	0.75965 (5)	0.0198 (4)
H3bb	1.4673	0.4553	0.7914	0.029463 (3)*
H3ba	1.3628	0.4064	0.7603	0.029463 (3)*
C4b	1.4122 (2)	0.45915 (4)	0.70118 (5)	0.0202 (4)
H4bb	1.5295	0.4844	0.7008	0.030296 (3)*
H4ba	1.4211	0.4363	0.6695	0.030296 (3)*
C5b	1.1722 (2)	0.48215 (4)	0.68753 (5)	0.0227 (4)
H5bb	1.168	0.508	0.7166	0.033828 (3)*
H5ba	1.0538	0.4575	0.6917	0.033828 (3)*
C6b	1.1065 (2)	0.50305 (4)	0.62599 (5)	0.0227 (4)
H6bb	1.2265	0.5259	0.6208	0.033771 (3)*
H6ba	1.1055	0.4768	0.5979	0.033771 (3)*
C7b	0.8717 (2)	0.52808 (4)	0.61078 (5)	0.0223 (4)
H7bb	0.8746	0.5563	0.6369	0.032966 (3)*
H7ba	0.7503	0.506	0.6179	0.032966 (3)*
C8b	0.8065 (2)	0.54423 (4)	0.54706 (5)	0.0219 (4)
H8bb	0.9251	0.5669	0.5408	0.032508 (3)*
H8ba	0.8112	0.516	0.5219	0.032508 (3)*
C9b	0.5676 (2)	0.56713 (4)	0.52806 (5)	0.0207 (4)
H9bb	0.4479	0.5435	0.5343	0.030599 (3)*
H9ba	0.5587	0.5955	0.5527	0.030599 (3)*
Cab	0.5159 (2)	0.58195 (4)	0.46407 (5)	0.0211 (4)
Habb	0.6428	0.6015	0.4573	0.031617 (3)*
Haba	0.5075	0.5534	0.4398	0.031617 (3)*
Cbb	0.2950 (2)	0.60989 (4)	0.44263 (5)	0.0184 (4)
N1a	−0.11873 (13)	0.78759 (2)	0.59777 (3)	0.0177 (2)
N2a	−0.1972 (2)	0.73097 (4)	0.51570 (5)	0.0182 (2)
N3a	−0.0551 (2)	0.70115 (4)	0.61532 (5)	0.0182 (2)
N4a	−0.4502 (2)	0.73265 (4)	0.58519 (5)	0.0190 (2)
Cca	0.0279 (2)	0.75044 (4)	0.63353 (5)	0.0187 (3)
Hcba	0.18945 (13)	0.75412 (2)	0.62912 (3)	0.0242 (4)
Hcaa	0.02206 (13)	0.75472 (2)	0.67474 (3)	0.0229 (5)
Cda	−0.3608 (2)	0.78110 (5)	0.60356 (5)	0.0187 (3)
Hdaa	−0.36620 (13)	0.78614 (2)	0.64438 (3)	0.0230 (4)
Hdba	−0.45912 (13)	0.80491 (2)	0.57878 (3)	0.0238 (4)
Cea	−0.1120 (2)	0.77931 (5)	0.53576 (5)	0.0195 (3)
Heaa	−0.21514 (13)	0.80348 (2)	0.51109 (3)	0.0247 (4)
Heba	0.04757 (13)	0.78268 (2)	0.53162 (3)	0.0249 (4)
Cfa	−0.0511 (2)	0.69521 (5)	0.55262 (6)	0.0193 (3)
Hfaa	0.11033 (13)	0.69935 (2)	0.54858 (3)	0.0242 (4)
Hfba	−0.11075 (13)	0.66247 (2)	0.53961 (3)	0.0244 (5)
Cga	−0.2981 (3)	0.69713 (5)	0.62123 (6)	0.0201 (3)
Hgaa	−0.35713 (13)	0.66422 (2)	0.60855 (3)	0.0264 (5)
Hgba	−0.29983 (13)	0.70227 (2)	0.66285 (3)	0.0249 (5)
Cha	−0.4356 (2)	0.72585 (5)	0.52386 (6)	0.0200 (3)
Hhba	−0.49187 (13)	0.69335 (2)	0.51087 (3)	0.0256 (4)
Hhaa	−0.53507 (13)	0.74982 (2)	0.49974 (3)	0.0251 (4)
N1b	−0.12310 (13)	0.77467 (3)	0.36194 (3)	0.0178 (2)
N2b	−0.1992 (2)	0.73969 (4)	0.26377 (5)	0.0203 (2)
N3b	−0.0637 (2)	0.68835 (4)	0.34931 (5)	0.0180 (3)
N4b	−0.4570 (2)	0.72140 (4)	0.32926 (5)	0.0191 (3)
Ccb	0.0204 (2)	0.73201 (5)	0.38408 (5)	0.0179 (3)
Hcbb	0.18290 (13)	0.73845 (3)	0.38201 (3)	0.0221 (5)
Hcab	0.01229 (13)	0.72595 (3)	0.42482 (3)	0.0228 (5)
Cdb	−0.3665 (2)	0.76430 (5)	0.36393 (5)	0.0190 (3)
Hdab	−0.37419 (13)	0.75906 (3)	0.40456 (3)	0.0238 (4)
Hdbb	−0.46278 (13)	0.79204 (3)	0.34794 (3)	0.0239 (4)
Ceb	−0.1129 (2)	0.78201 (5)	0.29999 (5)	0.0211 (3)
Heab	−0.21405 (13)	0.81002 (3)	0.28421 (3)	0.0275 (4)
Hebb	0.04747 (13)	0.78806 (3)	0.29806 (3)	0.0266 (4)
Cfb	−0.0562 (2)	0.69807 (5)	0.28749 (6)	0.0199 (3)
Hfab	0.10618 (13)	0.70485 (3)	0.28593 (3)	0.0244 (4)
Hfbb	−0.11651 (13)	0.66923 (3)	0.26350 (3)	0.0256 (5)
Cgb	−0.3080 (3)	0.68030 (5)	0.35225 (6)	0.0207 (3)
Hgab	−0.36771 (13)	0.65124 (3)	0.32853 (3)	0.0270 (5)
Hgbb	−0.31197 (13)	0.67501 (3)	0.39371 (3)	0.0265 (5)
Chb	−0.4390 (2)	0.73008 (5)	0.26850 (6)	0.0209 (3)
Hhbb	−0.49594 (13)	0.70151 (3)	0.24463 (3)	0.0264 (4)
Hhab	−0.53643 (13)	0.75780 (3)	0.25320 (3)	0.0261 (4)

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
O1a	0.0209 (6)	0.0176 (4)	0.0335 (5)	0.0001 (3)	−0.0021 (4)	0.0088 (4)
O2a	0.0237 (6)	0.0244 (5)	0.0442 (6)	−0.0044 (4)	−0.0011 (4)	0.0139 (4)
O3a	0.0358 (6)	0.0278 (5)	0.0237 (5)	0.0170 (4)	−0.0007 (4)	0.0019 (4)
O4a	0.0529 (8)	0.0524 (7)	0.0293 (5)	0.0359 (6)	0.0027 (5)	−0.0056 (5)
C1a	0.0191 (8)	0.0143 (6)	0.0210 (6)	0.0008 (5)	0.0033 (5)	−0.0018 (5)
C2a	0.0221 (8)	0.0170 (6)	0.0235 (6)	0.0010 (5)	0.0032 (5)	0.0040 (5)
C3a	0.0213 (8)	0.0182 (6)	0.0266 (6)	0.0026 (5)	0.0036 (5)	0.0043 (5)
C4a	0.0223 (8)	0.0192 (6)	0.0233 (6)	0.0027 (5)	0.0025 (5)	0.0032 (5)
C5a	0.0205 (7)	0.0180 (6)	0.0240 (6)	0.0022 (5)	0.0026 (5)	0.0015 (5)
C6a	0.0205 (8)	0.0218 (6)	0.0239 (6)	0.0028 (5)	0.0020 (5)	0.0027 (5)
C7a	0.0210 (7)	0.0194 (6)	0.0234 (6)	0.0027 (5)	0.0017 (5)	0.0014 (5)
C8a	0.0209 (8)	0.0228 (6)	0.0248 (6)	0.0039 (5)	0.0020 (5)	0.0037 (5)
C9a	0.0216 (8)	0.0190 (6)	0.0252 (6)	0.0045 (5)	0.0031 (5)	0.0024 (5)
Caa	0.0220 (7)	0.0159 (6)	0.0236 (6)	0.0045 (5)	0.0027 (5)	−0.0004 (5)
Cba	0.0221 (8)	0.0151 (6)	0.0231 (7)	0.0018 (5)	0.0031 (5)	0.0010 (5)
O1b	0.0224 (6)	0.0231 (5)	0.0322 (5)	0.0047 (4)	0.0061 (4)	0.0112 (4)
O2b	0.0260 (6)	0.0390 (6)	0.0433 (6)	0.0026 (4)	0.0119 (4)	0.0222 (5)
O3b	0.0281 (6)	0.0285 (5)	0.0230 (4)	0.0129 (4)	0.0070 (4)	0.0059 (4)
O4b	0.0337 (7)	0.0449 (6)	0.0293 (5)	0.0174 (5)	0.0125 (4)	0.0034 (4)
C1b	0.0202 (9)	0.0128 (5)	0.0205 (6)	−0.0001 (5)	0.0048 (5)	−0.0016 (4)
C2b	0.0231 (8)	0.0174 (6)	0.0213 (6)	0.0008 (5)	0.0060 (5)	0.0021 (5)
C3b	0.0212 (7)	0.0175 (6)	0.0209 (6)	0.0003 (5)	0.0053 (5)	0.0014 (5)
C4b	0.0229 (8)	0.0155 (6)	0.0228 (6)	0.0019 (5)	0.0062 (5)	0.0019 (5)
C5b	0.0213 (8)	0.0244 (6)	0.0226 (6)	0.0015 (5)	0.0054 (5)	0.0030 (5)
C6b	0.0210 (8)	0.0247 (6)	0.0226 (6)	0.0019 (5)	0.0052 (5)	0.0026 (5)
C7b	0.0212 (7)	0.0225 (6)	0.0229 (6)	0.0010 (5)	0.0043 (5)	0.0011 (5)
C8b	0.0219 (8)	0.0206 (6)	0.0232 (6)	0.0007 (5)	0.0053 (5)	0.0022 (5)
C9b	0.0225 (8)	0.0173 (6)	0.0220 (6)	0.0005 (5)	0.0042 (5)	0.0000 (5)
Cab	0.0217 (8)	0.0189 (6)	0.0232 (6)	0.0029 (5)	0.0061 (5)	0.0010 (5)
Cbb	0.0210 (8)	0.0136 (5)	0.0212 (7)	−0.0023 (5)	0.0060 (5)	−0.0016 (5)
N1a	0.0169 (5)	0.0146 (3)	0.0212 (4)	−0.0018 (2)	0.0037 (2)	−0.0022 (2)
N2a	0.0193 (5)	0.0192 (4)	0.0163 (3)	0.0013 (3)	0.0039 (2)	−0.0012 (2)
N3a	0.0188 (4)	0.0167 (4)	0.0186 (4)	0.0030 (3)	0.0028 (2)	0.0008 (3)
N4a	0.0136 (3)	0.0207 (4)	0.0232 (5)	−0.0020 (2)	0.0050 (2)	−0.0023 (3)
Cca	0.0147 (4)	0.0208 (6)	0.0191 (3)	−0.0003 (3)	0.0008 (3)	−0.0024 (3)
Hcba	0.0136 (3)	0.0298 (10)	0.0272 (8)	−0.0014 (4)	0.0003 (3)	−0.0037 (6)
Hcaa	0.0217 (8)	0.0264 (10)	0.0183 (3)	0.0003 (6)	−0.0006 (3)	−0.0039 (4)
Cda	0.0164 (5)	0.0179 (3)	0.0222 (5)	0.0024 (3)	0.0050 (3)	−0.0030 (3)
Hdaa	0.0224 (9)	0.0237 (6)	0.0244 (6)	0.0030 (5)	0.0086 (6)	−0.0058 (5)
Hdba	0.0210 (7)	0.0209 (4)	0.0290 (9)	0.0073 (4)	0.0044 (5)	−0.0021 (4)
Cea	0.0204 (5)	0.0179 (3)	0.0210 (4)	−0.0012 (3)	0.0065 (3)	0.0022 (3)
Heaa	0.0304 (9)	0.0197 (5)	0.0243 (6)	0.0013 (4)	0.0066 (5)	0.0059 (4)
Heba	0.0236 (6)	0.0258 (5)	0.0282 (7)	−0.0047 (4)	0.0117 (6)	0.0026 (5)
Cfa	0.0197 (5)	0.0180 (3)	0.0204 (5)	0.0040 (3)	0.0052 (3)	−0.0022 (3)
Hfaa	0.0203 (5)	0.0274 (6)	0.0263 (9)	0.0070 (5)	0.0083 (5)	−0.0026 (5)
Hfba	0.0301 (10)	0.0175 (3)	0.0255 (9)	0.0045 (3)	0.0060 (6)	−0.0049 (4)
Cga	0.0222 (6)	0.0176 (4)	0.0217 (4)	−0.0029 (3)	0.0073 (3)	0.0010 (3)
Hgaa	0.0316 (9)	0.0182 (3)	0.0307 (9)	−0.0070 (4)	0.0099 (6)	0.0012 (4)
Hgba	0.0299 (10)	0.0248 (7)	0.0224 (4)	−0.0026 (6)	0.0111 (5)	0.0030 (4)
Cha	0.0162 (4)	0.0213 (5)	0.0205 (3)	−0.0009 (3)	−0.0002 (2)	−0.0033 (3)
Hhba	0.0220 (6)	0.0253 (7)	0.0264 (6)	−0.0054 (5)	−0.0008 (4)	−0.0074 (5)
Hhaa	0.0190 (5)	0.0291 (10)	0.0234 (5)	0.0030 (4)	−0.0035 (4)	−0.0021 (5)
N1b	0.0163 (5)	0.0160 (3)	0.0201 (4)	−0.0017 (3)	0.0022 (3)	−0.0026 (2)
N2b	0.0204 (5)	0.0247 (4)	0.0161 (3)	−0.0010 (3)	0.0044 (2)	0.0004 (2)
N3b	0.0163 (5)	0.0160 (4)	0.0214 (4)	0.0005 (3)	0.0039 (3)	0.0002 (3)
N4b	0.0131 (3)	0.0214 (5)	0.0230 (5)	−0.0025 (2)	0.0045 (2)	−0.0024 (3)
Ccb	0.0145 (4)	0.0201 (6)	0.0179 (4)	−0.0001 (3)	0.0012 (3)	−0.0011 (3)
Hcbb	0.0136 (3)	0.0259 (11)	0.0251 (8)	−0.0012 (4)	0.0005 (4)	−0.0035 (6)
Hcab	0.0212 (8)	0.0282 (10)	0.0170 (4)	0.0027 (6)	0.0004 (4)	0.0002 (4)
Cdb	0.0158 (5)	0.0210 (4)	0.0203 (5)	0.0015 (3)	0.0041 (3)	−0.0033 (3)
Hdab	0.0208 (9)	0.0310 (6)	0.0213 (6)	0.0023 (5)	0.0078 (6)	−0.0046 (5)
Hdbb	0.0194 (7)	0.0233 (5)	0.0276 (8)	0.0055 (5)	0.0027 (5)	−0.0050 (5)
Ceb	0.0218 (5)	0.0186 (3)	0.0231 (4)	−0.0035 (3)	0.0054 (3)	0.0036 (3)
Heab	0.0316 (9)	0.0198 (5)	0.0301 (6)	−0.0009 (4)	0.0047 (5)	0.0078 (4)
Hebb	0.0252 (6)	0.0249 (6)	0.0315 (7)	−0.0081 (5)	0.0100 (5)	0.0046 (5)
Cfb	0.0172 (5)	0.0226 (4)	0.0206 (5)	−0.0002 (3)	0.0060 (3)	−0.0045 (3)
Hfab	0.0184 (5)	0.0313 (7)	0.0257 (9)	0.0001 (5)	0.0097 (5)	−0.0049 (5)
Hfbb	0.0233 (10)	0.0268 (4)	0.0267 (8)	0.0009 (4)	0.0059 (6)	−0.0107 (4)
Cgb	0.0191 (6)	0.0175 (4)	0.0266 (4)	−0.0039 (3)	0.0072 (3)	0.0015 (3)
Hgab	0.0245 (10)	0.0178 (4)	0.0393 (9)	−0.0072 (5)	0.0082 (6)	−0.0018 (4)
Hgbb	0.0273 (10)	0.0249 (7)	0.0299 (5)	−0.0037 (6)	0.0116 (5)	0.0075 (4)
Chb	0.0166 (4)	0.0248 (6)	0.0192 (4)	−0.0001 (3)	−0.0004 (3)	−0.0033 (3)
Hhbb	0.0197 (6)	0.0318 (8)	0.0246 (6)	−0.0020 (5)	−0.0019 (4)	−0.0096 (5)
Hhab	0.0211 (5)	0.0311 (10)	0.0223 (5)	0.0044 (4)	−0.0034 (4)	−0.0010 (5)

(153K)

Crystal data

C17H32N4O4	F(000) = 1552
Mr = 356.5	Dx = 1.257 (1) Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71069 Å
a = 5.9008 (3) Å	Cell parameters from 39616 reflections
b = 27.8378 (19) Å	θ = 1.9–24.7°
c = 23.5300 (12) Å	µ = 0.09 mm^−1
β = 103.046 (6)°	T = 153 K
V = 3765.4 (4) Å^3	Platelets, transparent
Z = 8	0.30 × 0.23 × 0.20 mm

Data collection

Stoe-IPDS diffractometer	5358 reflections with I > 2σ(I)
Radiation source: Sealed tube	Rint = 0.077
Graphite monochromator	θmax = 24.7°, θmin = 1.9°
Oscillation scans	h = −6→6
39616 measured reflections	k = −32→32
6869 independent reflections	l = −27→27

Refinement

Refinement on F^2	H atoms treated by a mixture of independent and constrained refinement
R[F^2 > 2σ(F^2)] = 0.036	Weighting scheme based on measured s.u.'s w = 1/(σ^2(I) + 0.0016I^2)
wR(F^2) = 0.085	(Δ/σ)max = 0.003
S = 1.17	Δρmax = 0.32 e Å^−3
6869 reflections	Δρmin = −0.26 e Å^−3
583 parameters

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

	x	y	z	Uiso*/Ueq
O1a	1.9959 (4)	0.35413 (8)	1.07256 (9)	0.0301 (3)
Ho1a	2.031 (3)	0.3261 (7)	1.0992 (7)	0.042296 (2)*
O2a	1.6376 (4)	0.32496 (8)	1.05282 (9)	0.0388 (4)
O3a	0.2568 (4)	0.63333 (8)	0.65740 (10)	0.0362 (4)
Ho3a	0.146 (3)	0.6569 (7)	0.6485 (8)	0.051654 (3)*
O4a	0.2737 (5)	0.65687 (10)	0.74719 (10)	0.0570 (5)
C1a	1.7761 (3)	0.35492 (4)	1.04496 (5)	0.0211 (5)
C2a	1.7171 (2)	0.39497 (5)	1.00133 (6)	0.0248 (4)
H2aa	1.7444 (19)	0.3827 (4)	0.9647 (5)	0.036175 (3)*
H2ab	1.825 (2)	0.4213 (4)	1.0140 (5)	0.036175 (3)*
C3a	1.4685 (2)	0.41270 (5)	0.99048 (6)	0.0252 (4)
H3ab	1.4413 (19)	0.4275 (4)	1.0269 (5)	0.036753 (3)*
H3aa	1.359 (2)	0.3855 (4)	0.9804 (5)	0.036753 (3)*
C4a	1.4147 (2)	0.44924 (5)	0.94104 (6)	0.0256 (4)
H4ab	1.530 (2)	0.4755 (4)	0.9502 (5)	0.037338 (3)*
H4aa	1.4333 (19)	0.4333 (4)	0.9053 (5)	0.037338 (3)*
C5a	1.1733 (2)	0.47074 (5)	0.92997 (5)	0.0246 (4)
H5ab	1.1555 (19)	0.4876 (4)	0.9652 (5)	0.035710 (3)*
H5aa	1.055 (2)	0.4440 (4)	0.9218 (5)	0.035710 (3)*
C6a	1.1251 (2)	0.50499 (5)	0.87832 (6)	0.0261 (5)
H6ab	1.244 (2)	0.5305 (4)	0.8860 (5)	0.037886 (3)*
H6aa	1.1430 (19)	0.4877 (4)	0.8442 (5)	0.037886 (3)*
C7a	0.8848 (2)	0.52761 (5)	0.86446 (5)	0.0252 (4)
H7ab	0.8710 (19)	0.5494 (4)	0.8954 (5)	0.036374 (3)*
H7aa	0.766 (2)	0.5023 (4)	0.8622 (5)	0.036374 (3)*
C8a	0.8373 (2)	0.55529 (5)	0.80706 (6)	0.0269 (5)
H8ab	0.962 (2)	0.5793 (4)	0.8091 (5)	0.039163 (3)*
H8aa	0.8441 (19)	0.5330 (4)	0.7748 (5)	0.039163 (3)*
C9a	0.6038 (2)	0.58077 (5)	0.79178 (6)	0.0257 (4)
H9ab	0.480 (2)	0.5583 (4)	0.7964 (5)	0.037509 (3)*
H9aa	0.6048 (19)	0.6074 (4)	0.8191 (5)	0.037509 (3)*
Caa	0.5528 (2)	0.59968 (5)	0.72955 (5)	0.0246 (4)
Haab	0.689 (2)	0.6175 (4)	0.7237 (4)	0.035808 (3)*
Haaa	0.5294 (19)	0.5733 (4)	0.7024 (5)	0.035808 (3)*
Cba	0.3466 (2)	0.63278 (4)	0.71322 (6)	0.0235 (5)
O1b	2.0021 (4)	0.36740 (8)	0.83511 (9)	0.0311 (4)
Ho1b	2.026 (3)	0.3437 (7)	0.8638 (7)	0.046296 (2)*
O2b	1.6391 (4)	0.35985 (8)	0.84502 (10)	0.0428 (4)
O3b	0.2583 (4)	0.62037 (8)	0.38679 (9)	0.0312 (3)
Ho3b	0.132 (3)	0.6418 (7)	0.3743 (7)	0.046717 (2)*
O4b	0.1710 (4)	0.62361 (8)	0.47316 (10)	0.0428 (4)
C1b	1.7774 (3)	0.37743 (4)	0.82089 (5)	0.0200 (4)
C2b	1.7166 (2)	0.41161 (4)	0.77012 (5)	0.0238 (4)
H2ba	1.7344 (19)	0.3938 (4)	0.7359 (5)	0.035699 (3)*
H2bb	1.832 (2)	0.4372 (4)	0.7759 (5)	0.035699 (3)*
C3b	1.4733 (2)	0.43253 (5)	0.75911 (5)	0.0227 (4)
H3bb	1.4636 (18)	0.4552 (4)	0.7906 (5)	0.033700 (3)*
H3ba	1.359 (2)	0.4064 (4)	0.7598 (4)	0.033700 (3)*
C4b	1.4093 (2)	0.45873 (5)	0.70067 (5)	0.0238 (4)
H4bb	1.527 (2)	0.4839 (4)	0.7001 (5)	0.035692 (3)*
H4ba	1.4178 (19)	0.4358 (4)	0.6688 (5)	0.035692 (3)*
C5b	1.1700 (2)	0.48186 (5)	0.68691 (5)	0.0263 (4)
H5bb	1.1660 (19)	0.5077 (4)	0.7157 (5)	0.039196 (3)*
H5ba	1.051 (2)	0.4573 (4)	0.6910 (5)	0.039196 (3)*
C6b	1.1047 (2)	0.50289 (5)	0.62566 (5)	0.0255 (4)
H6bb	1.225 (2)	0.5257 (4)	0.6208 (5)	0.037970 (3)*
H6ba	1.1042 (19)	0.4770 (4)	0.5978 (5)	0.037970 (3)*
C7b	0.8708 (2)	0.52797 (5)	0.61035 (5)	0.0259 (4)
H7bb	0.8737 (19)	0.5560 (4)	0.6364 (5)	0.038197 (3)*
H7ba	0.750 (2)	0.5061 (4)	0.6173 (5)	0.038197 (3)*
C8b	0.8064 (2)	0.54453 (5)	0.54701 (6)	0.0252 (4)
H8bb	0.925 (2)	0.5674 (4)	0.5408 (4)	0.037323 (3)*
H8ba	0.8120 (19)	0.5169 (4)	0.5219 (5)	0.037323 (3)*
C9b	0.5680 (2)	0.56743 (5)	0.52798 (5)	0.0238 (4)
H9bb	0.447 (2)	0.5442 (4)	0.5343 (4)	0.034977 (3)*
H9ba	0.5612 (19)	0.5959 (4)	0.5525 (5)	0.034977 (3)*
Cab	0.5165 (2)	0.58240 (5)	0.46420 (5)	0.0240 (4)
Habb	0.643 (2)	0.6016 (4)	0.4575 (4)	0.035900 (3)*
Haba	0.5076 (19)	0.5535 (4)	0.4396 (5)	0.035900 (3)*
Cbb	0.2965 (2)	0.61044 (4)	0.44288 (6)	0.0212 (4)
N1a	−0.11478 (15)	0.78752 (3)	0.59840 (3)	0.0201 (3)
N2a	−0.1934 (3)	0.73160 (5)	0.51603 (6)	0.0210 (3)
N3a	−0.0525 (3)	0.70126 (4)	0.61522 (6)	0.0209 (3)
N4a	−0.4466 (2)	0.73293 (5)	0.58526 (6)	0.0219 (3)
Cca	0.0309 (3)	0.75028 (5)	0.63394 (6)	0.0215 (3)
Hcba	0.1915 (17)	0.7535 (3)	0.6295 (4)	0.0286 (5)
Hcaa	0.0251 (15)	0.7544 (3)	0.6754 (4)	0.0272 (5)
Cda	−0.3568 (3)	0.78109 (5)	0.60398 (6)	0.0217 (3)
Hdaa	−0.3609 (15)	0.7859 (3)	0.6448 (4)	0.0270 (5)
Hdba	−0.4539 (15)	0.8054 (3)	0.5795 (4)	0.0286 (5)
Cea	−0.1081 (3)	0.77965 (5)	0.53652 (6)	0.0226 (3)
Heaa	−0.2114 (16)	0.8042 (3)	0.5125 (4)	0.0297 (5)
Heba	0.0501 (18)	0.7831 (3)	0.5328 (4)	0.0294 (4)
Cfa	−0.0483 (3)	0.69576 (5)	0.55270 (6)	0.0221 (3)
Hfaa	0.1120 (17)	0.6999 (3)	0.5491 (3)	0.0284 (5)
Hfba	−0.1077 (15)	0.6633 (3)	0.5397 (3)	0.0285 (5)
Cga	−0.2954 (3)	0.69730 (5)	0.62099 (6)	0.0230 (3)
Hgaa	−0.3556 (15)	0.6647 (3)	0.6082 (4)	0.0308 (5)
Hgba	−0.2982 (15)	0.7020 (3)	0.6624 (4)	0.0292 (5)
Cha	−0.4320 (3)	0.72644 (5)	0.52403 (6)	0.0233 (3)
Hhba	−0.4898 (15)	0.6939 (3)	0.5107 (4)	0.0304 (4)
Hhaa	−0.5305 (16)	0.7506 (3)	0.5000 (4)	0.0305 (5)
N1b	−0.11935 (15)	0.77516 (3)	0.36205 (3)	0.0200 (3)
N2b	−0.1959 (3)	0.74013 (5)	0.26418 (5)	0.0231 (3)
N3b	−0.0613 (3)	0.68905 (4)	0.34966 (6)	0.0203 (3)
N4b	−0.4537 (2)	0.72223 (5)	0.32956 (6)	0.0217 (3)
Ccb	0.0233 (3)	0.73259 (5)	0.38436 (6)	0.0203 (3)
Hcbb	0.1848 (17)	0.7385 (3)	0.3820 (4)	0.0256 (5)
Hcab	0.0153 (15)	0.7266 (3)	0.4254 (4)	0.0265 (5)
Cdb	−0.3627 (3)	0.76502 (5)	0.36401 (6)	0.0216 (3)
Hdab	−0.3689 (15)	0.7599 (3)	0.4047 (4)	0.0276 (5)
Hdbb	−0.4577 (15)	0.7930 (3)	0.3482 (4)	0.0280 (5)
Ceb	−0.1095 (3)	0.78232 (5)	0.30026 (6)	0.0241 (3)
Heab	−0.2108 (16)	0.8104 (3)	0.2850 (4)	0.0322 (5)
Hebb	0.0496 (18)	0.7883 (3)	0.2987 (4)	0.0308 (4)
Cfb	−0.0538 (3)	0.69863 (5)	0.28803 (6)	0.0226 (3)
Hfab	0.1073 (17)	0.7052 (3)	0.2868 (3)	0.0280 (5)
Hfbb	−0.1140 (15)	0.6699 (3)	0.2645 (3)	0.0297 (5)
Cgb	−0.3055 (3)	0.68123 (5)	0.35262 (6)	0.0237 (3)
Hgab	−0.3665 (15)	0.6523 (3)	0.3291 (4)	0.0318 (5)
Hgbb	−0.3105 (15)	0.6759 (3)	0.3938 (4)	0.0309 (5)
Chb	−0.4358 (3)	0.73067 (5)	0.26889 (6)	0.0240 (3)
Hhbb	−0.4944 (15)	0.7019 (3)	0.2450 (4)	0.0313 (5)
Hhab	−0.5323 (16)	0.7585 (3)	0.2535 (4)	0.0309 (5)

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
O1a	0.0244 (6)	0.0215 (5)	0.0395 (5)	0.0003 (4)	−0.0031 (4)	0.0111 (4)
O2a	0.0275 (6)	0.0300 (5)	0.0536 (6)	−0.0060 (4)	−0.0022 (4)	0.0193 (5)
O3a	0.0433 (7)	0.0342 (6)	0.0268 (5)	0.0214 (5)	−0.0012 (4)	0.0027 (4)
O4a	0.0663 (10)	0.0676 (8)	0.0335 (6)	0.0479 (7)	0.0036 (5)	−0.0065 (6)
C1a	0.0221 (9)	0.0168 (6)	0.0232 (6)	0.0018 (6)	0.0028 (6)	−0.0011 (5)
C2a	0.0261 (8)	0.0205 (6)	0.0264 (7)	0.0012 (5)	0.0030 (5)	0.0053 (5)
C3a	0.0252 (8)	0.0200 (6)	0.0291 (7)	0.0036 (5)	0.0035 (5)	0.0055 (5)
C4a	0.0262 (8)	0.0219 (7)	0.0273 (7)	0.0037 (5)	0.0034 (5)	0.0039 (5)
C5a	0.0247 (8)	0.0209 (6)	0.0265 (7)	0.0033 (5)	0.0022 (5)	0.0025 (5)
C6a	0.0243 (9)	0.0260 (7)	0.0262 (7)	0.0038 (6)	0.0020 (5)	0.0042 (5)
C7a	0.0249 (8)	0.0227 (6)	0.0259 (7)	0.0034 (5)	0.0014 (5)	0.0027 (5)
C8a	0.0245 (9)	0.0267 (7)	0.0280 (7)	0.0058 (6)	0.0023 (5)	0.0045 (5)
C9a	0.0254 (8)	0.0232 (7)	0.0272 (7)	0.0047 (5)	0.0031 (5)	0.0018 (5)
Caa	0.0260 (8)	0.0195 (6)	0.0268 (7)	0.0059 (5)	0.0031 (5)	−0.0003 (5)
Cba	0.0255 (8)	0.0181 (6)	0.0252 (8)	0.0023 (5)	0.0023 (6)	0.0015 (5)
O1b	0.0272 (7)	0.0280 (5)	0.0384 (5)	0.0058 (4)	0.0076 (4)	0.0139 (4)
O2b	0.0294 (7)	0.0492 (6)	0.0525 (6)	0.0030 (5)	0.0149 (5)	0.0293 (5)
O3b	0.0329 (6)	0.0353 (5)	0.0261 (5)	0.0164 (4)	0.0085 (4)	0.0073 (4)
O4b	0.0411 (7)	0.0574 (7)	0.0333 (5)	0.0238 (5)	0.0156 (5)	0.0052 (5)
C1b	0.0229 (9)	0.0141 (6)	0.0226 (6)	−0.0004 (6)	0.0042 (6)	−0.0013 (5)
C2b	0.0276 (8)	0.0204 (6)	0.0242 (6)	0.0006 (5)	0.0072 (5)	0.0032 (5)
C3b	0.0246 (8)	0.0209 (6)	0.0226 (6)	0.0000 (5)	0.0051 (5)	0.0015 (5)
C4b	0.0268 (8)	0.0207 (6)	0.0246 (6)	0.0032 (5)	0.0071 (5)	0.0030 (5)
C5b	0.0248 (8)	0.0291 (7)	0.0253 (7)	0.0027 (6)	0.0060 (5)	0.0043 (5)
C6b	0.0249 (8)	0.0277 (7)	0.0241 (7)	0.0031 (5)	0.0057 (5)	0.0031 (5)
C7b	0.0250 (8)	0.0267 (7)	0.0255 (7)	0.0005 (5)	0.0046 (5)	0.0016 (5)
C8b	0.0247 (8)	0.0250 (7)	0.0257 (7)	0.0011 (5)	0.0055 (5)	0.0027 (5)
C9b	0.0253 (8)	0.0211 (6)	0.0243 (6)	−0.0001 (5)	0.0041 (5)	−0.0001 (5)
Cab	0.0246 (8)	0.0232 (6)	0.0247 (6)	0.0036 (5)	0.0069 (5)	0.0021 (5)
Cbb	0.0243 (8)	0.0165 (6)	0.0234 (7)	−0.0017 (5)	0.0066 (6)	−0.0017 (5)
N1a	0.0197 (5)	0.0176 (3)	0.0229 (5)	−0.0023 (3)	0.0043 (3)	−0.0026 (2)
N2a	0.0226 (5)	0.0236 (5)	0.0168 (3)	0.0014 (3)	0.0043 (2)	−0.0015 (2)
N3a	0.0214 (5)	0.0202 (4)	0.0201 (4)	0.0040 (3)	0.0027 (3)	0.0012 (3)
N4a	0.0150 (3)	0.0249 (5)	0.0263 (5)	−0.0022 (2)	0.0057 (3)	−0.0032 (3)
Cca	0.0168 (4)	0.0256 (7)	0.0203 (4)	−0.0005 (3)	0.0001 (3)	−0.0029 (3)
Hcba	0.0152 (3)	0.0371 (12)	0.0306 (8)	−0.0018 (4)	−0.0005 (4)	−0.0045 (6)
Hcaa	0.0263 (8)	0.0330 (12)	0.0191 (3)	−0.0002 (6)	−0.0015 (4)	−0.0046 (4)
Cda	0.0191 (5)	0.0213 (4)	0.0252 (5)	0.0031 (3)	0.0061 (3)	−0.0037 (3)
Hdaa	0.0270 (9)	0.0283 (6)	0.0282 (7)	0.0032 (5)	0.0113 (6)	−0.0075 (5)
Hdba	0.0252 (8)	0.0251 (5)	0.0348 (10)	0.0096 (5)	0.0054 (5)	−0.0024 (4)
Cea	0.0246 (5)	0.0218 (4)	0.0226 (5)	−0.0016 (3)	0.0076 (3)	0.0027 (3)
Heaa	0.0380 (10)	0.0241 (5)	0.0271 (7)	0.0017 (5)	0.0076 (5)	0.0077 (5)
Heba	0.0288 (7)	0.0314 (7)	0.0317 (8)	−0.0064 (5)	0.0144 (6)	0.0028 (5)
Cfa	0.0224 (5)	0.0219 (4)	0.0225 (6)	0.0048 (3)	0.0061 (4)	−0.0030 (3)
Hfaa	0.0231 (6)	0.0335 (8)	0.0306 (10)	0.0083 (5)	0.0103 (5)	−0.0036 (5)
Hfba	0.0351 (11)	0.0213 (4)	0.0292 (9)	0.0053 (4)	0.0077 (7)	−0.0064 (4)
Cga	0.0259 (6)	0.0208 (4)	0.0239 (5)	−0.0035 (3)	0.0088 (4)	0.0010 (3)
Hgaa	0.0375 (11)	0.0216 (4)	0.0353 (10)	−0.0086 (5)	0.0124 (7)	0.0009 (4)
Hgba	0.0365 (10)	0.0296 (8)	0.0249 (5)	−0.0037 (6)	0.0139 (6)	0.0034 (5)
Cha	0.0183 (4)	0.0266 (6)	0.0224 (4)	−0.0008 (3)	−0.0012 (3)	−0.0041 (3)
Hhba	0.0254 (7)	0.0320 (9)	0.0299 (7)	−0.0066 (6)	−0.0018 (4)	−0.0097 (6)
Hhaa	0.0225 (5)	0.0368 (11)	0.0266 (5)	0.0044 (5)	−0.0059 (4)	−0.0022 (5)
N1b	0.0182 (5)	0.0188 (3)	0.0222 (5)	−0.0023 (3)	0.0025 (3)	−0.0035 (3)
N2b	0.0228 (5)	0.0297 (5)	0.0168 (3)	−0.0008 (3)	0.0047 (2)	0.0006 (2)
N3b	0.0185 (5)	0.0189 (4)	0.0231 (4)	0.0009 (3)	0.0040 (3)	0.0001 (3)
N4b	0.0141 (3)	0.0258 (5)	0.0254 (5)	−0.0032 (2)	0.0049 (3)	−0.0031 (3)
Ccb	0.0160 (4)	0.0243 (7)	0.0190 (4)	−0.0002 (3)	0.0007 (3)	−0.0017 (3)
Hcbb	0.0147 (4)	0.0320 (12)	0.0278 (8)	−0.0015 (4)	−0.0003 (4)	−0.0045 (7)
Hcab	0.0247 (8)	0.0347 (11)	0.0178 (4)	0.0030 (6)	−0.0003 (4)	−0.0001 (5)
Cdb	0.0176 (5)	0.0248 (4)	0.0226 (5)	0.0017 (3)	0.0050 (3)	−0.0043 (3)
Hdab	0.0241 (9)	0.0369 (7)	0.0237 (7)	0.0024 (5)	0.0097 (6)	−0.0061 (5)
Hdbb	0.0225 (8)	0.0279 (6)	0.0325 (9)	0.0070 (5)	0.0039 (5)	−0.0059 (5)
Ceb	0.0246 (6)	0.0220 (4)	0.0259 (4)	−0.0039 (3)	0.0064 (3)	0.0044 (3)
Heab	0.0369 (10)	0.0235 (5)	0.0352 (7)	−0.0005 (5)	0.0062 (5)	0.0098 (5)
Hebb	0.0286 (7)	0.0297 (7)	0.0363 (8)	−0.0096 (5)	0.0120 (6)	0.0054 (5)
Cfb	0.0195 (5)	0.0269 (4)	0.0222 (5)	0.0002 (3)	0.0066 (4)	−0.0056 (3)
Hfab	0.0207 (6)	0.0374 (8)	0.0286 (9)	0.0009 (5)	0.0111 (5)	−0.0059 (6)
Hfbb	0.0277 (11)	0.0320 (4)	0.0297 (9)	0.0013 (4)	0.0068 (7)	−0.0133 (5)
Cgb	0.0221 (6)	0.0206 (4)	0.0294 (5)	−0.0051 (3)	0.0082 (4)	0.0014 (3)
Hgab	0.0295 (10)	0.0213 (5)	0.0452 (10)	−0.0095 (5)	0.0096 (7)	−0.0027 (5)
Hgbb	0.0324 (11)	0.0297 (8)	0.0335 (5)	−0.0050 (6)	0.0138 (6)	0.0087 (5)
Chb	0.0182 (4)	0.0306 (6)	0.0207 (4)	−0.0001 (3)	−0.0012 (3)	−0.0040 (3)
Hhbb	0.0225 (7)	0.0398 (9)	0.0274 (7)	−0.0029 (6)	−0.0033 (4)	−0.0119 (6)
Hhab	0.0236 (5)	0.0391 (11)	0.0250 (6)	0.0057 (5)	−0.0047 (4)	−0.0004 (5)

(183K)

Crystal data

C17H32N4O4	F(000) = 1552
Mr = 356.5	Dx = 1.250 (1) Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71069 Å
a = 5.9060 (3) Å	Cell parameters from 33115 reflections
b = 27.9400 (19) Å	θ = 1.9–24.7°
c = 23.5635 (11) Å	µ = 0.09 mm^−1
β = 103.114 (5)°	T = 183 K
V = 3786.9 (4) Å^3	Platelets, transparent
Z = 8	0.30 × 0.23 × 0.20 mm

Data collection

Stoe-IPDS diffractometer	5258 reflections with I > 2σ(I)
Radiation source: Sealed tube	Rint = 0.056
Graphite monochromator	θmax = 24.7°, θmin = 1.9°
Oscillation scans	h = −6→6
33115 measured reflections	k = −32→32
6924 independent reflections	l = −27→27

Refinement

Refinement on F^2	H atoms treated by a mixture of independent and constrained refinement
R[F^2 > 2σ(F^2)] = 0.036	Weighting scheme based on measured s.u.'s w = 1/(σ^2(I) + 0.0016I^2)
wR(F^2) = 0.086	(Δ/σ)max = 0.005
S = 1.16	Δρmax = 0.29 e Å^−3
6924 reflections	Δρmin = −0.24 e Å^−3
439 parameters

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

	x	y	z	Uiso*/Ueq
O1a	1.9918	0.3544	1.0721	0.0370 (4)
Ho1a	2.024 (3)	0.3278 (7)	1.0994 (7)	0.052020 (2)*
O2a	1.6340 (4)	0.32574 (8)	1.05279 (10)	0.0483 (4)
O3a	0.2589 (4)	0.63359 (8)	0.65745 (10)	0.0443 (4)
Ho3a	0.147 (4)	0.6558 (7)	0.6482 (8)	0.063381 (3)*
O4a	0.2730 (5)	0.65594 (10)	0.74657 (10)	0.0714 (6)
C1a	1.7725 (3)	0.35524 (5)	1.04472 (5)	0.0259 (5)
C2a	1.7144 (2)	0.39518 (5)	1.00119 (5)	0.0304 (5)
H2aa	1.7422	0.383	0.9645	0.044229 (3)*
H2ab	1.8237	0.4213	1.0138	0.044229 (3)*
C3a	1.4662 (2)	0.41299 (5)	0.99023 (5)	0.0308 (5)
H3ab	1.4387	0.4276	1.0269	0.044881 (3)*
H3aa	1.3592	0.3861	0.9801	0.044881 (3)*
C4a	1.4126 (2)	0.44926 (5)	0.94066 (5)	0.0314 (5)
H4ab	1.527	0.4748	0.9495	0.045733 (3)*
H4aa	1.431	0.4332	0.9049	0.045733 (3)*
C5a	1.1717 (2)	0.47081 (5)	0.92958 (5)	0.0302 (5)
H5ab	1.153	0.4881	0.9652	0.043930 (3)*
H5aa	1.0535	0.4443	0.9222	0.043930 (3)*
C6a	1.1234 (2)	0.50480 (5)	0.87777 (5)	0.0325 (5)
H6ab	1.2423	0.53	0.8849	0.046982 (3)*
H6aa	1.1412	0.4872	0.843	0.046982 (3)*
C7a	0.8845 (2)	0.52756 (5)	0.86407 (5)	0.0306 (4)
H7ab	0.8705	0.5493	0.8954	0.044316 (3)*
H7aa	0.7664	0.503	0.8618	0.044316 (3)*
C8a	0.8364 (2)	0.55508 (5)	0.80666 (6)	0.0328 (5)
H8ab	0.961	0.5792	0.8085	0.047777 (3)*
H8aa	0.8427	0.5327	0.7746	0.047777 (3)*
C9a	0.6040 (2)	0.58060 (5)	0.79147 (5)	0.0315 (5)
H9ab	0.4798	0.5585	0.7956	0.045865 (3)*
H9aa	0.6052	0.607	0.8185	0.045865 (3)*
Caa	0.5525 (2)	0.59948 (5)	0.72947 (5)	0.0300 (4)
Haab	0.6887	0.6175	0.7238	0.043641 (3)*
Haaa	0.5308	0.5731	0.7024	0.043641 (3)*
Cba	0.3468 (3)	0.63240 (5)	0.71294 (6)	0.0288 (5)
O1b	1.9966 (4)	0.36689 (8)	0.83427 (9)	0.0380 (4)
Ho1b	2.024 (3)	0.3436 (7)	0.8625 (8)	0.056490 (3)*
O2b	1.6353 (4)	0.35956 (9)	0.84386 (10)	0.0529 (4)
O3b	0.2602 (4)	0.62126 (8)	0.38739 (9)	0.0380 (4)
Ho3b	0.131 (3)	0.6429 (7)	0.3749 (7)	0.057032 (3)*
O4b	0.1733 (4)	0.62404 (9)	0.47314 (9)	0.0531 (4)
C1b	1.7733 (3)	0.37714 (4)	0.81998 (5)	0.0250 (5)
C2b	1.7129 (2)	0.41127 (4)	0.76951 (5)	0.0289 (4)
H2ba	1.7312	0.3938	0.7353	0.043187 (3)*
H2bb	1.8293	0.4369	0.776	0.043187 (3)*
C3b	1.4700 (2)	0.43215 (5)	0.75832 (5)	0.0279 (4)
H3bb	1.4609	0.4542	0.7895	0.041489 (3)*
H3ba	1.358	0.4061	0.7589	0.041489 (3)*
C4b	1.4060 (2)	0.45836 (5)	0.70020 (5)	0.0293 (5)
H4bb	1.5221	0.483	0.6997	0.043964 (3)*
H4ba	1.4143	0.4358	0.6686	0.043964 (3)*
C5b	1.1674 (2)	0.48150 (5)	0.68637 (5)	0.0320 (5)
H5bb	1.1646	0.5074	0.7146	0.047503 (3)*
H5ba	1.0478	0.4575	0.6903	0.047503 (3)*
C6b	1.1029 (3)	0.50270 (5)	0.62524 (5)	0.0316 (5)
H6bb	1.2226	0.5251	0.6206	0.047056 (3)*
H6ba	1.1004	0.4768	0.5968	0.047056 (3)*
C7b	0.8697 (2)	0.52791 (5)	0.60993 (5)	0.0315 (5)
H7bb	0.8732	0.5555	0.6365	0.046342 (3)*
H7ba	0.7487	0.5061	0.6166	0.046342 (3)*
C8b	0.8059 (2)	0.54462 (5)	0.54687 (5)	0.0306 (5)
H8bb	0.9238	0.5674	0.5415	0.045351 (3)*
H8ba	0.8113	0.5171	0.5214	0.045351 (3)*
C9b	0.5687 (2)	0.56779 (5)	0.52788 (5)	0.0291 (4)
H9bb	0.4495	0.5448	0.5339	0.042907 (3)*
H9ba	0.5613	0.5958	0.5524	0.042907 (3)*
Cab	0.5173 (2)	0.58290 (5)	0.46441 (5)	0.0293 (4)
Habb	0.6413	0.6018	0.4582	0.043580 (3)*
Haba	0.5085	0.5543	0.44	0.043580 (3)*
Cbb	0.2980 (3)	0.61100 (4)	0.44315 (6)	0.0260 (5)
N1a	−0.11087 (14)	0.78744 (3)	0.59915 (3)	0.0246 (3)
N2a	−0.1896 (2)	0.73228 (5)	0.51642 (5)	0.0258 (3)
N3a	−0.0499 (2)	0.70149 (4)	0.61519 (6)	0.0255 (3)
N4a	−0.4432 (2)	0.73325 (5)	0.58529 (6)	0.0267 (3)
Cca	0.0340 (3)	0.75013 (5)	0.63429 (6)	0.0261 (3)
Hcba	0.19408 (14)	0.75366 (3)	0.62974 (3)	0.0341 (5)
Hcaa	0.03056 (14)	0.75423 (3)	0.67562 (3)	0.0333 (5)
Cda	−0.3525 (3)	0.78106 (5)	0.60453 (6)	0.0265 (3)
Hdaa	−0.35790 (14)	0.78555 (3)	0.64545 (3)	0.0333 (5)
Hdba	−0.45011 (14)	0.80527 (3)	0.58032 (3)	0.0347 (5)
Cea	−0.1034 (3)	0.77994 (5)	0.53735 (6)	0.0275 (3)
Heaa	−0.20525 (14)	0.80413 (3)	0.51272 (3)	0.0363 (5)
Heba	0.05450 (14)	0.78326 (3)	0.53378 (3)	0.0354 (4)
Cfa	−0.0454 (3)	0.69634 (5)	0.55277 (6)	0.0270 (3)
Hfaa	0.11550 (14)	0.70038 (3)	0.54879 (3)	0.0343 (5)
Hfba	−0.10620 (14)	0.66403 (3)	0.53931 (3)	0.0351 (5)
Cga	−0.2928 (3)	0.69756 (5)	0.62071 (6)	0.0284 (3)
Hgaa	−0.35417 (14)	0.66492 (3)	0.60726 (3)	0.0381 (5)
Hgba	−0.29644 (14)	0.70201 (3)	0.66250 (3)	0.0362 (5)
Cha	−0.4280 (3)	0.72718 (5)	0.52421 (6)	0.0285 (3)
Hhba	−0.48639 (14)	0.69461 (3)	0.51017 (3)	0.0373 (5)
Hhaa	−0.52664 (14)	0.75133 (3)	0.50010 (3)	0.0370 (5)
N1b	−0.11573 (14)	0.77565 (3)	0.36223 (3)	0.0243 (3)
N2b	−0.1926 (2)	0.74059 (5)	0.26463 (5)	0.0282 (3)
N3b	−0.0589 (2)	0.68990 (4)	0.35013 (5)	0.0248 (3)
N4b	−0.4504 (2)	0.72310 (5)	0.32986 (6)	0.0268 (3)
Ccb	0.0263 (3)	0.73326 (5)	0.38457 (5)	0.0246 (3)
Hcbb	0.18717 (14)	0.73941 (3)	0.38210 (3)	0.0313 (5)
Hcab	0.02087 (14)	0.72774 (3)	0.42555 (3)	0.0321 (5)
Cdb	−0.3586 (3)	0.76570 (5)	0.36419 (6)	0.0264 (3)
Hdab	−0.36590 (14)	0.76063 (3)	0.40489 (3)	0.0339 (5)
Hdbb	−0.45425 (14)	0.79349 (3)	0.34833 (3)	0.0343 (5)
Ceb	−0.1054 (3)	0.78261 (5)	0.30052 (6)	0.0292 (3)
Heab	−0.20529 (14)	0.81043 (3)	0.28423 (3)	0.0391 (5)
Hebb	0.05329 (14)	0.78830 (3)	0.29891 (3)	0.0375 (4)
Cfb	−0.0513 (3)	0.69924 (5)	0.28858 (6)	0.0279 (3)
Hfab	0.11042 (14)	0.70575 (3)	0.28682 (3)	0.0349 (5)
Hfbb	−0.11286 (14)	0.67056 (3)	0.26494 (3)	0.0371 (5)
Cgb	−0.3028 (3)	0.68227 (5)	0.35301 (6)	0.0291 (3)
Hgab	−0.36496 (14)	0.65327 (3)	0.32927 (3)	0.0395 (5)
Hgbb	−0.30844 (14)	0.67698 (3)	0.39455 (3)	0.0379 (5)
Chb	−0.4323 (3)	0.73136 (5)	0.26934 (6)	0.0295 (3)
Hhbb	−0.49142 (14)	0.70259 (3)	0.24507 (3)	0.0390 (5)
Hhab	−0.52902 (14)	0.75905 (3)	0.25355 (3)	0.0379 (5)

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
O1a	0.0299 (6)	0.0269 (5)	0.0482 (6)	0.0002 (4)	−0.0033 (4)	0.0136 (4)
O2a	0.0331 (7)	0.0378 (6)	0.0674 (7)	−0.0073 (5)	−0.0024 (5)	0.0243 (5)
O3a	0.0524 (8)	0.0428 (6)	0.0329 (5)	0.0264 (5)	−0.0006 (5)	0.0035 (4)
O4a	0.0827 (11)	0.0865 (10)	0.0407 (6)	0.0604 (9)	0.0049 (6)	−0.0061 (6)
C1a	0.0276 (10)	0.0202 (7)	0.0285 (6)	0.0024 (6)	0.0033 (6)	0.0003 (5)
C2a	0.0309 (9)	0.0254 (7)	0.0330 (7)	0.0019 (6)	0.0037 (5)	0.0068 (5)
C3a	0.0306 (9)	0.0248 (7)	0.0353 (7)	0.0046 (5)	0.0040 (6)	0.0071 (5)
C4a	0.0319 (9)	0.0269 (7)	0.0335 (7)	0.0041 (6)	0.0039 (6)	0.0049 (5)
C5a	0.0317 (9)	0.0255 (7)	0.0316 (7)	0.0043 (6)	0.0034 (5)	0.0037 (5)
C6a	0.0310 (9)	0.0312 (7)	0.0327 (7)	0.0055 (6)	0.0020 (5)	0.0054 (6)
C7a	0.0299 (8)	0.0278 (7)	0.0319 (7)	0.0044 (6)	0.0021 (5)	0.0028 (5)
C8a	0.0299 (9)	0.0327 (7)	0.0340 (7)	0.0076 (6)	0.0030 (5)	0.0063 (6)
C9a	0.0307 (9)	0.0277 (7)	0.0342 (7)	0.0067 (6)	0.0038 (5)	0.0033 (5)
Caa	0.0317 (9)	0.0243 (7)	0.0321 (7)	0.0075 (6)	0.0033 (5)	0.0005 (5)
Cba	0.0306 (9)	0.0227 (7)	0.0318 (8)	0.0044 (6)	0.0041 (6)	0.0013 (6)
O1b	0.0327 (7)	0.0345 (5)	0.0470 (6)	0.0076 (4)	0.0092 (4)	0.0179 (4)
O2b	0.0360 (7)	0.0602 (7)	0.0662 (7)	0.0043 (5)	0.0190 (5)	0.0374 (6)
O3b	0.0395 (7)	0.0429 (6)	0.0329 (5)	0.0190 (5)	0.0107 (4)	0.0093 (4)
O4b	0.0528 (8)	0.0713 (8)	0.0394 (6)	0.0308 (6)	0.0191 (5)	0.0073 (5)
C1b	0.0285 (10)	0.0184 (6)	0.0280 (6)	0.0003 (6)	0.0063 (6)	−0.0014 (5)
C2b	0.0322 (9)	0.0251 (7)	0.0300 (6)	0.0019 (5)	0.0083 (5)	0.0051 (5)
C3b	0.0300 (8)	0.0258 (7)	0.0280 (6)	0.0009 (5)	0.0069 (5)	0.0028 (5)
C4b	0.0325 (9)	0.0255 (7)	0.0309 (7)	0.0036 (6)	0.0091 (5)	0.0046 (5)
C5b	0.0307 (9)	0.0348 (7)	0.0305 (7)	0.0030 (6)	0.0067 (5)	0.0045 (6)
C6b	0.0308 (9)	0.0339 (7)	0.0303 (7)	0.0030 (6)	0.0075 (5)	0.0043 (6)
C7b	0.0304 (9)	0.0324 (7)	0.0308 (7)	0.0022 (6)	0.0054 (5)	0.0025 (5)
C8b	0.0295 (9)	0.0304 (7)	0.0318 (7)	0.0021 (6)	0.0065 (5)	0.0036 (5)
C9b	0.0311 (9)	0.0254 (7)	0.0302 (7)	0.0009 (6)	0.0055 (5)	0.0002 (5)
Cab	0.0295 (9)	0.0276 (7)	0.0310 (7)	0.0046 (6)	0.0074 (5)	0.0021 (5)
Cbb	0.0297 (9)	0.0214 (6)	0.0281 (8)	−0.0007 (5)	0.0088 (6)	−0.0025 (5)
N1a	0.0235 (5)	0.0218 (3)	0.0282 (5)	−0.0027 (3)	0.0054 (3)	−0.0034 (3)
N2a	0.0270 (5)	0.0298 (5)	0.0205 (3)	0.0018 (3)	0.0052 (2)	−0.0019 (2)
N3a	0.0257 (5)	0.0249 (4)	0.0249 (4)	0.0046 (3)	0.0039 (3)	0.0018 (3)
N4a	0.0182 (3)	0.0305 (5)	0.0321 (5)	−0.0026 (2)	0.0071 (3)	−0.0036 (3)
Cca	0.0203 (4)	0.0315 (7)	0.0243 (4)	−0.0005 (3)	0.0007 (3)	−0.0034 (3)
Hcba	0.0185 (4)	0.0446 (12)	0.0361 (8)	−0.0021 (4)	−0.0002 (4)	−0.0052 (6)
Hcaa	0.0313 (8)	0.0419 (12)	0.0231 (3)	−0.0001 (6)	−0.0012 (4)	−0.0057 (4)
Cda	0.0230 (5)	0.0264 (4)	0.0309 (5)	0.0036 (3)	0.0077 (4)	−0.0047 (3)
Hdaa	0.0323 (9)	0.0360 (7)	0.0346 (7)	0.0038 (5)	0.0138 (6)	−0.0096 (5)
Hdba	0.0300 (8)	0.0307 (5)	0.0429 (10)	0.0110 (5)	0.0070 (6)	−0.0032 (5)
Cea	0.0290 (6)	0.0271 (4)	0.0278 (5)	−0.0017 (3)	0.0092 (3)	0.0037 (3)
Heaa	0.0446 (10)	0.0306 (5)	0.0339 (7)	0.0022 (5)	0.0095 (5)	0.0103 (5)
Heba	0.0338 (7)	0.0385 (7)	0.0383 (8)	−0.0071 (5)	0.0170 (6)	0.0041 (5)
Cfa	0.0269 (5)	0.0270 (4)	0.0277 (6)	0.0056 (3)	0.0075 (4)	−0.0039 (3)
Hfaa	0.0280 (6)	0.0408 (8)	0.0367 (10)	0.0098 (5)	0.0124 (6)	−0.0046 (6)
Hfba	0.0419 (11)	0.0266 (4)	0.0371 (10)	0.0061 (4)	0.0092 (7)	−0.0086 (4)
Cga	0.0309 (6)	0.0262 (4)	0.0301 (5)	−0.0042 (3)	0.0109 (4)	0.0019 (3)
Hgaa	0.0443 (10)	0.0269 (4)	0.0454 (10)	−0.0102 (5)	0.0151 (7)	0.0019 (4)
Hgba	0.0433 (11)	0.0381 (8)	0.0314 (5)	−0.0041 (6)	0.0171 (6)	0.0054 (5)
Cha	0.0221 (4)	0.0327 (6)	0.0275 (4)	−0.0009 (3)	−0.0012 (3)	−0.0051 (3)
Hhba	0.0305 (7)	0.0396 (9)	0.0373 (7)	−0.0077 (6)	−0.0021 (4)	−0.0124 (6)
Hhaa	0.0269 (5)	0.0453 (11)	0.0323 (5)	0.0053 (5)	−0.0066 (4)	−0.0024 (5)
N1b	0.0218 (5)	0.0231 (3)	0.0269 (5)	−0.0028 (3)	0.0030 (3)	−0.0036 (3)
N2b	0.0274 (5)	0.0367 (5)	0.0206 (3)	−0.0009 (3)	0.0058 (2)	0.0009 (2)
N3b	0.0225 (5)	0.0233 (4)	0.0284 (4)	0.0013 (3)	0.0052 (3)	0.0004 (3)
N4b	0.0167 (3)	0.0322 (5)	0.0317 (5)	−0.0041 (3)	0.0061 (3)	−0.0032 (3)
Ccb	0.0190 (4)	0.0297 (7)	0.0233 (4)	−0.0003 (3)	0.0010 (3)	−0.0014 (4)
Hcbb	0.0174 (4)	0.0396 (12)	0.0341 (8)	−0.0019 (4)	−0.0002 (4)	−0.0043 (7)
Hcab	0.0297 (8)	0.0419 (12)	0.0219 (4)	0.0036 (6)	−0.0003 (4)	0.0003 (5)
Cdb	0.0212 (5)	0.0306 (4)	0.0278 (5)	0.0023 (3)	0.0064 (4)	−0.0045 (3)
Hdab	0.0296 (9)	0.0453 (7)	0.0295 (7)	0.0035 (5)	0.0124 (6)	−0.0065 (5)
Hdbb	0.0273 (8)	0.0348 (6)	0.0398 (9)	0.0090 (5)	0.0052 (6)	−0.0062 (5)
Ceb	0.0291 (6)	0.0275 (4)	0.0314 (5)	−0.0049 (3)	0.0077 (3)	0.0059 (3)
Heab	0.0443 (10)	0.0294 (6)	0.0423 (7)	−0.0009 (5)	0.0074 (5)	0.0125 (5)
Hebb	0.0339 (7)	0.0375 (7)	0.0439 (8)	−0.0117 (5)	0.0144 (6)	0.0075 (5)
Cfb	0.0241 (5)	0.0335 (4)	0.0273 (6)	0.0008 (3)	0.0083 (4)	−0.0064 (3)
Hfab	0.0257 (6)	0.0474 (8)	0.0352 (9)	0.0022 (5)	0.0142 (6)	−0.0063 (6)
Hfbb	0.0354 (11)	0.0396 (4)	0.0365 (9)	0.0022 (5)	0.0085 (7)	−0.0158 (5)
Cgb	0.0269 (6)	0.0255 (4)	0.0364 (5)	−0.0065 (3)	0.0101 (4)	0.0020 (3)
Hgab	0.0367 (11)	0.0265 (5)	0.0557 (10)	−0.0122 (5)	0.0115 (7)	−0.0030 (5)
Hgbb	0.0394 (11)	0.0366 (8)	0.0416 (5)	−0.0064 (6)	0.0172 (6)	0.0110 (5)
Chb	0.0218 (4)	0.0377 (6)