Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S0108270100011471/gd1115sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S0108270100011471/gd11151sup2.hkl |
CCDC reference: 153922
Data collection: XSCANS (Siemens, 1994); cell refinement: XSCANS; data reduction: SHELXTL (Sheldrick, 1999); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL.
C16H25B9S | F(000) = 1456 |
Mr = 346.71 | Dx = 1.139 Mg m−3 |
Monoclinic, P21/n | Mo Kα radiation, λ = 0.71073 Å |
a = 13.039 (2) Å | Cell parameters from 45 reflections |
b = 15.2610 (16) Å | θ = 2.7–16.2° |
c = 21.319 (5) Å | µ = 0.16 mm−1 |
β = 107.581 (14)° | T = 160 K |
V = 4044.2 (13) Å3 | Plate, colourless |
Z = 8 | 0.62 × 0.44 × 0.21 mm |
Bruker P4 diffractometer | 5279 reflections with I > 2σ(I) |
Radiation source: fine-focus sealed tube | Rint = 0.033 |
Graphite monochromator | θmax = 25.0°, θmin = 2.0° |
ω scans | h = −15→1 |
Absorption correction: ψ scan (North et al., 1968) | k = −18→1 |
Tmin = 0.924, Tmax = 0.968 | l = −24→25 |
8786 measured reflections | 3 standard reflections every 97 reflections |
7111 independent reflections | intensity decay: 1.7% |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.050 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.129 | H atoms treated by a mixture of independent and constrained refinement |
S = 1.04 | w = 1/[σ2(Fo2) + (0.0523P)2 + 1.8495P] where P = (Fo2 + 2Fc2)/3 |
7111 reflections | (Δ/σ)max = 0.001 |
523 parameters | Δρmax = 0.40 e Å−3 |
0 restraints | Δρmin = −0.22 e Å−3 |
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes. |
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. |
x | y | z | Uiso*/Ueq | ||
B1 | 0.1960 (2) | 0.7691 (2) | 0.73462 (13) | 0.0318 (7) | |
H1 | 0.193 (2) | 0.7664 (18) | 0.6849 (13) | 0.038* | |
B2 | 0.1626 (2) | 0.6790 (2) | 0.77531 (13) | 0.0290 (6) | |
H2 | 0.140 (2) | 0.6084 (17) | 0.7558 (12) | 0.035* | |
B3 | 0.2976 (2) | 0.71160 (19) | 0.79484 (13) | 0.0258 (6) | |
H3 | 0.359 (2) | 0.6745 (17) | 0.7870 (12) | 0.031* | |
B4 | 0.3002 (2) | 0.82770 (19) | 0.79263 (12) | 0.0260 (6) | |
H4 | 0.370 (2) | 0.8609 (16) | 0.7837 (12) | 0.031* | |
B5 | 0.1665 (2) | 0.86587 (19) | 0.77266 (13) | 0.0288 (6) | |
H5 | 0.143 (2) | 0.9278 (17) | 0.7462 (12) | 0.035* | |
B6 | 0.0785 (2) | 0.7725 (2) | 0.76299 (14) | 0.0315 (6) | |
H6 | 0.002 (2) | 0.7749 (17) | 0.7278 (13) | 0.038* | |
C7 | 0.23959 (18) | 0.68742 (15) | 0.85527 (11) | 0.0231 (5) | |
C8 | 0.31320 (17) | 0.77211 (15) | 0.86639 (10) | 0.0208 (5) | |
B9 | 0.2466 (2) | 0.86275 (17) | 0.85511 (12) | 0.0221 (5) | |
B10 | 0.1069 (2) | 0.83833 (19) | 0.83629 (14) | 0.0283 (6) | |
H10 | 0.039 (2) | 0.8798 (17) | 0.8432 (12) | 0.034* | |
H10A | 0.133 (2) | 0.7874 (17) | 0.8803 (12) | 0.034* | |
B11 | 0.1122 (2) | 0.71647 (18) | 0.84050 (14) | 0.0270 (6) | |
H11 | 0.054 (2) | 0.6723 (17) | 0.8531 (12) | 0.032* | |
C71 | 0.27981 (18) | 0.60779 (15) | 0.89740 (11) | 0.0255 (5) | |
C72 | 0.3449 (2) | 0.54365 (17) | 0.88264 (14) | 0.0386 (6) | |
H72 | 0.3659 | 0.5487 | 0.8438 | 0.046* | |
C73 | 0.3796 (3) | 0.4722 (2) | 0.92428 (17) | 0.0526 (8) | |
H73 | 0.4235 | 0.4287 | 0.9134 | 0.063* | |
C74 | 0.3507 (3) | 0.46385 (19) | 0.98121 (16) | 0.0516 (8) | |
H74 | 0.3761 | 0.4158 | 1.0101 | 0.062* | |
C75 | 0.2850 (3) | 0.52577 (19) | 0.99558 (15) | 0.0486 (8) | |
H75 | 0.2637 | 0.5200 | 1.0342 | 0.058* | |
C76 | 0.2494 (2) | 0.59690 (17) | 0.95394 (13) | 0.0376 (6) | |
H76 | 0.2033 | 0.6389 | 0.9644 | 0.045* | |
C81 | 0.42039 (17) | 0.76773 (14) | 0.91903 (10) | 0.0207 (5) | |
C82 | 0.51804 (18) | 0.76491 (15) | 0.90531 (11) | 0.0244 (5) | |
H82 | 0.5187 | 0.7634 | 0.8609 | 0.029* | |
C83 | 0.61417 (19) | 0.76434 (16) | 0.95575 (12) | 0.0278 (5) | |
H83 | 0.6803 | 0.7632 | 0.9457 | 0.033* | |
C84 | 0.61464 (19) | 0.76538 (16) | 1.02119 (12) | 0.0285 (5) | |
H84 | 0.6808 | 0.7647 | 1.0557 | 0.034* | |
C85 | 0.51844 (19) | 0.76740 (16) | 1.03548 (11) | 0.0293 (5) | |
H85 | 0.5180 | 0.7676 | 1.0800 | 0.035* | |
C86 | 0.42238 (18) | 0.76916 (16) | 0.98492 (11) | 0.0256 (5) | |
H86 | 0.3565 | 0.7714 | 0.9952 | 0.031* | |
S9 | 0.32030 (5) | 0.96186 (4) | 0.89993 (3) | 0.02614 (15) | |
C91 | 0.2739 (2) | 0.97444 (18) | 0.97062 (12) | 0.0392 (7) | |
H91A | 0.1951 | 0.9733 | 0.9568 | 0.059* | |
H91B | 0.2994 | 1.0305 | 0.9921 | 0.059* | |
H91C | 0.3020 | 0.9264 | 1.0016 | 0.059* | |
C92 | 0.2516 (2) | 1.05178 (17) | 0.85092 (13) | 0.0398 (7) | |
H92A | 0.2795 | 1.1071 | 0.8729 | 0.060* | |
H92B | 0.1744 | 1.0475 | 0.8454 | 0.060* | |
H92C | 0.2634 | 1.0499 | 0.8077 | 0.060* | |
B1' | 1.0888 (2) | 0.1781 (2) | 0.96183 (13) | 0.0293 (6) | |
H1' | 1.167 (2) | 0.1524 (17) | 0.9866 (12) | 0.035* | |
B2' | 0.9717 (2) | 0.13579 (18) | 0.97508 (13) | 0.0252 (6) | |
H2' | 0.9621 (19) | 0.0799 (17) | 1.0058 (12) | 0.030* | |
B3' | 0.9934 (2) | 0.11880 (18) | 0.89842 (13) | 0.0228 (5) | |
H3' | 1.0054 (19) | 0.0554 (16) | 0.8793 (11) | 0.027* | |
B4' | 1.0545 (2) | 0.21456 (18) | 0.87886 (13) | 0.0250 (6) | |
H4' | 1.1045 (19) | 0.2096 (16) | 0.8455 (12) | 0.030* | |
B5' | 1.0682 (2) | 0.29142 (19) | 0.94310 (14) | 0.0278 (6) | |
H5' | 1.130 (2) | 0.3424 (17) | 0.9545 (12) | 0.033* | |
B6' | 1.0124 (2) | 0.2436 (2) | 1.00294 (13) | 0.0303 (6) | |
H6' | 1.045 (2) | 0.2588 (17) | 1.0562 (13) | 0.036* | |
C7' | 0.87104 (17) | 0.15389 (14) | 0.90319 (10) | 0.0196 (5) | |
C8' | 0.91539 (16) | 0.20096 (14) | 0.85037 (10) | 0.0197 (5) | |
B9' | 0.9596 (2) | 0.29901 (17) | 0.87127 (13) | 0.0239 (6) | |
B10' | 0.9384 (2) | 0.32562 (19) | 0.94759 (13) | 0.0269 (6) | |
H10' | 0.930 (2) | 0.3909 (17) | 0.9669 (12) | 0.032* | |
H10B | 0.854 (2) | 0.2934 (17) | 0.9279 (12) | 0.032* | |
B11' | 0.8736 (2) | 0.22261 (18) | 0.96343 (12) | 0.0238 (6) | |
H11' | 0.8173 (19) | 0.2170 (16) | 0.9890 (12) | 0.029* | |
C71' | 0.77791 (17) | 0.09091 (15) | 0.88172 (10) | 0.0203 (5) | |
C72' | 0.7913 (2) | 0.00017 (16) | 0.88165 (11) | 0.0271 (5) | |
H72' | 0.8616 | −0.0240 | 0.8919 | 0.033* | |
C73' | 0.7026 (2) | −0.05501 (17) | 0.86666 (12) | 0.0344 (6) | |
H73' | 0.7126 | −0.1167 | 0.8667 | 0.041* | |
C74' | 0.5997 (2) | −0.02109 (18) | 0.85165 (12) | 0.0351 (6) | |
H74' | 0.5393 | −0.0591 | 0.8421 | 0.042* | |
C75' | 0.58554 (19) | 0.06914 (18) | 0.85073 (12) | 0.0328 (6) | |
H75' | 0.5150 | 0.0930 | 0.8396 | 0.039* | |
C76' | 0.67346 (18) | 0.12424 (17) | 0.86584 (11) | 0.0269 (5) | |
H76' | 0.6628 | 0.1858 | 0.8654 | 0.032* | |
C81' | 0.86011 (18) | 0.17961 (15) | 0.77901 (11) | 0.0238 (5) | |
C82' | 0.9045 (2) | 0.12516 (17) | 0.74228 (12) | 0.0327 (6) | |
H82' | 0.9720 | 0.0980 | 0.7623 | 0.039* | |
C83' | 0.8505 (2) | 0.1099 (2) | 0.67584 (13) | 0.0436 (7) | |
H83' | 0.8813 | 0.0725 | 0.6509 | 0.052* | |
C84' | 0.7524 (2) | 0.1492 (2) | 0.64643 (13) | 0.0438 (7) | |
H84' | 0.7159 | 0.1388 | 0.6012 | 0.053* | |
C85' | 0.7073 (2) | 0.2035 (2) | 0.68253 (12) | 0.0411 (7) | |
H85' | 0.6395 | 0.2302 | 0.6624 | 0.049* | |
C86' | 0.7609 (2) | 0.21891 (18) | 0.74839 (12) | 0.0317 (6) | |
H86' | 0.7298 | 0.2568 | 0.7730 | 0.038* | |
S9' | 0.95552 (5) | 0.37969 (4) | 0.80343 (3) | 0.03070 (16) | |
C91' | 0.8501 (3) | 0.4552 (2) | 0.80550 (17) | 0.0644 (10) | |
H91D | 0.8483 | 0.5038 | 0.7752 | 0.097* | |
H91E | 0.8640 | 0.4781 | 0.8502 | 0.097* | |
H91F | 0.7807 | 0.4247 | 0.7922 | 0.097* | |
C92' | 1.0725 (3) | 0.4470 (2) | 0.83626 (16) | 0.0622 (10) | |
H92D | 1.0725 | 0.4706 | 0.8790 | 0.093* | |
H92E | 1.0715 | 0.4954 | 0.8059 | 0.093* | |
H92F | 1.1374 | 0.4117 | 0.8418 | 0.093* |
U11 | U22 | U33 | U12 | U13 | U23 | |
B1 | 0.0327 (16) | 0.0402 (17) | 0.0204 (14) | −0.0065 (13) | 0.0051 (12) | −0.0045 (12) |
B2 | 0.0270 (15) | 0.0325 (16) | 0.0250 (14) | −0.0038 (12) | 0.0042 (12) | −0.0064 (12) |
B3 | 0.0224 (14) | 0.0314 (15) | 0.0236 (13) | −0.0040 (12) | 0.0069 (11) | −0.0068 (11) |
B4 | 0.0267 (14) | 0.0314 (15) | 0.0192 (13) | −0.0025 (12) | 0.0059 (11) | 0.0014 (11) |
B5 | 0.0288 (15) | 0.0322 (15) | 0.0201 (13) | −0.0009 (12) | −0.0005 (11) | 0.0048 (11) |
B6 | 0.0243 (15) | 0.0330 (16) | 0.0305 (15) | −0.0033 (12) | −0.0016 (12) | −0.0032 (12) |
C7 | 0.0208 (12) | 0.0235 (12) | 0.0235 (12) | −0.0016 (10) | 0.0045 (9) | −0.0057 (9) |
C8 | 0.0213 (11) | 0.0232 (12) | 0.0176 (11) | −0.0024 (9) | 0.0056 (9) | −0.0013 (9) |
B9 | 0.0214 (13) | 0.0236 (13) | 0.0193 (12) | −0.0026 (11) | 0.0032 (10) | 0.0002 (10) |
B10 | 0.0226 (14) | 0.0296 (15) | 0.0306 (15) | 0.0015 (12) | 0.0048 (11) | 0.0003 (12) |
B11 | 0.0225 (14) | 0.0269 (14) | 0.0312 (14) | −0.0035 (12) | 0.0073 (12) | −0.0035 (12) |
C71 | 0.0244 (12) | 0.0182 (11) | 0.0309 (13) | −0.0046 (10) | 0.0036 (10) | −0.0037 (10) |
C72 | 0.0377 (15) | 0.0305 (14) | 0.0481 (16) | 0.0024 (12) | 0.0137 (13) | −0.0028 (12) |
C73 | 0.0494 (18) | 0.0307 (16) | 0.077 (2) | 0.0129 (14) | 0.0175 (17) | 0.0025 (15) |
C74 | 0.064 (2) | 0.0286 (15) | 0.0538 (19) | 0.0015 (15) | 0.0046 (16) | 0.0090 (14) |
C75 | 0.073 (2) | 0.0321 (15) | 0.0427 (16) | −0.0029 (15) | 0.0202 (15) | 0.0056 (13) |
C76 | 0.0520 (17) | 0.0254 (13) | 0.0386 (15) | 0.0015 (12) | 0.0185 (13) | −0.0001 (11) |
C81 | 0.0211 (12) | 0.0157 (11) | 0.0239 (11) | 0.0002 (9) | 0.0045 (9) | −0.0010 (9) |
C82 | 0.0258 (12) | 0.0239 (12) | 0.0243 (12) | −0.0018 (10) | 0.0086 (10) | −0.0024 (10) |
C83 | 0.0199 (12) | 0.0287 (13) | 0.0349 (13) | −0.0010 (10) | 0.0085 (10) | −0.0007 (10) |
C84 | 0.0234 (12) | 0.0272 (13) | 0.0287 (13) | 0.0002 (10) | −0.0013 (10) | −0.0048 (10) |
C85 | 0.0313 (13) | 0.0329 (14) | 0.0209 (12) | 0.0022 (11) | 0.0037 (10) | −0.0018 (10) |
C86 | 0.0221 (12) | 0.0290 (13) | 0.0262 (12) | 0.0025 (10) | 0.0080 (10) | −0.0004 (10) |
S9 | 0.0280 (3) | 0.0217 (3) | 0.0284 (3) | −0.0025 (3) | 0.0080 (2) | −0.0019 (2) |
C91 | 0.0597 (18) | 0.0339 (15) | 0.0262 (13) | −0.0009 (13) | 0.0161 (13) | −0.0023 (11) |
C92 | 0.0571 (18) | 0.0230 (13) | 0.0409 (15) | 0.0045 (12) | 0.0171 (13) | 0.0067 (11) |
B1' | 0.0196 (14) | 0.0361 (16) | 0.0276 (14) | −0.0019 (12) | 0.0003 (11) | 0.0026 (12) |
B2' | 0.0207 (13) | 0.0287 (15) | 0.0227 (13) | −0.0019 (11) | 0.0013 (11) | 0.0034 (11) |
B3' | 0.0168 (12) | 0.0232 (14) | 0.0269 (13) | −0.0006 (11) | 0.0044 (10) | 0.0023 (11) |
B4' | 0.0165 (13) | 0.0279 (14) | 0.0288 (14) | −0.0023 (11) | 0.0043 (11) | 0.0002 (11) |
B5' | 0.0218 (14) | 0.0304 (15) | 0.0292 (14) | −0.0086 (12) | 0.0049 (11) | −0.0025 (12) |
B6' | 0.0306 (15) | 0.0377 (16) | 0.0202 (13) | −0.0125 (13) | 0.0040 (12) | −0.0023 (12) |
C7' | 0.0168 (11) | 0.0225 (11) | 0.0176 (11) | 0.0003 (9) | 0.0020 (9) | 0.0028 (9) |
C8' | 0.0148 (11) | 0.0208 (11) | 0.0228 (11) | 0.0014 (9) | 0.0049 (9) | 0.0020 (9) |
B9' | 0.0252 (14) | 0.0215 (13) | 0.0249 (13) | −0.0027 (11) | 0.0074 (11) | −0.0001 (11) |
B10' | 0.0289 (15) | 0.0260 (15) | 0.0275 (14) | −0.0052 (12) | 0.0112 (12) | −0.0044 (12) |
B11' | 0.0242 (14) | 0.0275 (14) | 0.0207 (13) | −0.0035 (11) | 0.0083 (11) | −0.0009 (11) |
C71' | 0.0206 (11) | 0.0258 (12) | 0.0139 (10) | −0.0024 (10) | 0.0047 (9) | 0.0024 (9) |
C72' | 0.0270 (13) | 0.0281 (13) | 0.0261 (12) | −0.0004 (10) | 0.0078 (10) | −0.0004 (10) |
C73' | 0.0402 (15) | 0.0284 (14) | 0.0355 (14) | −0.0095 (12) | 0.0128 (12) | −0.0048 (11) |
C74' | 0.0316 (14) | 0.0458 (16) | 0.0273 (13) | −0.0186 (12) | 0.0079 (11) | −0.0087 (12) |
C75' | 0.0192 (12) | 0.0482 (16) | 0.0275 (13) | −0.0046 (11) | 0.0016 (10) | 0.0012 (12) |
C76' | 0.0230 (12) | 0.0302 (13) | 0.0250 (12) | −0.0005 (10) | 0.0035 (10) | 0.0039 (10) |
C81' | 0.0236 (12) | 0.0274 (12) | 0.0205 (11) | −0.0074 (10) | 0.0070 (9) | 0.0016 (10) |
C82' | 0.0334 (14) | 0.0375 (15) | 0.0281 (13) | −0.0040 (12) | 0.0106 (11) | −0.0023 (11) |
C83' | 0.0569 (19) | 0.0501 (18) | 0.0294 (14) | −0.0185 (15) | 0.0213 (14) | −0.0136 (13) |
C84' | 0.0453 (17) | 0.0602 (19) | 0.0209 (13) | −0.0250 (15) | 0.0027 (12) | 0.0006 (13) |
C85' | 0.0320 (14) | 0.0567 (19) | 0.0277 (14) | −0.0092 (13) | −0.0012 (11) | 0.0121 (13) |
C86' | 0.0299 (13) | 0.0384 (14) | 0.0244 (12) | 0.0001 (11) | 0.0044 (10) | 0.0062 (11) |
S9' | 0.0403 (4) | 0.0243 (3) | 0.0306 (3) | −0.0015 (3) | 0.0153 (3) | 0.0034 (3) |
C91' | 0.100 (3) | 0.0453 (19) | 0.063 (2) | 0.0408 (19) | 0.046 (2) | 0.0247 (16) |
C92' | 0.083 (3) | 0.052 (2) | 0.0485 (18) | −0.0427 (19) | 0.0142 (17) | 0.0028 (15) |
B1—B2 | 1.750 (4) | B1'—B2' | 1.758 (4) |
B1—B3 | 1.774 (4) | B1'—B3' | 1.783 (4) |
B1—B4 | 1.778 (4) | B1'—B4' | 1.778 (4) |
B1—B5 | 1.782 (4) | B1'—B5' | 1.777 (4) |
B1—B6 | 1.810 (4) | B1'—B6' | 1.814 (4) |
B1—H1 | 1.05 (3) | B1'—H1' | 1.07 (3) |
B2—B3 | 1.754 (4) | B2'—B3' | 1.760 (4) |
B2—B6 | 1.771 (4) | B2'—B6' | 1.776 (4) |
B2—C7 | 1.702 (3) | B2'—C7' | 1.712 (3) |
B2—B11 | 1.801 (4) | B2'—B11' | 1.806 (4) |
B2—H2 | 1.16 (3) | B2'—H2' | 1.11 (3) |
B3—B4 | 1.773 (4) | B3'—B4' | 1.773 (4) |
B3—C7 | 1.719 (3) | B3'—C7' | 1.715 (3) |
B3—C8 | 1.742 (3) | B3'—C8' | 1.740 (3) |
B3—H3 | 1.04 (3) | B3'—H3' | 1.08 (2) |
B4—B5 | 1.764 (4) | B4'—B5' | 1.771 (4) |
B4—C8 | 1.749 (3) | B4'—C8' | 1.743 (3) |
B4—B9 | 1.763 (4) | B4'—B9' | 1.760 (4) |
B4—H4 | 1.11 (3) | B4'—H4' | 1.10 (2) |
B5—B6 | 1.802 (4) | B5'—B6' | 1.803 (4) |
B5—B9 | 1.753 (3) | B5'—B9' | 1.748 (4) |
B5—B10 | 1.804 (4) | B5'—B10' | 1.801 (4) |
B5—H5 | 1.10 (3) | B5'—H5' | 1.09 (3) |
B6—B10 | 1.800 (4) | B6'—B10' | 1.789 (4) |
B6—B11 | 1.793 (4) | B6'—B11' | 1.779 (4) |
B6—H6 | 1.05 (3) | B6'—H6' | 1.11 (3) |
C7—C8 | 1.585 (3) | C7'—C8' | 1.585 (3) |
C7—B11 | 1.654 (3) | C7'—B11' | 1.651 (3) |
C7—C71 | 1.508 (3) | C7'—C71' | 1.507 (3) |
C8—B9 | 1.612 (3) | C8'—B9' | 1.617 (3) |
C8—C81 | 1.507 (3) | C8'—C81' | 1.509 (3) |
B9—S9 | 1.889 (3) | B9'—S9' | 1.888 (3) |
B9—B10 | 1.782 (4) | B9'—B10' | 1.778 (4) |
B10—B11 | 1.862 (4) | B10'—B11' | 1.863 (4) |
B10—H10 | 1.14 (3) | B10'—H10' | 1.10 (3) |
B10—H10A | 1.19 (3) | B10'—H10B | 1.17 (3) |
B11—H10A | 1.35 (3) | B11'—H10B | 1.30 (3) |
B11—H11 | 1.11 (3) | B11'—H11' | 1.04 (2) |
C71—C76 | 1.388 (4) | C71'—C72' | 1.396 (3) |
C71—C72 | 1.392 (3) | C71'—C76' | 1.396 (3) |
C72—C73 | 1.392 (4) | C72'—C73' | 1.388 (3) |
C72—H72 | 0.9500 | C72'—H72' | 0.9500 |
C73—C74 | 1.381 (5) | C73'—C74' | 1.382 (4) |
C73—H73 | 0.9500 | C73'—H73' | 0.9500 |
C74—C75 | 1.370 (4) | C74'—C75' | 1.389 (4) |
C74—H74 | 0.9500 | C74'—H74' | 0.9500 |
C75—C76 | 1.390 (4) | C75'—C76' | 1.379 (3) |
C75—H75 | 0.9500 | C75'—H75' | 0.9500 |
C76—H76 | 0.9500 | C76'—H76' | 0.9500 |
C81—C82 | 1.391 (3) | C81'—C82' | 1.383 (3) |
C81—C86 | 1.397 (3) | C81'—C86' | 1.396 (3) |
C82—C83 | 1.383 (3) | C82'—C83' | 1.398 (4) |
C82—H82 | 0.9500 | C82'—H82' | 0.9500 |
C83—C84 | 1.393 (3) | C83'—C84' | 1.380 (4) |
C83—H83 | 0.9500 | C83'—H83' | 0.9500 |
C84—C85 | 1.378 (3) | C84'—C85' | 1.377 (4) |
C84—H84 | 0.9500 | C84'—H84' | 0.9500 |
C85—C86 | 1.384 (3) | C85'—C86' | 1.387 (3) |
C85—H85 | 0.9500 | C85'—H85' | 0.9500 |
C86—H86 | 0.9500 | C86'—H86' | 0.9500 |
S9—C91 | 1.796 (3) | S9'—C91' | 1.804 (3) |
S9—C92 | 1.792 (3) | S9'—C92' | 1.797 (3) |
C91—H91A | 0.9800 | C91'—H91D | 0.9800 |
C91—H91B | 0.9800 | C91'—H91E | 0.9800 |
C91—H91C | 0.9800 | C91'—H91F | 0.9800 |
C92—H92A | 0.9800 | C92'—H92D | 0.9800 |
C92—H92B | 0.9800 | C92'—H92E | 0.9800 |
C92—H92C | 0.9800 | C92'—H92F | 0.9800 |
B2—B1—B3 | 59.69 (16) | B2'—B1'—B5' | 108.3 (2) |
B2—B1—B4 | 107.62 (19) | B2'—B1'—B4' | 107.77 (18) |
B3—B1—B4 | 59.89 (15) | B5'—B1'—B4' | 59.77 (15) |
B2—B1—B5 | 107.8 (2) | B2'—B1'—B3' | 59.62 (15) |
B3—B1—B5 | 107.30 (19) | B5'—B1'—B3' | 107.49 (18) |
B4—B1—B5 | 59.42 (16) | B4'—B1'—B3' | 59.74 (15) |
B2—B1—B6 | 59.66 (17) | B2'—B1'—B6' | 59.60 (16) |
B3—B1—B6 | 107.2 (2) | B5'—B1'—B6' | 60.29 (16) |
B4—B1—B6 | 107.43 (19) | B4'—B1'—B6' | 107.4 (2) |
B5—B1—B6 | 60.22 (16) | B3'—B1'—B6' | 106.69 (19) |
B2—B1—H1 | 122.1 (15) | B2'—B1'—H1' | 122.0 (14) |
B3—B1—H1 | 120.0 (15) | B5'—B1'—H1' | 121.6 (14) |
B4—B1—H1 | 120.4 (15) | B4'—B1'—H1' | 121.4 (14) |
B5—B1—H1 | 123.1 (15) | B3'—B1'—H1' | 122.0 (14) |
B6—B1—H1 | 124.4 (14) | B6'—B1'—H1' | 123.0 (14) |
C7—B2—B1 | 106.11 (19) | C7'—B2'—B1' | 105.38 (18) |
C7—B2—B3 | 59.66 (14) | C7'—B2'—B3' | 59.18 (14) |
B1—B2—B3 | 60.84 (16) | B1'—B2'—B3' | 60.90 (15) |
C7—B2—B6 | 103.82 (19) | C7'—B2'—B6' | 102.74 (18) |
B1—B2—B6 | 61.86 (17) | B1'—B2'—B6' | 61.77 (16) |
B3—B2—B6 | 109.8 (2) | B3'—B2'—B6' | 109.37 (19) |
C7—B2—B11 | 56.29 (14) | C7'—B2'—B11' | 55.88 (13) |
B1—B2—B11 | 109.6 (2) | B1'—B2'—B11' | 108.78 (19) |
B3—B2—B11 | 107.47 (18) | B3'—B2'—B11' | 106.65 (18) |
B6—B2—B11 | 60.26 (16) | B6'—B2'—B11' | 59.57 (15) |
C7—B2—H2 | 116.0 (13) | C7'—B2'—H2' | 117.4 (13) |
B1—B2—H2 | 128.9 (13) | B1'—B2'—H2' | 129.7 (13) |
B3—B2—H2 | 118.6 (13) | B3'—B2'—H2' | 121.0 (13) |
B6—B2—H2 | 128.0 (13) | B6'—B2'—H2' | 126.4 (13) |
B11—B2—H2 | 117.3 (13) | B11'—B2'—H2' | 116.5 (13) |
C7—B3—C8 | 54.49 (13) | C7'—B3'—C8' | 54.60 (12) |
C7—B3—B2 | 58.67 (14) | C7'—B3'—B2' | 59.02 (14) |
C8—B3—B2 | 101.66 (18) | C8'—B3'—B2' | 102.18 (18) |
C7—B3—B4 | 104.52 (19) | C7'—B3'—B4' | 104.40 (18) |
C8—B3—B4 | 59.69 (14) | C8'—B3'—B4' | 59.47 (14) |
B2—B3—B4 | 107.7 (2) | B2'—B3'—B4' | 107.86 (19) |
C7—B3—B1 | 104.30 (19) | C7'—B3'—B1' | 104.17 (19) |
C8—B3—B1 | 103.63 (19) | C8'—B3'—B1' | 103.32 (18) |
B2—B3—B1 | 59.47 (16) | B2'—B3'—B1' | 59.48 (15) |
B4—B3—B1 | 60.17 (16) | B4'—B3'—B1' | 59.99 (15) |
C7—B3—H3 | 122.8 (14) | C7'—B3'—H3' | 123.0 (13) |
C8—B3—H3 | 122.6 (14) | C8'—B3'—H3' | 123.3 (13) |
B2—B3—H3 | 125.4 (14) | B2'—B3'—H3' | 124.3 (13) |
B4—B3—H3 | 121.2 (14) | B4'—B3'—H3' | 121.6 (13) |
B1—B3—H3 | 126.8 (14) | B1'—B3'—H3' | 126.5 (13) |
C8—B4—B9 | 54.64 (13) | C8'—B4'—B9' | 54.99 (13) |
C8—B4—B5 | 101.40 (18) | C8'—B4'—B5' | 101.52 (18) |
B9—B4—B5 | 59.61 (15) | B9'—B4'—B5' | 59.33 (15) |
C8—B4—B3 | 59.26 (14) | C8'—B4'—B3' | 59.32 (14) |
B9—B4—B3 | 105.54 (19) | B9'—B4'—B3' | 105.78 (18) |
B5—B4—B3 | 108.1 (2) | B5'—B4'—B3' | 108.16 (19) |
C8—B4—B1 | 103.16 (19) | C8'—B4'—B1' | 103.42 (18) |
B9—B4—B1 | 106.50 (19) | B9'—B4'—B1' | 106.21 (19) |
B5—B4—B1 | 60.40 (16) | B5'—B4'—B1' | 60.08 (16) |
B3—B4—B1 | 59.94 (16) | B3'—B4'—B1' | 60.27 (15) |
C8—B4—H4 | 121.0 (13) | C8'—B4'—H4' | 121.5 (13) |
B9—B4—H4 | 121.7 (13) | B9'—B4'—H4' | 121.8 (13) |
B5—B4—H4 | 127.7 (13) | B5'—B4'—H4' | 127.0 (13) |
B3—B4—H4 | 119.0 (13) | B3'—B4'—H4' | 119.4 (13) |
B1—B4—H4 | 127.3 (13) | B1'—B4'—H4' | 126.9 (13) |
B9—B5—B4 | 60.17 (15) | B9'—B5'—B4' | 60.02 (15) |
B9—B5—B1 | 106.77 (19) | B9'—B5'—B1' | 106.79 (19) |
B4—B5—B1 | 60.18 (16) | B4'—B5'—B1' | 60.15 (16) |
B9—B5—B6 | 105.04 (19) | B9'—B5'—B10' | 60.11 (15) |
B4—B5—B6 | 108.4 (2) | B4'—B5'—B10' | 110.86 (18) |
B1—B5—B6 | 60.67 (17) | B1'—B5'—B10' | 110.5 (2) |
B9—B5—B10 | 60.11 (15) | B9'—B5'—B6' | 104.67 (19) |
B4—B5—B10 | 111.10 (18) | B4'—B5'—B6' | 108.14 (19) |
B1—B5—B10 | 110.5 (2) | B1'—B5'—B6' | 60.88 (16) |
B6—B5—B10 | 59.87 (16) | B10'—B5'—B6' | 59.51 (16) |
B9—B5—H5 | 121.9 (13) | B9'—B5'—H5' | 119.8 (13) |
B4—B5—H5 | 120.8 (14) | B4'—B5'—H5' | 122.6 (13) |
B1—B5—H5 | 123.1 (13) | B1'—B5'—H5' | 126.2 (13) |
B6—B5—H5 | 123.6 (14) | B10'—B5'—H5' | 115.1 (14) |
B10—B5—H5 | 118.0 (14) | B6'—B5'—H5' | 123.9 (13) |
B2—B6—B11 | 60.68 (16) | B2'—B6'—B11' | 61.07 (15) |
B2—B6—B10 | 111.42 (19) | B2'—B6'—B10' | 112.37 (19) |
B11—B6—B10 | 62.44 (16) | B11'—B6'—B10' | 62.96 (16) |
B2—B6—B5 | 106.0 (2) | B2'—B6'—B5' | 106.36 (19) |
B11—B6—B5 | 107.51 (18) | B11'—B6'—B5' | 107.96 (19) |
B10—B6—B5 | 60.13 (16) | B10'—B6'—B5' | 60.19 (15) |
B2—B6—B1 | 58.48 (17) | B2'—B6'—B1' | 58.63 (16) |
B11—B6—B1 | 107.3 (2) | B11'—B6'—B1' | 107.49 (19) |
B10—B6—B1 | 109.44 (19) | B10'—B6'—B1' | 109.40 (19) |
B5—B6—B1 | 59.12 (16) | B5'—B6'—B1' | 58.84 (16) |
B2—B6—H6 | 123.1 (15) | B2'—B6'—H6' | 121.3 (14) |
B11—B6—H6 | 126.0 (15) | B11'—B6'—H6' | 122.9 (14) |
B10—B6—H6 | 120.0 (14) | B10'—B6'—H6' | 119.5 (14) |
B5—B6—H6 | 119.3 (15) | B5'—B6'—H6' | 121.8 (14) |
B1—B6—H6 | 118.8 (14) | B1'—B6'—H6' | 120.8 (14) |
C71—C7—C8 | 118.83 (18) | C71'—C7'—C8' | 120.43 (17) |
C71—C7—B11 | 118.5 (2) | C71'—C7'—B11' | 117.81 (18) |
C8—C7—B11 | 109.74 (18) | C8'—C7'—B11' | 109.81 (18) |
C71—C7—B2 | 121.96 (19) | C71'—C7'—B2' | 119.89 (18) |
C8—C7—B2 | 111.04 (18) | C8'—C7'—B2' | 111.31 (17) |
B11—C7—B2 | 64.88 (16) | B11'—C7'—B2' | 64.93 (15) |
C71—C7—B3 | 117.82 (19) | C71'—C7'—B3' | 117.48 (19) |
C8—C7—B3 | 63.47 (14) | C8'—C7'—B3' | 63.49 (14) |
B11—C7—B3 | 116.30 (19) | B11'—C7'—B3' | 116.37 (18) |
B2—C7—B3 | 61.67 (15) | B2'—C7'—B3' | 61.79 (14) |
C81—C8—C7 | 117.32 (18) | C81'—C8'—C7' | 116.92 (18) |
C81—C8—B9 | 119.07 (18) | C81'—C8'—B9' | 119.97 (18) |
C7—C8—B9 | 113.77 (18) | C7'—C8'—B9' | 113.57 (18) |
C81—C8—B3 | 117.75 (18) | C81'—C8'—B3' | 117.02 (18) |
C7—C8—B3 | 62.04 (14) | C7'—C8'—B3' | 61.91 (14) |
B9—C8—B3 | 114.14 (18) | B9'—C8'—B3' | 114.08 (17) |
C81—C8—B4 | 120.49 (18) | C81'—C8'—B4' | 120.47 (18) |
C7—C8—B4 | 111.79 (17) | C7'—C8'—B4' | 111.78 (17) |
B9—C8—B4 | 63.13 (15) | B9'—C8'—B4' | 63.04 (15) |
B3—C8—B4 | 61.05 (15) | B3'—C8'—B4' | 61.22 (14) |
C8—B9—B5 | 107.70 (19) | C8'—B9'—B5' | 107.90 (19) |
C8—B9—B4 | 62.24 (15) | C8'—B9'—B4' | 61.97 (14) |
B5—B9—B4 | 60.22 (15) | B5'—B9'—B4' | 60.65 (15) |
C8—B9—B10 | 108.78 (19) | C8'—B9'—B10' | 108.81 (19) |
B5—B9—B10 | 61.36 (16) | B5'—B9'—B10' | 61.44 (16) |
B4—B9—B10 | 112.19 (19) | B4'—B9'—B10' | 112.49 (19) |
C8—B9—S9 | 116.29 (16) | C8'—B9'—S9' | 117.86 (17) |
B5—B9—S9 | 122.92 (17) | B5'—B9'—S9' | 122.85 (17) |
B4—B9—S9 | 111.59 (16) | B4'—B9'—S9' | 113.86 (17) |
B10—B9—S9 | 127.61 (18) | B10'—B9'—S9' | 125.16 (17) |
B9—B10—B6 | 103.93 (19) | B9'—B10'—B6' | 104.01 (19) |
B9—B10—B5 | 58.53 (15) | B9'—B10'—B5' | 58.45 (15) |
B6—B10—B5 | 59.99 (16) | B6'—B10'—B5' | 60.30 (16) |
B9—B10—B11 | 100.20 (18) | B9'—B10'—B11' | 100.23 (18) |
B6—B10—B11 | 58.61 (16) | B6'—B10'—B11' | 58.27 (15) |
B5—B10—B11 | 104.5 (2) | B5'—B10'—B11' | 104.49 (19) |
B9—B10—H10 | 129.9 (13) | B9'—B10'—H10' | 127.7 (13) |
B6—B10—H10 | 117.3 (13) | B6'—B10'—H10' | 118.9 (13) |
B5—B10—H10 | 119.9 (13) | B5'—B10'—H10' | 119.1 (13) |
B11—B10—H10 | 124.7 (13) | B11'—B10'—H10' | 126.6 (13) |
B9—B10—H10A | 85.9 (12) | B9'—B10'—H10B | 88.1 (12) |
B6—B10—H10A | 104.8 (12) | B6'—B10'—H10B | 101.9 (13) |
B5—B10—H10A | 131.4 (13) | B5'—B10'—H10B | 131.5 (12) |
B11—B10—H10A | 46.4 (12) | B11'—B10'—H10B | 43.7 (12) |
H10—B10—H10A | 108.1 (18) | H10'—B10'—H10B | 109.1 (18) |
C7—B11—B6 | 104.9 (2) | C7'—B11'—B6' | 105.16 (19) |
C7—B11—B2 | 58.84 (15) | C7'—B11'—B2' | 59.19 (14) |
B6—B11—B2 | 59.06 (16) | B6'—B11'—B2' | 59.36 (15) |
C7—B11—B10 | 107.31 (19) | C7'—B11'—B10' | 107.38 (18) |
B6—B11—B10 | 58.95 (16) | B6'—B11'—B10' | 58.77 (15) |
B2—B11—B10 | 107.3 (2) | B2'—B11'—B10' | 107.61 (18) |
C7—B11—H10A | 95.5 (11) | C7'—B11'—H10B | 97.0 (11) |
B6—B11—H10A | 98.3 (11) | B6'—B11'—H10B | 97.0 (11) |
B2—B11—H10A | 133.5 (11) | B2'—B11'—H10B | 134.3 (11) |
B10—B11—H10A | 39.5 (11) | B10'—B11'—H10B | 38.3 (11) |
C7—B11—H11 | 120.8 (13) | C7'—B11'—H11' | 120.2 (14) |
B6—B11—H11 | 121.3 (13) | B6'—B11'—H11' | 122.9 (13) |
B2—B11—H11 | 115.5 (13) | B2'—B11'—H11' | 116.7 (14) |
B10—B11—H11 | 127.0 (13) | B10'—B11'—H11' | 126.5 (14) |
H10A—B11—H11 | 110.9 (17) | H10B—B11'—H11' | 108.9 (17) |
C76—C71—C72 | 117.8 (2) | C72'—C71'—C76' | 118.3 (2) |
C76—C71—C7 | 118.3 (2) | C72'—C71'—C7' | 122.9 (2) |
C72—C71—C7 | 123.9 (2) | C76'—C71'—C7' | 118.6 (2) |
C73—C72—C71 | 120.6 (3) | C73'—C72'—C71' | 120.4 (2) |
C73—C72—H72 | 119.7 | C73'—C72'—H72' | 119.8 |
C71—C72—H72 | 119.7 | C71'—C72'—H72' | 119.8 |
C74—C73—C72 | 120.7 (3) | C74'—C73'—C72' | 120.6 (2) |
C74—C73—H73 | 119.6 | C74'—C73'—H73' | 119.7 |
C72—C73—H73 | 119.6 | C72'—C73'—H73' | 119.7 |
C75—C74—C73 | 119.2 (3) | C73'—C74'—C75' | 119.4 (2) |
C75—C74—H74 | 120.4 | C73'—C74'—H74' | 120.3 |
C73—C74—H74 | 120.4 | C75'—C74'—H74' | 120.3 |
C74—C75—C76 | 120.4 (3) | C76'—C75'—C74' | 120.2 (2) |
C74—C75—H75 | 119.8 | C76'—C75'—H75' | 119.9 |
C76—C75—H75 | 119.8 | C74'—C75'—H75' | 119.9 |
C71—C76—C75 | 121.3 (3) | C75'—C76'—C71' | 121.0 (2) |
C71—C76—H76 | 119.3 | C75'—C76'—H76' | 119.5 |
C75—C76—H76 | 119.3 | C71'—C76'—H76' | 119.5 |
C82—C81—C86 | 118.2 (2) | C82'—C81'—C86' | 118.7 (2) |
C82—C81—C8 | 123.2 (2) | C82'—C81'—C8' | 123.1 (2) |
C86—C81—C8 | 118.65 (19) | C86'—C81'—C8' | 118.1 (2) |
C83—C82—C81 | 120.6 (2) | C81'—C82'—C83' | 120.3 (3) |
C83—C82—H82 | 119.7 | C81'—C82'—H82' | 119.8 |
C81—C82—H82 | 119.7 | C83'—C82'—H82' | 119.8 |
C82—C83—C84 | 120.5 (2) | C84'—C83'—C82' | 120.2 (3) |
C82—C83—H83 | 119.8 | C84'—C83'—H83' | 119.9 |
C84—C83—H83 | 119.8 | C82'—C83'—H83' | 119.9 |
C85—C84—C83 | 119.5 (2) | C85'—C84'—C83' | 120.0 (2) |
C85—C84—H84 | 120.2 | C85'—C84'—H84' | 120.0 |
C83—C84—H84 | 120.2 | C83'—C84'—H84' | 120.0 |
C84—C85—C86 | 119.9 (2) | C84'—C85'—C86' | 119.9 (3) |
C84—C85—H85 | 120.0 | C84'—C85'—H85' | 120.1 |
C86—C85—H85 | 120.0 | C86'—C85'—H85' | 120.1 |
C85—C86—C81 | 121.3 (2) | C85'—C86'—C81' | 120.9 (3) |
C85—C86—H86 | 119.3 | C85'—C86'—H86' | 119.6 |
C81—C86—H86 | 119.3 | C81'—C86'—H86' | 119.6 |
C92—S9—C91 | 99.89 (13) | C92'—S9'—C91' | 100.89 (19) |
C92—S9—B9 | 103.29 (12) | C92'—S9'—B9' | 104.49 (13) |
C91—S9—B9 | 105.16 (12) | C91'—S9'—B9' | 104.08 (13) |
S9—C91—H91A | 109.5 | S9'—C91'—H91D | 109.5 |
S9—C91—H91B | 109.5 | S9'—C91'—H91E | 109.5 |
H91A—C91—H91B | 109.5 | H91D—C91'—H91E | 109.5 |
S9—C91—H91C | 109.5 | S9'—C91'—H91F | 109.5 |
H91A—C91—H91C | 109.5 | H91D—C91'—H91F | 109.5 |
H91B—C91—H91C | 109.5 | H91E—C91'—H91F | 109.5 |
S9—C92—H92A | 109.5 | S9'—C92'—H92D | 109.5 |
S9—C92—H92B | 109.5 | S9'—C92'—H92E | 109.5 |
H92A—C92—H92B | 109.5 | H92D—C92'—H92E | 109.5 |
S9—C92—H92C | 109.5 | S9'—C92'—H92F | 109.5 |
H92A—C92—H92C | 109.5 | H92D—C92'—H92F | 109.5 |
H92B—C92—H92C | 109.5 | H92E—C92'—H92F | 109.5 |
B3—B1—B2—C7 | 40.26 (18) | B5'—B1'—B2'—C7' | 59.5 (2) |
B4—B1—B2—C7 | 2.9 (3) | B4'—B1'—B2'—C7' | −3.7 (3) |
B5—B1—B2—C7 | −59.8 (2) | B3'—B1'—B2'—C7' | −40.44 (17) |
B6—B1—B2—C7 | −97.3 (2) | B6'—B1'—B2'—C7' | 96.43 (19) |
B4—B1—B2—B3 | −37.31 (19) | B5'—B1'—B2'—B3' | 100.0 (2) |
B5—B1—B2—B3 | −100.0 (2) | B4'—B1'—B2'—B3' | 36.75 (18) |
B6—B1—B2—B3 | −137.58 (19) | B6'—B1'—B2'—B3' | 136.87 (19) |
B3—B1—B2—B6 | 137.58 (19) | B5'—B1'—B2'—B6' | −36.91 (18) |
B4—B1—B2—B6 | 100.3 (2) | B4'—B1'—B2'—B6' | −100.1 (2) |
B5—B1—B2—B6 | 37.56 (18) | B3'—B1'—B2'—B6' | −136.87 (19) |
B3—B1—B2—B11 | 99.6 (2) | B5'—B1'—B2'—B11' | 0.9 (2) |
B4—B1—B2—B11 | 62.3 (3) | B4'—B1'—B2'—B11' | −62.3 (2) |
B5—B1—B2—B11 | −0.5 (3) | B3'—B1'—B2'—B11' | −99.03 (19) |
B6—B1—B2—B11 | −38.02 (18) | B6'—B1'—B2'—B11' | 37.83 (18) |
B1—B2—B3—C7 | 134.0 (2) | B1'—B2'—B3'—C7' | −133.27 (19) |
B6—B2—B3—C7 | 94.8 (2) | B6'—B2'—B3'—C7' | −93.6 (2) |
B11—B2—B3—C7 | 30.85 (18) | B11'—B2'—B3'—C7' | −30.67 (16) |
C7—B2—B3—C8 | −34.92 (16) | C7'—B2'—B3'—C8' | 34.84 (15) |
B1—B2—B3—C8 | 99.1 (2) | B1'—B2'—B3'—C8' | −98.42 (19) |
B6—B2—B3—C8 | 59.9 (2) | B6'—B2'—B3'—C8' | −58.7 (2) |
B11—B2—B3—C8 | −4.1 (2) | B11'—B2'—B3'—C8' | 4.2 (2) |
C7—B2—B3—B4 | −96.6 (2) | C7'—B2'—B3'—B4' | 96.39 (19) |
B1—B2—B3—B4 | 37.44 (19) | B1'—B2'—B3'—B4' | −36.88 (18) |
B6—B2—B3—B4 | −1.8 (3) | B6'—B2'—B3'—B4' | 2.8 (2) |
B11—B2—B3—B4 | −65.7 (2) | B11'—B2'—B3'—B4' | 65.7 (2) |
C7—B2—B3—B1 | −134.0 (2) | C7'—B2'—B3'—B1' | 133.27 (19) |
B6—B2—B3—B1 | −39.21 (19) | B6'—B2'—B3'—B1' | 39.68 (19) |
B11—B2—B3—B1 | −103.1 (2) | B11'—B2'—B3'—B1' | 102.6 (2) |
B2—B1—B3—C7 | −39.35 (17) | B2'—B1'—B3'—C7' | 40.08 (17) |
B4—B1—B3—C7 | 98.75 (19) | B5'—B1'—B3'—C7' | −61.3 (2) |
B5—B1—B3—C7 | 61.6 (2) | B4'—B1'—B3'—C7' | −98.64 (19) |
B6—B1—B3—C7 | −1.8 (2) | B6'—B1'—B3'—C7' | 2.1 (2) |
B2—B1—B3—C8 | −95.64 (19) | B2'—B1'—B3'—C8' | 96.43 (18) |
B4—B1—B3—C8 | 42.46 (17) | B5'—B1'—B3'—C8' | −4.9 (2) |
B5—B1—B3—C8 | 5.3 (2) | B4'—B1'—B3'—C8' | −42.30 (16) |
B6—B1—B3—C8 | −58.1 (2) | B6'—B1'—B3'—C8' | 58.4 (2) |
B4—B1—B3—B2 | 138.1 (2) | B5'—B1'—B3'—B2' | −101.4 (2) |
B5—B1—B3—B2 | 100.9 (2) | B4'—B1'—B3'—B2' | −138.7 (2) |
B6—B1—B3—B2 | 37.54 (18) | B6'—B1'—B3'—B2' | −38.00 (18) |
B2—B1—B3—B4 | −138.1 (2) | B2'—B1'—B3'—B4' | 138.7 (2) |
B5—B1—B3—B4 | −37.20 (19) | B5'—B1'—B3'—B4' | 37.35 (18) |
B6—B1—B3—B4 | −100.6 (2) | B6'—B1'—B3'—B4' | 100.7 (2) |
C7—B3—B4—C8 | 32.18 (16) | C7'—B3'—B4'—C8' | −32.25 (15) |
B2—B3—B4—C8 | 93.41 (19) | B2'—B3'—B4'—C8' | −93.86 (19) |
B1—B3—B4—C8 | 130.54 (19) | B1'—B3'—B4'—C8' | −130.51 (19) |
C7—B3—B4—B9 | 2.0 (2) | C7'—B3'—B4'—B9' | −1.7 (2) |
C8—B3—B4—B9 | −30.19 (16) | C8'—B3'—B4'—B9' | 30.57 (16) |
B2—B3—B4—B9 | 63.2 (2) | B2'—B3'—B4'—B9' | −63.3 (2) |
B1—B3—B4—B9 | 100.4 (2) | B1'—B3'—B4'—B9' | −99.9 (2) |
C7—B3—B4—B5 | −60.5 (2) | C7'—B3'—B4'—B5' | 60.6 (2) |
C8—B3—B4—B5 | −92.71 (19) | C8'—B3'—B4'—B5' | 92.86 (19) |
B2—B3—B4—B5 | 0.7 (2) | B2'—B3'—B4'—B5' | −1.0 (2) |
B1—B3—B4—B5 | 37.83 (18) | B1'—B3'—B4'—B5' | −37.66 (18) |
C7—B3—B4—B1 | −98.4 (2) | C7'—B3'—B4'—B1' | 98.26 (19) |
C8—B3—B4—B1 | −130.54 (19) | C8'—B3'—B4'—B1' | 130.51 (19) |
B2—B3—B4—B1 | −37.13 (18) | B2'—B3'—B4'—B1' | 36.66 (18) |
B2—B1—B4—C8 | −4.9 (3) | B2'—B1'—B4'—C8' | 5.5 (2) |
B3—B1—B4—C8 | −42.13 (17) | B5'—B1'—B4'—C8' | −95.72 (19) |
B5—B1—B4—C8 | 95.77 (19) | B3'—B1'—B4'—C8' | 42.23 (16) |
B6—B1—B4—C8 | 58.0 (2) | B6'—B1'—B4'—C8' | −57.3 (2) |
B2—B1—B4—B9 | −61.5 (2) | B2'—B1'—B4'—B9' | 62.5 (2) |
B3—B1—B4—B9 | −98.7 (2) | B5'—B1'—B4'—B9' | −38.74 (17) |
B5—B1—B4—B9 | 39.19 (18) | B3'—B1'—B4'—B9' | 99.21 (19) |
B6—B1—B4—B9 | 1.4 (3) | B6'—B1'—B4'—B9' | −0.3 (2) |
B2—B1—B4—B5 | −100.7 (2) | B2'—B1'—B4'—B5' | 101.3 (2) |
B3—B1—B4—B5 | −137.9 (2) | B3'—B1'—B4'—B5' | 138.0 (2) |
B6—B1—B4—B5 | −37.79 (19) | B6'—B1'—B4'—B5' | 38.41 (18) |
B2—B1—B4—B3 | 37.22 (19) | B2'—B1'—B4'—B3' | −36.70 (18) |
B5—B1—B4—B3 | 137.9 (2) | B5'—B1'—B4'—B3' | −138.0 (2) |
B6—B1—B4—B3 | 100.1 (2) | B6'—B1'—B4'—B3' | −99.5 (2) |
C8—B4—B5—B9 | 36.62 (16) | C8'—B4'—B5'—B9' | −36.71 (16) |
B3—B4—B5—B9 | 97.8 (2) | B3'—B4'—B5'—B9' | −97.95 (19) |
B1—B4—B5—B9 | 135.4 (2) | B1'—B4'—B5'—B9' | −135.7 (2) |
C8—B4—B5—B1 | −98.77 (19) | C8'—B4'—B5'—B1' | 98.97 (19) |
B9—B4—B5—B1 | −135.4 (2) | B9'—B4'—B5'—B1' | 135.7 (2) |
B3—B4—B5—B1 | −37.63 (18) | B3'—B4'—B5'—B1' | 37.74 (18) |
C8—B4—B5—B6 | −60.5 (2) | C8'—B4'—B5'—B10' | −3.4 (2) |
B9—B4—B5—B6 | −97.2 (2) | B9'—B4'—B5'—B10' | 33.33 (18) |
B3—B4—B5—B6 | 0.6 (2) | B3'—B4'—B5'—B10' | −64.6 (2) |
B1—B4—B5—B6 | 38.23 (18) | B1'—B4'—B5'—B10' | −102.4 (2) |
C8—B4—B5—B10 | 3.4 (2) | C8'—B4'—B5'—B6' | 60.1 (2) |
B9—B4—B5—B10 | −33.18 (19) | B9'—B4'—B5'—B6' | 96.8 (2) |
B3—B4—B5—B10 | 64.6 (2) | B3'—B4'—B5'—B6' | −1.1 (2) |
B1—B4—B5—B10 | 102.2 (2) | B1'—B4'—B5'—B6' | −38.88 (18) |
B2—B1—B5—B9 | 60.8 (2) | B2'—B1'—B5'—B9' | −61.1 (2) |
B3—B1—B5—B9 | −2.1 (3) | B4'—B1'—B5'—B9' | 39.20 (18) |
B4—B1—B5—B9 | −39.52 (18) | B3'—B1'—B5'—B9' | 1.9 (3) |
B6—B1—B5—B9 | 98.1 (2) | B6'—B1'—B5'—B9' | −97.7 (2) |
B2—B1—B5—B4 | 100.3 (2) | B2'—B1'—B5'—B4' | −100.3 (2) |
B3—B1—B5—B4 | 37.41 (19) | B3'—B1'—B5'—B4' | −37.34 (18) |
B6—B1—B5—B4 | 137.7 (2) | B6'—B1'—B5'—B4' | −136.94 (19) |
B2—B1—B5—B6 | −37.32 (18) | B2'—B1'—B5'—B10' | 2.6 (3) |
B3—B1—B5—B6 | −100.2 (2) | B4'—B1'—B5'—B10' | 102.9 (2) |
B4—B1—B5—B6 | −137.7 (2) | B3'—B1'—B5'—B10' | 65.6 (2) |
B2—B1—B5—B10 | −2.9 (3) | B6'—B1'—B5'—B10' | −34.03 (18) |
B3—B1—B5—B10 | −65.8 (2) | B2'—B1'—B5'—B6' | 36.62 (18) |
B4—B1—B5—B10 | −103.2 (2) | B4'—B1'—B5'—B6' | 136.94 (19) |
B6—B1—B5—B10 | 34.43 (18) | B3'—B1'—B5'—B6' | 99.6 (2) |
C7—B2—B6—B11 | −36.98 (17) | C7'—B2'—B6'—B11' | 36.88 (16) |
B1—B2—B6—B11 | −138.1 (2) | B1'—B2'—B6'—B11' | 137.66 (19) |
B3—B2—B6—B11 | −99.3 (2) | B3'—B2'—B6'—B11' | 98.37 (19) |
C7—B2—B6—B10 | 0.8 (3) | C7'—B2'—B6'—B10' | −1.0 (2) |
B1—B2—B6—B10 | −100.3 (2) | B1'—B2'—B6'—B10' | 99.8 (2) |
B3—B2—B6—B10 | −61.5 (3) | B3'—B2'—B6'—B10' | 60.5 (2) |
B11—B2—B6—B10 | 37.8 (2) | B11'—B2'—B6'—B10' | −37.89 (19) |
C7—B2—B6—B5 | 64.4 (2) | C7'—B2'—B6'—B5' | −64.9 (2) |
B1—B2—B6—B5 | −36.66 (18) | B1'—B2'—B6'—B5' | 35.84 (18) |
B3—B2—B6—B5 | 2.1 (2) | B3'—B2'—B6'—B5' | −3.5 (2) |
B11—B2—B6—B5 | 101.4 (2) | B11'—B2'—B6'—B5' | −101.8 (2) |
C7—B2—B6—B1 | 101.1 (2) | C7'—B2'—B6'—B1' | −100.79 (19) |
B3—B2—B6—B1 | 38.76 (18) | B3'—B2'—B6'—B1' | −39.29 (18) |
B11—B2—B6—B1 | 138.1 (2) | B11'—B2'—B6'—B1' | −137.66 (19) |
B9—B5—B6—B2 | −64.7 (2) | B9'—B5'—B6'—B2' | 65.6 (2) |
B4—B5—B6—B2 | −1.6 (2) | B4'—B5'—B6'—B2' | 2.8 (2) |
B1—B5—B6—B2 | 36.37 (18) | B1'—B5'—B6'—B2' | −35.75 (18) |
B10—B5—B6—B2 | −105.9 (2) | B10'—B5'—B6'—B2' | 106.8 (2) |
B9—B5—B6—B11 | −1.0 (3) | B9'—B5'—B6'—B11' | 1.3 (3) |
B4—B5—B6—B11 | 62.0 (2) | B4'—B5'—B6'—B11' | −61.4 (2) |
B1—B5—B6—B11 | 100.0 (2) | B1'—B5'—B6'—B11' | −100.0 (2) |
B10—B5—B6—B11 | −42.21 (19) | B10'—B5'—B6'—B11' | 42.57 (19) |
B9—B5—B6—B10 | 41.19 (18) | B9'—B5'—B6'—B10' | −41.24 (18) |
B4—B5—B6—B10 | 104.2 (2) | B4'—B5'—B6'—B10' | −104.0 (2) |
B1—B5—B6—B10 | 142.2 (2) | B1'—B5'—B6'—B10' | −142.54 (19) |
B9—B5—B6—B1 | −101.1 (2) | B9'—B5'—B6'—B1' | 101.3 (2) |
B4—B5—B6—B1 | −38.02 (18) | B4'—B5'—B6'—B1' | 38.55 (18) |
B10—B5—B6—B1 | −142.2 (2) | B10'—B5'—B6'—B1' | 142.54 (19) |
B3—B1—B6—B2 | −37.55 (18) | B5'—B1'—B6'—B2' | 138.97 (19) |
B4—B1—B6—B2 | −100.6 (2) | B4'—B1'—B6'—B2' | 100.8 (2) |
B5—B1—B6—B2 | −138.03 (19) | B3'—B1'—B6'—B2' | 38.01 (17) |
B2—B1—B6—B11 | 37.60 (18) | B2'—B1'—B6'—B11' | −38.17 (18) |
B3—B1—B6—B11 | 0.0 (3) | B5'—B1'—B6'—B11' | 100.8 (2) |
B4—B1—B6—B11 | −63.0 (3) | B4'—B1'—B6'—B11' | 62.6 (2) |
B5—B1—B6—B11 | −100.4 (2) | B3'—B1'—B6'—B11' | −0.2 (3) |
B2—B1—B6—B10 | 103.8 (2) | B2'—B1'—B6'—B10' | −104.9 (2) |
B3—B1—B6—B10 | 66.2 (3) | B5'—B1'—B6'—B10' | 34.02 (18) |
B4—B1—B6—B10 | 3.2 (3) | B4'—B1'—B6'—B10' | −4.2 (3) |
B5—B1—B6—B10 | −34.27 (19) | B3'—B1'—B6'—B10' | −66.9 (2) |
B2—B1—B6—B5 | 138.03 (19) | B2'—B1'—B6'—B5' | −138.97 (19) |
B3—B1—B6—B5 | 100.5 (2) | B4'—B1'—B6'—B5' | −38.18 (18) |
B4—B1—B6—B5 | 37.43 (18) | B3'—B1'—B6'—B5' | −101.0 (2) |
B1—B2—C7—C71 | −147.6 (2) | B1'—B2'—C7'—C71' | 148.5 (2) |
B3—B2—C7—C71 | −106.8 (2) | B3'—B2'—C7'—C71' | 107.2 (2) |
B6—B2—C7—C71 | 148.1 (2) | B6'—B2'—C7'—C71' | −147.7 (2) |
B11—B2—C7—C71 | 109.2 (2) | B11'—B2'—C7'—C71' | −109.0 (2) |
B1—B2—C7—C8 | 0.5 (3) | B1'—B2'—C7'—C8' | 0.1 (2) |
B3—B2—C7—C8 | 41.32 (18) | B3'—B2'—C7'—C8' | −41.16 (18) |
B6—B2—C7—C8 | −63.8 (2) | B6'—B2'—C7'—C8' | 64.0 (2) |
B11—B2—C7—C8 | −102.7 (2) | B11'—B2'—C7'—C8' | 102.7 (2) |
B1—B2—C7—B11 | 103.1 (2) | B1'—B2'—C7'—B11' | −102.5 (2) |
B3—B2—C7—B11 | 144.0 (2) | B3'—B2'—C7'—B11' | −143.82 (19) |
B6—B2—C7—B11 | 38.90 (18) | B6'—B2'—C7'—B11' | −38.69 (17) |
B1—B2—C7—B3 | −40.83 (19) | B1'—B2'—C7'—B3' | 41.29 (18) |
B6—B2—C7—B3 | −105.1 (2) | B6'—B2'—C7'—B3' | 105.1 (2) |
B11—B2—C7—B3 | −144.0 (2) | B11'—B2'—C7'—B3' | 143.82 (19) |
C8—B3—C7—C71 | −110.2 (2) | C8'—B3'—C7'—C71' | 112.2 (2) |
B2—B3—C7—C71 | 113.3 (2) | B2'—B3'—C7'—C71' | −111.0 (2) |
B4—B3—C7—C71 | −144.6 (2) | B4'—B3'—C7'—C71' | 146.57 (18) |
B1—B3—C7—C71 | 153.0 (2) | B1'—B3'—C7'—C71' | −151.32 (19) |
B2—B3—C7—C8 | −136.5 (2) | B2'—B3'—C7'—C8' | 136.75 (19) |
B4—B3—C7—C8 | −34.39 (17) | B4'—B3'—C7'—C8' | 34.33 (16) |
B1—B3—C7—C8 | −96.72 (19) | B1'—B3'—C7'—C8' | 96.44 (19) |
C8—B3—C7—B11 | 100.0 (2) | C8'—B3'—C7'—B11' | −100.1 (2) |
B2—B3—C7—B11 | −36.4 (2) | B2'—B3'—C7'—B11' | 36.64 (19) |
B4—B3—C7—B11 | 65.6 (2) | B4'—B3'—C7'—B11' | −65.8 (2) |
B1—B3—C7—B11 | 3.3 (3) | B1'—B3'—C7'—B11' | −3.7 (2) |
C8—B3—C7—B2 | 136.5 (2) | C8'—B3'—C7'—B2' | −136.75 (19) |
B4—B3—C7—B2 | 102.1 (2) | B4'—B3'—C7'—B2' | −102.4 (2) |
B1—B3—C7—B2 | 39.75 (18) | B1'—B3'—C7'—B2' | −40.31 (17) |
C71—C7—C8—C81 | 0.1 (3) | C71'—C7'—C8'—C81' | 0.1 (3) |
B11—C7—C8—C81 | 141.1 (2) | B11'—C7'—C8'—C81' | −141.80 (19) |
B2—C7—C8—C81 | −149.11 (19) | B2'—C7'—C8'—C81' | 148.25 (19) |
B3—C7—C8—C81 | −108.6 (2) | B3'—C7'—C8'—C81' | 107.8 (2) |
C71—C7—C8—B9 | −145.5 (2) | C71'—C7'—C8'—B9' | 146.5 (2) |
B11—C7—C8—B9 | −4.5 (2) | B11'—C7'—C8'—B9' | 4.6 (2) |
B2—C7—C8—B9 | 65.3 (2) | B2'—C7'—C8'—B9' | −65.4 (2) |
B3—C7—C8—B9 | 105.8 (2) | B3'—C7'—C8'—B9' | −105.8 (2) |
C71—C7—C8—B3 | 108.7 (2) | C71'—C7'—C8'—B3' | −107.8 (2) |
B11—C7—C8—B3 | −110.3 (2) | B11'—C7'—C8'—B3' | 110.35 (19) |
B2—C7—C8—B3 | −40.51 (18) | B2'—C7'—C8'—B3' | 40.40 (18) |
C71—C7—C8—B4 | 145.3 (2) | C71'—C7'—C8'—B4' | −144.5 (2) |
B11—C7—C8—B4 | −73.7 (2) | B11'—C7'—C8'—B4' | 73.6 (2) |
B2—C7—C8—B4 | −3.9 (2) | B2'—C7'—C8'—B4' | 3.6 (2) |
B3—C7—C8—B4 | 36.64 (18) | B3'—C7'—C8'—B4' | −36.76 (17) |
C7—B3—C8—C81 | 107.9 (2) | C7'—B3'—C8'—C81' | −107.7 (2) |
B2—B3—C8—C81 | 144.9 (2) | B2'—B3'—C8'—C81' | −144.62 (19) |
B4—B3—C8—C81 | −111.4 (2) | B4'—B3'—C8'—C81' | 111.7 (2) |
B1—B3—C8—C81 | −154.1 (2) | B1'—B3'—C8'—C81' | 154.24 (19) |
B2—B3—C8—C7 | 36.92 (17) | B2'—B3'—C8'—C7' | −36.94 (16) |
B4—B3—C8—C7 | 140.7 (2) | B4'—B3'—C8'—C7' | −140.64 (18) |
B1—B3—C8—C7 | 97.99 (19) | B1'—B3'—C8'—C7' | −98.07 (19) |
C7—B3—C8—B9 | −105.2 (2) | C7'—B3'—C8'—B9' | 104.9 (2) |
B2—B3—C8—B9 | −68.3 (2) | B2'—B3'—C8'—B9' | 68.0 (2) |
B4—B3—C8—B9 | 35.51 (19) | B4'—B3'—C8'—B9' | −35.70 (19) |
B1—B3—C8—B9 | −7.2 (2) | B1'—B3'—C8'—B9' | 6.9 (2) |
C7—B3—C8—B4 | −140.70 (19) | C7'—B3'—C8'—B4' | 140.64 (18) |
B2—B3—C8—B4 | −103.8 (2) | B2'—B3'—C8'—B4' | 103.71 (19) |
B1—B3—C8—B4 | −42.71 (17) | B1'—B3'—C8'—B4' | 42.57 (17) |
B9—B4—C8—C81 | −109.5 (2) | B9'—B4'—C8'—C81' | 110.5 (2) |
B5—B4—C8—C81 | −148.6 (2) | B5'—B4'—C8'—C81' | 149.4 (2) |
B3—B4—C8—C81 | 107.0 (2) | B3'—B4'—C8'—C81' | −106.2 (2) |
B1—B4—C8—C81 | 149.4 (2) | B1'—B4'—C8'—C81' | −148.9 (2) |
B9—B4—C8—C7 | 106.5 (2) | B9'—B4'—C8'—C7' | −106.3 (2) |
B5—B4—C8—C7 | 67.4 (2) | B5'—B4'—C8'—C7' | −67.4 (2) |
B3—B4—C8—C7 | −37.05 (18) | B3'—B4'—C8'—C7' | 37.05 (18) |
B1—B4—C8—C7 | 5.4 (2) | B1'—B4'—C8'—C7' | −5.7 (2) |
B5—B4—C8—B9 | −39.12 (17) | B5'—B4'—C8'—B9' | 38.89 (17) |
B3—B4—C8—B9 | −143.5 (2) | B3'—B4'—C8'—B9' | 143.30 (19) |
B1—B4—C8—B9 | −101.1 (2) | B1'—B4'—C8'—B9' | 100.6 (2) |
B9—B4—C8—B3 | 143.5 (2) | B9'—B4'—C8'—B3' | −143.30 (19) |
B5—B4—C8—B3 | 104.4 (2) | B5'—B4'—C8'—B3' | −104.4 (2) |
B1—B4—C8—B3 | 42.49 (18) | B1'—B4'—C8'—B3' | −42.74 (17) |
C81—C8—B9—B5 | 152.4 (2) | C81'—C8'—B9'—B5' | −152.2 (2) |
C7—C8—B9—B5 | −62.6 (2) | C7'—C8'—B9'—B5' | 62.5 (2) |
B3—C8—B9—B5 | 6.1 (2) | B3'—C8'—B9'—B5' | −5.9 (3) |
B4—C8—B9—B5 | 40.78 (18) | B4'—C8'—B9'—B5' | −40.93 (18) |
C81—C8—B9—B4 | 111.7 (2) | C81'—C8'—B9'—B4' | −111.3 (2) |
C7—C8—B9—B4 | −103.39 (19) | C7'—C8'—B9'—B4' | 103.44 (19) |
B3—C8—B9—B4 | −34.73 (19) | B3'—C8'—B9'—B4' | 35.01 (18) |
C81—C8—B9—B10 | −142.6 (2) | C81'—C8'—B9'—B10' | 142.6 (2) |
C7—C8—B9—B10 | 2.4 (2) | C7'—C8'—B9'—B10' | −2.6 (2) |
B3—C8—B9—B10 | 71.0 (2) | B3'—C8'—B9'—B10' | −71.0 (2) |
B4—C8—B9—B10 | 105.8 (2) | B4'—C8'—B9'—B10' | −106.1 (2) |
C81—C8—B9—S9 | 9.9 (3) | C81'—C8'—B9'—S9' | −7.6 (3) |
C7—C8—B9—S9 | 154.85 (16) | C7'—C8'—B9'—S9' | −152.85 (16) |
B3—C8—B9—S9 | −136.49 (17) | B3'—C8'—B9'—S9' | 138.72 (17) |
B4—C8—B9—S9 | −101.76 (19) | B4'—C8'—B9'—S9' | 103.7 (2) |
B4—B5—B9—C8 | −41.76 (18) | B4'—B5'—B9'—C8' | 41.56 (18) |
B1—B5—B9—C8 | −2.2 (3) | B1'—B5'—B9'—C8' | 2.3 (3) |
B6—B5—B9—C8 | 61.1 (2) | B10'—B5'—B9'—C8' | −102.1 (2) |
B10—B5—B9—C8 | 102.2 (2) | B6'—B5'—B9'—C8' | −61.2 (2) |
B1—B5—B9—B4 | 39.52 (19) | B1'—B5'—B9'—B4' | −39.26 (18) |
B6—B5—B9—B4 | 102.9 (2) | B10'—B5'—B9'—B4' | −143.7 (2) |
B10—B5—B9—B4 | 143.9 (2) | B6'—B5'—B9'—B4' | −102.7 (2) |
B4—B5—B9—B10 | −143.9 (2) | B4'—B5'—B9'—B10' | 143.7 (2) |
B1—B5—B9—B10 | −104.4 (2) | B1'—B5'—B9'—B10' | 104.4 (2) |
B6—B5—B9—B10 | −41.07 (18) | B6'—B5'—B9'—B10' | 40.94 (18) |
B4—B5—B9—S9 | 97.7 (2) | B4'—B5'—B9'—S9' | −100.9 (2) |
B1—B5—B9—S9 | 137.26 (19) | B1'—B5'—B9'—S9' | −140.18 (19) |
B6—B5—B9—S9 | −159.41 (18) | B10'—B5'—B9'—S9' | 115.4 (2) |
B10—B5—B9—S9 | −118.3 (2) | B6'—B5'—B9'—S9' | 156.34 (18) |
B5—B4—B9—C8 | 134.19 (19) | B5'—B4'—B9'—C8' | −134.34 (19) |
B3—B4—B9—C8 | 32.01 (17) | B3'—B4'—B9'—C8' | −32.28 (17) |
B1—B4—B9—C8 | 94.6 (2) | B1'—B4'—B9'—C8' | −95.25 (19) |
C8—B4—B9—B5 | −134.19 (19) | C8'—B4'—B9'—B5' | 134.34 (19) |
B3—B4—B9—B5 | −102.2 (2) | B3'—B4'—B9'—B5' | 102.1 (2) |
B1—B4—B9—B5 | −39.56 (19) | B1'—B4'—B9'—B5' | 39.09 (18) |
C8—B4—B9—B10 | −100.3 (2) | C8'—B4'—B9'—B10' | 100.1 (2) |
B5—B4—B9—B10 | 33.93 (19) | B5'—B4'—B9'—B10' | −34.27 (19) |
B3—B4—B9—B10 | −68.3 (2) | B3'—B4'—B9'—B10' | 67.8 (2) |
B1—B4—B9—B10 | −5.6 (3) | B1'—B4'—B9'—B10' | 4.8 (3) |
C8—B4—B9—S9 | 109.26 (18) | C8'—B4'—B9'—S9' | −110.08 (18) |
B5—B4—B9—S9 | −116.54 (19) | B5'—B4'—B9'—S9' | 115.58 (19) |
B3—B4—B9—S9 | 141.27 (17) | B3'—B4'—B9'—S9' | −142.36 (16) |
B1—B4—B9—S9 | −156.10 (17) | B1'—B4'—B9'—S9' | 154.67 (16) |
C8—B9—B10—B6 | −59.5 (2) | C8'—B9'—B10'—B6' | 59.4 (2) |
B5—B9—B10—B6 | 40.89 (18) | B5'—B9'—B10'—B6' | −41.19 (18) |
B4—B9—B10—B6 | 7.4 (3) | B4'—B9'—B10'—B6' | −7.2 (2) |
S9—B9—B10—B6 | 152.04 (18) | S9'—B9'—B10'—B6' | −153.04 (18) |
C8—B9—B10—B5 | −100.4 (2) | C8'—B9'—B10'—B5' | 100.6 (2) |
B4—B9—B10—B5 | −33.50 (19) | B4'—B9'—B10'—B5' | 33.97 (19) |
S9—B9—B10—B5 | 111.2 (2) | S9'—B9'—B10'—B5' | −111.8 (2) |
C8—B9—B10—B11 | 0.5 (2) | C8'—B9'—B10'—B11' | −0.2 (2) |
B5—B9—B10—B11 | 100.8 (2) | B5'—B9'—B10'—B11' | −100.81 (19) |
B4—B9—B10—B11 | 67.3 (2) | B4'—B9'—B10'—B11' | −66.8 (2) |
S9—B9—B10—B11 | −147.99 (18) | S9'—B9'—B10'—B11' | 147.35 (18) |
B2—B6—B10—B9 | 56.5 (3) | B2'—B6'—B10'—B9' | −56.4 (2) |
B11—B6—B10—B9 | 93.6 (2) | B11'—B6'—B10'—B9' | −93.49 (19) |
B5—B6—B10—B9 | −40.14 (17) | B5'—B6'—B10'—B9' | 40.25 (17) |
B1—B6—B10—B9 | −6.3 (3) | B1'—B6'—B10'—B9' | 6.8 (2) |
B2—B6—B10—B5 | 96.7 (2) | B2'—B6'—B10'—B5' | −96.6 (2) |
B11—B6—B10—B5 | 133.7 (2) | B11'—B6'—B10'—B5' | −133.74 (19) |
B1—B6—B10—B5 | 33.87 (19) | B1'—B6'—B10'—B5' | −33.49 (18) |
B2—B6—B10—B11 | −37.05 (19) | B2'—B6'—B10'—B11' | 37.12 (18) |
B5—B6—B10—B11 | −133.7 (2) | B5'—B6'—B10'—B11' | 133.74 (19) |
B1—B6—B10—B11 | −99.9 (2) | B1'—B6'—B10'—B11' | 100.3 (2) |
B4—B5—B10—B9 | 33.20 (19) | B4'—B5'—B10'—B9' | −33.30 (18) |
B1—B5—B10—B9 | 98.1 (2) | B1'—B5'—B10'—B9' | −98.1 (2) |
B6—B5—B10—B9 | 132.8 (2) | B6'—B5'—B10'—B9' | −132.6 (2) |
B9—B5—B10—B6 | −132.8 (2) | B9'—B5'—B10'—B6' | 132.6 (2) |
B4—B5—B10—B6 | −99.6 (2) | B4'—B5'—B10'—B6' | 99.3 (2) |
B1—B5—B10—B6 | −34.74 (19) | B1'—B5'—B10'—B6' | 34.56 (18) |
B9—B5—B10—B11 | −93.22 (19) | B9'—B5'—B10'—B11' | 93.24 (19) |
B4—B5—B10—B11 | −60.0 (2) | B4'—B5'—B10'—B11' | 59.9 (2) |
B1—B5—B10—B11 | 4.8 (2) | B1'—B5'—B10'—B11' | −4.8 (2) |
B6—B5—B10—B11 | 39.59 (17) | B6'—B5'—B10'—B11' | −39.40 (17) |
C71—C7—B11—B6 | −152.8 (2) | C71'—C7'—B11'—B6' | 151.12 (19) |
C8—C7—B11—B6 | 66.1 (2) | C8'—C7'—B11'—B6' | −65.9 (2) |
B2—C7—B11—B6 | −38.55 (18) | B2'—C7'—B11'—B6' | 39.07 (17) |
B3—C7—B11—B6 | −3.3 (3) | B3'—C7'—B11'—B6' | 3.6 (3) |
C71—C7—B11—B2 | −114.2 (2) | C71'—C7'—B11'—B2' | 112.0 (2) |
C8—C7—B11—B2 | 104.7 (2) | C8'—C7'—B11'—B2' | −104.95 (19) |
B3—C7—B11—B2 | 35.27 (19) | B3'—C7'—B11'—B2' | −35.49 (18) |
C71—C7—B11—B10 | 145.7 (2) | C71'—C7'—B11'—B10' | −147.44 (19) |
C8—C7—B11—B10 | 4.5 (2) | C8'—C7'—B11'—B10' | −4.4 (2) |
B2—C7—B11—B10 | −100.1 (2) | B2'—C7'—B11'—B10' | 100.52 (19) |
B3—C7—B11—B10 | −64.8 (2) | B3'—C7'—B11'—B10' | 65.0 (2) |
B2—B6—B11—C7 | 38.44 (17) | B2'—B6'—B11'—C7' | −38.99 (17) |
B10—B6—B11—C7 | −101.5 (2) | B10'—B6'—B11'—C7' | 101.40 (19) |
B5—B6—B11—C7 | −60.4 (2) | B5'—B6'—B11'—C7' | 60.2 (2) |
B1—B6—B11—C7 | 1.8 (2) | B1'—B6'—B11'—C7' | −1.9 (2) |
B10—B6—B11—B2 | −140.0 (2) | B10'—B6'—B11'—B2' | 140.39 (19) |
B5—B6—B11—B2 | −98.9 (2) | B5'—B6'—B11'—B2' | 99.2 (2) |
B1—B6—B11—B2 | −36.62 (18) | B1'—B6'—B11'—B2' | 37.08 (18) |
B2—B6—B11—B10 | 140.0 (2) | B2'—B6'—B11'—B10' | −140.39 (19) |
B5—B6—B11—B10 | 41.09 (19) | B5'—B6'—B11'—B10' | −41.23 (18) |
B1—B6—B11—B10 | 103.3 (2) | B1'—B6'—B11'—B10' | −103.3 (2) |
B1—B2—B11—C7 | −96.7 (2) | B1'—B2'—B11'—C7' | 96.2 (2) |
B3—B2—B11—C7 | −32.14 (18) | B3'—B2'—B11'—C7' | 31.95 (17) |
B6—B2—B11—C7 | −135.4 (2) | B6'—B2'—B11'—C7' | 135.00 (19) |
C7—B2—B11—B6 | 135.4 (2) | C7'—B2'—B11'—B6' | −135.00 (19) |
B1—B2—B11—B6 | 38.72 (19) | B1'—B2'—B11'—B6' | −38.81 (18) |
B3—B2—B11—B6 | 103.2 (2) | B3'—B2'—B11'—B6' | −103.1 (2) |
C7—B2—B11—B10 | 100.1 (2) | C7'—B2'—B11'—B10' | −100.11 (19) |
B1—B2—B11—B10 | 3.5 (3) | B1'—B2'—B11'—B10' | −3.9 (2) |
B3—B2—B11—B10 | 68.0 (2) | B3'—B2'—B11'—B10' | −68.2 (2) |
B6—B2—B11—B10 | −35.26 (18) | B6'—B2'—B11'—B10' | 34.89 (17) |
B9—B10—B11—C7 | −3.0 (2) | B9'—B10'—B11'—C7' | 2.7 (2) |
B6—B10—B11—C7 | 97.2 (2) | B6'—B10'—B11'—C7' | −97.5 (2) |
B5—B10—B11—C7 | 56.9 (2) | B5'—B10'—B11'—C7' | −57.1 (2) |
B9—B10—B11—B6 | −100.2 (2) | B9'—B10'—B11'—B6' | 100.2 (2) |
B5—B10—B11—B6 | −40.28 (18) | B5'—B10'—B11'—B6' | 40.40 (18) |
B9—B10—B11—B2 | −64.9 (2) | B9'—B10'—B11'—B2' | 65.1 (2) |
B6—B10—B11—B2 | 35.30 (18) | B6'—B10'—B11'—B2' | −35.14 (17) |
B5—B10—B11—B2 | −5.0 (2) | B5'—B10'—B11'—B2' | 5.3 (2) |
C8—C7—C71—C76 | 94.3 (3) | C8'—C7'—C71'—C72' | 98.0 (3) |
B11—C7—C71—C76 | −43.3 (3) | B11'—C7'—C71'—C72' | −123.0 (2) |
B2—C7—C71—C76 | −120.0 (3) | B2'—C7'—C71'—C72' | −47.5 (3) |
B3—C7—C71—C76 | 167.7 (2) | B3'—C7'—C71'—C72' | 24.2 (3) |
C8—C7—C71—C72 | −86.5 (3) | C8'—C7'—C71'—C76' | −86.9 (3) |
B11—C7—C71—C72 | 136.0 (2) | B11'—C7'—C71'—C76' | 52.1 (3) |
B2—C7—C71—C72 | 59.3 (3) | B2'—C7'—C71'—C76' | 127.7 (2) |
B3—C7—C71—C72 | −13.1 (3) | B3'—C7'—C71'—C76' | −160.73 (19) |
C76—C71—C72—C73 | −1.3 (4) | C76'—C71'—C72'—C73' | −0.5 (3) |
C7—C71—C72—C73 | 179.5 (2) | C7'—C71'—C72'—C73' | 174.6 (2) |
C71—C72—C73—C74 | −0.5 (5) | C71'—C72'—C73'—C74' | −0.1 (4) |
C72—C73—C74—C75 | 1.6 (5) | C72'—C73'—C74'—C75' | 0.9 (4) |
C73—C74—C75—C76 | −1.1 (5) | C73'—C74'—C75'—C76' | −1.2 (4) |
C72—C71—C76—C75 | 1.8 (4) | C74'—C75'—C76'—C71' | 0.6 (4) |
C7—C71—C76—C75 | −178.9 (2) | C72'—C71'—C76'—C75' | 0.3 (3) |
C74—C75—C76—C71 | −0.7 (5) | C7'—C71'—C76'—C75' | −175.0 (2) |
C7—C8—C81—C82 | 109.2 (2) | C7'—C8'—C81'—C82' | −104.6 (3) |
B9—C8—C81—C82 | −107.1 (2) | B9'—C8'—C81'—C82' | 111.3 (3) |
B3—C8—C81—C82 | 38.1 (3) | B3'—C8'—C81'—C82' | −34.1 (3) |
B4—C8—C81—C82 | −32.9 (3) | B4'—C8'—C81'—C82' | 36.9 (3) |
C7—C8—C81—C86 | −72.8 (3) | C7'—C8'—C81'—C86' | 77.4 (3) |
B9—C8—C81—C86 | 70.9 (3) | B9'—C8'—C81'—C86' | −66.8 (3) |
B3—C8—C81—C86 | −143.9 (2) | B3'—C8'—C81'—C86' | 147.9 (2) |
B4—C8—C81—C86 | 145.1 (2) | B4'—C8'—C81'—C86' | −141.2 (2) |
C86—C81—C82—C83 | −0.6 (3) | C86'—C81'—C82'—C83' | −0.2 (4) |
C8—C81—C82—C83 | 177.5 (2) | C8'—C81'—C82'—C83' | −178.2 (2) |
C81—C82—C83—C84 | 0.9 (4) | C81'—C82'—C83'—C84' | 0.0 (4) |
C82—C83—C84—C85 | −0.3 (4) | C82'—C83'—C84'—C85' | −0.1 (4) |
C83—C84—C85—C86 | −0.6 (4) | C83'—C84'—C85'—C86' | 0.4 (4) |
C84—C85—C86—C81 | 0.9 (4) | C84'—C85'—C86'—C81' | −0.5 (4) |
C82—C81—C86—C85 | −0.3 (3) | C82'—C81'—C86'—C85' | 0.4 (4) |
C8—C81—C86—C85 | −178.5 (2) | C8'—C81'—C86'—C85' | 178.6 (2) |
C8—B9—S9—C92 | 155.50 (18) | C8'—B9'—S9'—C92' | −146.0 (2) |
B5—B9—S9—C92 | 19.1 (2) | B5'—B9'—S9'—C92' | −7.0 (3) |
B4—B9—S9—C92 | 86.80 (18) | B4'—B9'—S9'—C92' | −76.3 (2) |
B10—B9—S9—C92 | −58.0 (2) | B10'—B9'—S9'—C92' | 69.1 (2) |
C8—B9—S9—C91 | −100.21 (19) | C8'—B9'—S9'—C91' | 108.6 (2) |
B5—B9—S9—C91 | 123.4 (2) | B5'—B9'—S9'—C91' | −112.4 (2) |
B4—B9—S9—C91 | −168.90 (17) | B4'—B9'—S9'—C91' | 178.2 (2) |
B10—B9—S9—C91 | 46.3 (2) | B10'—B9'—S9'—C91' | −36.4 (3) |
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