The Fe–C system, which is widely used to grow commercial high-pressure–high-temperature diamond monocrystals, is rather complicated due to the formation of carbides. The carbide Fe3C is a normal run product, but the pressure at which Fe7C3 carbide becomes stable is a subject of discussion. This paper demonstrates the synthesis of Fe7C3 carbide and its detailed study using single-crystal and powder X-ray diffraction, as well as electron probe micro-analysis and scanning electron microscopy. The experiments were performed using a multiple-anvil high-pressure apparatus of `split-sphere' (BARS) type at a pressure of 5.5 GPa and a temperature of 1623 K. Our results show that in the Fe–C system, in addition to diamond, a phase that corresponds to the Fe7C3 carbide was synthesized. This means that both carbides (Fe7C3 and Fe3C) are stable at 5.5 GPa. Two crystal phases are described, Fe14C6 and Fe28C12−x. Fe14C6 is based on the well known rhombic structure of Fe7C3, while Fe28C12−x has a different packing order of Fe6C polyhedrons. The results obtained in this study should be taken into account when synthesizing and growing diamond at high pressures and temperatures in metal–carbon systems with a high iron content, as well as when conducting experimental studies on the synthesis of diamond directly from carbide.
Supporting information
CCDC references: 1950083; 1956500
For both structures, data collection: Bruker APEX2 V2013.6-2; cell refinement: Bruker SAINT V8.32B; data reduction: Bruker SAINT V8.32B; program(s) used to solve structure: SHELXT 2014/5. Program(s) used to refine structure: SHELXL 2018/3 for (I); olex2.refine (Bourhis et al., 2015) for (II). For both structures, molecular graphics: Olex2 (Dolomanov et al., 2009); software used to prepare material for publication: Olex2 (Dolomanov et al., 2009).
Crystal data top
C6Fe14 | Dx = 7.609 Mg m−3 |
Mr = 853.96 | Mo Kα radiation, λ = 0.71073 Å |
Orthorhombic, Pbca | Cell parameters from 4135 reflections |
a = 11.9698 (6) Å | θ = 3.4–33.2° |
b = 4.5240 (2) Å | µ = 26.26 mm−1 |
c = 13.7658 (6) Å | T = 298 K |
V = 745.44 (6) Å3 | Block, metallic light gray |
Z = 4 | 0.12 × 0.08 × 0.04 mm |
F(000) = 1600 | |
Data collection top
Bruker APEX-II CCD diffractometer | 1268 reflections with I > 2σ(I) |
Detector resolution: 25 pixels mm-1 | Rint = 0.029 |
φ and ω scans | θmax = 33.2°, θmin = 3.0° |
Absorption correction: multi-scan SADABS-2012/1 (Bruker,2012) was used for absorption correction. wR2(int)
was 0.1120 before and 0.0329 after correction. The Ratio of minimum to
maximum transmission is 0.5837. The λ/2 correction factor is 0.0015. | h = −16→18 |
Tmin = 0.436, Tmax = 0.747 | k = −6→6 |
6522 measured reflections | l = −21→10 |
1428 independent reflections | |
Refinement top
Refinement on F2 | Primary atom site location: dual |
Least-squares matrix: full | w = 1/[σ2(Fo2) + (0.036P)2 + 1.365P] where P = (Fo2 + 2Fc2)/3 |
R[F2 > 2σ(F2)] = 0.025 | (Δ/σ)max = 0.001 |
wR(F2) = 0.066 | Δρmax = 1.83 e Å−3 |
S = 1.09 | Δρmin = −0.84 e Å−3 |
1428 reflections | Extinction correction: SHELXL-2018/3 (Sheldrick 2018), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
92 parameters | Extinction coefficient: 0.0031 (2) |
0 restraints | |
Special details top
Geometry. All esds (except the esd in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell esds are taken
into account individually in the estimation of esds in distances, angles
and torsion angles; correlations between esds in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell esds is used for estimating esds 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 > 2sigma(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. |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top | x | y | z | Uiso*/Ueq | |
Fe1 | 0.58215 (3) | 0.24110 (7) | 0.37329 (2) | 0.00332 (10) | |
Fe2 | 0.31084 (3) | 0.57276 (7) | 0.46759 (2) | 0.00412 (10) | |
Fe3 | 0.31312 (3) | 0.56322 (7) | 0.28399 (2) | 0.00430 (9) | |
Fe4 | 0.12724 (3) | 0.56340 (8) | 0.37470 (2) | 0.00425 (10) | |
Fe5 | 0.47545 (3) | 0.25065 (7) | 0.53109 (2) | 0.00425 (10) | |
Fe6 | 0.29253 (3) | 0.25177 (7) | 0.62536 (2) | 0.00410 (10) | |
Fe7 | 0.47666 (3) | 0.22765 (7) | 0.21469 (2) | 0.00433 (10) | |
C3 | 0.3411 (2) | 0.9648 (5) | 0.23224 (17) | 0.0093 (4) | |
C1 | 0.4392 (2) | 0.4646 (6) | 0.38006 (16) | 0.0084 (4) | |
C2 | 0.3435 (2) | 0.9697 (5) | 0.51866 (17) | 0.0083 (4) | |
Atomic displacement parameters (Å2) top | U11 | U22 | U33 | U12 | U13 | U23 |
Fe1 | 0.00189 (17) | 0.00476 (18) | 0.00332 (17) | 0.00025 (9) | 0.00002 (9) | 0.00030 (9) |
Fe2 | 0.00240 (16) | 0.00623 (16) | 0.00373 (15) | 0.00019 (10) | 0.00014 (10) | −0.00011 (10) |
Fe3 | 0.00255 (15) | 0.00655 (16) | 0.00381 (15) | 0.00010 (10) | −0.00005 (10) | 0.00006 (10) |
Fe4 | 0.00259 (16) | 0.00629 (17) | 0.00389 (16) | 0.00011 (11) | 0.00026 (9) | 0.00001 (9) |
Fe5 | 0.00433 (17) | 0.00416 (16) | 0.00428 (16) | −0.00033 (10) | 0.00074 (11) | −0.00050 (9) |
Fe6 | 0.00269 (17) | 0.00385 (17) | 0.00577 (18) | −0.00001 (9) | 0.00005 (9) | −0.00047 (9) |
Fe7 | 0.00374 (16) | 0.00477 (16) | 0.00448 (16) | 0.00040 (10) | −0.00079 (11) | 0.00063 (9) |
C3 | 0.0096 (10) | 0.0095 (9) | 0.0089 (10) | 0.0013 (8) | 0.0022 (8) | 0.0003 (7) |
C1 | 0.0040 (10) | 0.0095 (10) | 0.0118 (10) | −0.0005 (8) | 0.0009 (7) | −0.0003 (7) |
C2 | 0.0089 (10) | 0.0089 (9) | 0.0071 (9) | 0.0001 (8) | −0.0037 (8) | −0.0009 (7) |
Geometric parameters (Å, º) top
Fe1—Fe2i | 2.6735 (4) | Fe3—C3 | 1.980 (2) |
Fe1—Fe3ii | 2.6281 (4) | Fe3—C3iii | 2.029 (3) |
Fe1—Fe4iii | 2.6323 (5) | Fe3—C1 | 2.056 (2) |
Fe1—Fe5 | 2.5203 (5) | Fe4—Fe5x | 2.6461 (5) |
Fe1—Fe5iv | 2.6753 (4) | Fe4—Fe5vii | 2.6198 (4) |
Fe1—Fe6iv | 2.6874 (5) | Fe4—Fe7vii | 2.6363 (5) |
Fe1—Fe6v | 2.5184 (6) | Fe4—Fe7xi | 2.6590 (5) |
Fe1—Fe7 | 2.5229 (5) | Fe4—C3iii | 2.047 (2) |
Fe1—Fe7vi | 2.6091 (4) | Fe4—C1vii | 1.983 (3) |
Fe1—C3ii | 1.994 (2) | Fe4—C2iii | 2.057 (2) |
Fe1—C1 | 1.990 (3) | Fe5—Fe5iv | 2.4943 (6) |
Fe1—C2i | 1.978 (2) | Fe5—Fe5i | 2.4836 (6) |
Fe2—Fe2iii | 2.6903 (4) | Fe5—Fe6 | 2.5451 (5) |
Fe2—Fe3 | 2.5279 (5) | Fe5—Fe7xii | 2.5294 (6) |
Fe2—Fe4vii | 2.6667 (5) | Fe5—C1 | 2.334 (2) |
Fe2—Fe4 | 2.5429 (5) | Fe5—C1i | 2.049 (2) |
Fe2—Fe5i | 2.6801 (5) | Fe5—C2xiii | 2.035 (2) |
Fe2—Fe5 | 2.6019 (5) | Fe5—C2i | 2.482 (3) |
Fe2—Fe6 | 2.6218 (4) | Fe6—Fe6vii | 2.4806 (3) |
Fe2—Fe6vii | 2.6275 (4) | Fe6—Fe6iii | 2.4806 (3) |
Fe2—C1 | 2.013 (2) | Fe6—Fe7xii | 2.5255 (5) |
Fe2—C2 | 1.968 (2) | Fe6—C3xiv | 2.037 (2) |
Fe2—C2iii | 2.031 (2) | Fe6—C3xv | 2.384 (3) |
Fe3—Fe4 | 2.5513 (5) | Fe6—C2xiii | 2.039 (2) |
Fe3—Fe4vii | 2.6813 (4) | Fe6—C2iii | 2.404 (3) |
Fe3—Fe4iii | 2.6799 (4) | Fe7—Fe7vi | 2.5246 (3) |
Fe3—Fe6viii | 2.6585 (4) | Fe7—Fe7ii | 2.5246 (3) |
Fe3—Fe6ix | 2.6191 (4) | Fe7—C3xiii | 2.026 (3) |
Fe3—Fe7vi | 2.6241 (5) | Fe7—C1ii | 2.033 (2) |
Fe3—Fe7 | 2.6546 (5) | | |
| | | |
Fe2i—Fe1—Fe5iv | 88.986 (13) | Fe1—Fe5—Fe4iii | 61.573 (14) |
Fe2i—Fe1—Fe6iv | 89.327 (14) | Fe1—Fe5—Fe6 | 151.100 (19) |
Fe3ii—Fe1—Fe2i | 122.879 (17) | Fe1—Fe5—Fe7xii | 149.203 (18) |
Fe3ii—Fe1—Fe4iii | 111.515 (15) | Fe2—Fe5—Fe4v | 170.185 (18) |
Fe3ii—Fe1—Fe5iv | 105.880 (15) | Fe2—Fe5—Fe4iii | 63.237 (13) |
Fe3ii—Fe1—Fe6iv | 59.027 (12) | Fe4iii—Fe5—Fe4v | 123.457 (14) |
Fe4iii—Fe1—Fe2i | 123.118 (15) | Fe5iv—Fe5—Fe1 | 64.481 (16) |
Fe4iii—Fe1—Fe5iv | 59.802 (13) | Fe5i—Fe5—Fe1 | 66.332 (16) |
Fe4iii—Fe1—Fe6iv | 106.142 (16) | Fe5i—Fe5—Fe2 | 63.555 (16) |
Fe5—Fe1—Fe2i | 62.048 (13) | Fe5iv—Fe5—Fe2 | 124.92 (2) |
Fe5—Fe1—Fe3ii | 163.147 (17) | Fe5i—Fe5—Fe4iii | 96.98 (2) |
Fe5—Fe1—Fe4iii | 61.074 (13) | Fe5iv—Fe5—Fe4v | 61.196 (15) |
Fe5—Fe1—Fe5iv | 57.288 (14) | Fe5i—Fe5—Fe4v | 119.61 (2) |
Fe5—Fe1—Fe6iv | 106.927 (14) | Fe5iv—Fe5—Fe4iii | 62.260 (16) |
Fe5iv—Fe1—Fe6iv | 56.667 (12) | Fe5i—Fe5—Fe5iv | 130.68 (3) |
Fe5—Fe1—Fe7 | 119.51 (2) | Fe5iv—Fe5—Fe6 | 112.30 (2) |
Fe5—Fe1—Fe7vi | 104.413 (15) | Fe5i—Fe5—Fe6 | 112.18 (2) |
Fe6v—Fe1—Fe2i | 60.717 (12) | Fe5i—Fe5—Fe7xii | 107.93 (2) |
Fe6v—Fe1—Fe3ii | 62.162 (12) | Fe5iv—Fe5—Fe7xii | 112.14 (2) |
Fe6v—Fe1—Fe4iii | 162.929 (17) | Fe6—Fe5—Fe2 | 61.233 (13) |
Fe6v—Fe1—Fe5 | 120.011 (16) | Fe6—Fe5—Fe4iii | 90.918 (15) |
Fe6v—Fe1—Fe5iv | 105.350 (15) | Fe6—Fe5—Fe4v | 109.992 (16) |
Fe6v—Fe1—Fe6iv | 56.802 (11) | Fe7xii—Fe5—Fe2 | 108.561 (16) |
Fe6v—Fe1—Fe7vi | 105.213 (15) | Fe7xii—Fe5—Fe4v | 61.782 (13) |
Fe6v—Fe1—Fe7 | 120.475 (16) | Fe7xii—Fe5—Fe4iii | 146.759 (17) |
Fe7—Fe1—Fe2i | 163.021 (16) | Fe7xii—Fe5—Fe6 | 59.694 (13) |
Fe7vi—Fe1—Fe2i | 104.116 (14) | C1—Fe5—Fe1 | 48.21 (6) |
Fe7—Fe1—Fe3ii | 61.213 (13) | C1i—Fe5—Fe1 | 105.82 (7) |
Fe7vi—Fe1—Fe3ii | 90.264 (13) | C1—Fe5—Fe2 | 47.76 (6) |
Fe7—Fe1—Fe4iii | 61.471 (13) | C1i—Fe5—Fe2 | 103.06 (7) |
Fe7vi—Fe1—Fe4iii | 90.238 (15) | C1i—Fe5—Fe4v | 72.70 (7) |
Fe7vi—Fe1—Fe5iv | 149.361 (19) | C1—Fe5—Fe4iii | 46.76 (6) |
Fe7—Fe1—Fe5iv | 106.064 (15) | C1i—Fe5—Fe4iii | 158.08 (7) |
Fe7—Fe1—Fe6iv | 105.386 (14) | C1—Fe5—Fe4v | 141.89 (6) |
Fe7vi—Fe1—Fe6iv | 148.624 (16) | C1i—Fe5—Fe5iv | 131.22 (7) |
Fe7—Fe1—Fe7vi | 58.908 (9) | C1i—Fe5—Fe5i | 61.10 (7) |
C3ii—Fe1—Fe2i | 102.50 (7) | C1—Fe5—Fe5i | 50.22 (6) |
C3ii—Fe1—Fe3ii | 48.37 (7) | C1—Fe5—Fe5iv | 96.62 (6) |
C3ii—Fe1—Fe4iii | 126.78 (7) | C1—Fe5—Fe6 | 107.07 (6) |
C3ii—Fe1—Fe5iv | 154.02 (7) | C1i—Fe5—Fe6 | 97.08 (7) |
C3ii—Fe1—Fe5 | 148.48 (7) | C1i—Fe5—Fe7xii | 51.41 (7) |
C3ii—Fe1—Fe6v | 62.52 (7) | C1—Fe5—Fe7xii | 151.05 (6) |
C3ii—Fe1—Fe6iv | 99.73 (7) | C1i—Fe5—C1 | 111.32 (7) |
C3ii—Fe1—Fe7 | 67.19 (7) | C1i—Fe5—C2i | 88.96 (9) |
C3ii—Fe1—Fe7vi | 50.06 (7) | C1—Fe5—C2i | 94.76 (8) |
C1—Fe1—Fe2i | 102.33 (7) | C2i—Fe5—Fe1 | 46.58 (5) |
C1—Fe1—Fe3ii | 127.19 (6) | C2xiii—Fe5—Fe1 | 108.07 (7) |
C1—Fe1—Fe4iii | 48.40 (7) | C2i—Fe5—Fe2 | 142.51 (6) |
C1—Fe1—Fe5 | 61.00 (7) | C2xiii—Fe5—Fe2 | 74.57 (7) |
C1—Fe1—Fe5iv | 100.25 (7) | C2i—Fe5—Fe4v | 47.16 (5) |
C1—Fe1—Fe6v | 148.54 (8) | C2i—Fe5—Fe4iii | 93.04 (5) |
C1—Fe1—Fe6iv | 154.34 (8) | C2xiii—Fe5—Fe4iii | 50.55 (7) |
C1—Fe1—Fe7 | 67.81 (7) | C2xiii—Fe5—Fe4v | 103.81 (7) |
C1—Fe1—Fe7vi | 50.28 (7) | C2xiii—Fe5—Fe5iv | 65.54 (7) |
C1—Fe1—C3ii | 99.91 (10) | C2xiii—Fe5—Fe5i | 136.25 (7) |
C2i—Fe1—Fe2i | 47.18 (7) | C2i—Fe5—Fe5i | 93.61 (6) |
C2i—Fe1—Fe3ii | 104.91 (7) | C2i—Fe5—Fe5iv | 48.27 (6) |
C2i—Fe1—Fe4iii | 106.00 (7) | C2xiii—Fe5—Fe6 | 51.42 (7) |
C2i—Fe1—Fe5 | 65.68 (7) | C2i—Fe5—Fe6 | 153.22 (6) |
C2i—Fe1—Fe5iv | 49.09 (7) | C2i—Fe5—Fe7xii | 106.64 (5) |
C2i—Fe1—Fe6iv | 48.99 (7) | C2xiii—Fe5—Fe7xii | 96.47 (7) |
C2i—Fe1—Fe6v | 63.31 (7) | C2xiii—Fe5—C1i | 146.09 (10) |
C2i—Fe1—Fe7 | 149.79 (7) | C2xiii—Fe5—C1 | 92.29 (9) |
C2i—Fe1—Fe7vi | 151.29 (7) | C2xiii—Fe5—C2i | 113.81 (7) |
C2i—Fe1—C3ii | 125.81 (11) | Fe1x—Fe6—Fe2iii | 62.560 (13) |
C2i—Fe1—C1 | 126.63 (10) | Fe1x—Fe6—Fe2 | 94.736 (15) |
Fe1i—Fe2—Fe2iii | 121.614 (9) | Fe1x—Fe6—Fe3xii | 95.445 (15) |
Fe1i—Fe2—Fe5i | 56.169 (12) | Fe1x—Fe6—Fe5 | 149.760 (16) |
Fe3—Fe2—Fe1i | 145.019 (16) | Fe1x—Fe6—Fe7xii | 150.288 (16) |
Fe3—Fe2—Fe2iii | 89.512 (9) | Fe2—Fe6—Fe2iii | 61.662 (12) |
Fe3—Fe2—Fe4 | 60.415 (12) | Fe3xii—Fe6—Fe2iii | 124.454 (16) |
Fe3—Fe2—Fe4vii | 62.083 (12) | Fe3xii—Fe6—Fe2 | 169.79 (2) |
Fe3—Fe2—Fe5i | 90.090 (13) | Fe5—Fe6—Fe2 | 60.451 (13) |
Fe3—Fe2—Fe5 | 108.552 (15) | Fe5—Fe6—Fe2iii | 89.027 (14) |
Fe3—Fe2—Fe6vii | 146.800 (16) | Fe5—Fe6—Fe3xii | 110.065 (18) |
Fe3—Fe2—Fe6 | 145.052 (16) | Fe6iii—Fe6—Fe1x | 66.50 (2) |
Fe4vii—Fe2—Fe1i | 89.858 (13) | Fe6vii—Fe6—Fe1x | 65.03 (2) |
Fe4—Fe2—Fe1i | 146.230 (17) | Fe6iii—Fe6—Fe2iii | 61.683 (12) |
Fe4vii—Fe2—Fe2iii | 148.245 (12) | Fe6vii—Fe6—Fe2 | 61.915 (9) |
Fe4—Fe2—Fe2iii | 61.194 (15) | Fe6vii—Fe6—Fe2iii | 95.036 (16) |
Fe4—Fe2—Fe4vii | 90.741 (16) | Fe6iii—Fe6—Fe2 | 122.640 (12) |
Fe4vii—Fe2—Fe5i | 59.325 (12) | Fe6vii—Fe6—Fe3xii | 122.328 (11) |
Fe4—Fe2—Fe5 | 144.494 (17) | Fe6iii—Fe6—Fe3xii | 62.772 (9) |
Fe4—Fe2—Fe5i | 146.437 (16) | Fe6iii—Fe6—Fe5 | 110.565 (16) |
Fe4—Fe2—Fe6 | 109.579 (17) | Fe6vii—Fe6—Fe5 | 110.788 (16) |
Fe4—Fe2—Fe6vii | 90.793 (14) | Fe6iii—Fe6—Fe6vii | 131.53 (3) |
Fe5—Fe2—Fe1i | 62.506 (13) | Fe6vii—Fe6—Fe7xii | 108.940 (17) |
Fe5i—Fe2—Fe2iii | 140.117 (16) | Fe6iii—Fe6—Fe7xii | 113.067 (17) |
Fe5—Fe2—Fe2iii | 86.505 (12) | Fe7xii—Fe6—Fe2iii | 145.566 (18) |
Fe5—Fe2—Fe4vii | 114.633 (16) | Fe7xii—Fe6—Fe2 | 108.060 (18) |
Fe5—Fe2—Fe5i | 56.072 (14) | Fe7xii—Fe6—Fe3xii | 62.096 (13) |
Fe5—Fe2—Fe6 | 58.316 (14) | Fe7xii—Fe6—Fe5 | 59.843 (16) |
Fe5—Fe2—Fe6vii | 104.567 (16) | C3xv—Fe6—Fe1x | 47.91 (6) |
Fe6—Fe2—Fe1i | 62.341 (12) | C3xiv—Fe6—Fe1x | 105.80 (7) |
Fe6vii—Fe2—Fe1i | 56.721 (14) | C3xiv—Fe6—Fe2iii | 157.78 (7) |
Fe6vii—Fe2—Fe2iii | 90.243 (14) | C3xiv—Fe6—Fe2 | 103.05 (7) |
Fe6—Fe2—Fe2iii | 59.273 (9) | C3xv—Fe6—Fe2iii | 93.87 (6) |
Fe6vii—Fe2—Fe4vii | 105.705 (14) | C3xv—Fe6—Fe2 | 142.64 (6) |
Fe6—Fe2—Fe4vii | 151.821 (16) | C3xiv—Fe6—Fe3xii | 73.35 (7) |
Fe6—Fe2—Fe5i | 103.843 (16) | C3xv—Fe6—Fe3xii | 47.55 (6) |
Fe6vii—Fe2—Fe5i | 110.609 (15) | C3xiv—Fe6—Fe5 | 97.11 (7) |
Fe6—Fe2—Fe6vii | 56.401 (11) | C3xv—Fe6—Fe5 | 153.02 (6) |
C1—Fe2—Fe1i | 101.61 (7) | C3xiv—Fe6—Fe6vii | 62.81 (7) |
C1—Fe2—Fe2iii | 102.06 (7) | C3xv—Fe6—Fe6vii | 95.69 (6) |
C1—Fe2—Fe3 | 52.35 (7) | C3xv—Fe6—Fe6iii | 49.45 (6) |
C1—Fe2—Fe4vii | 72.73 (7) | C3xiv—Fe6—Fe6iii | 133.75 (7) |
C1—Fe2—Fe4 | 110.77 (7) | C3xv—Fe6—Fe7xii | 107.48 (6) |
C1—Fe2—Fe5i | 49.30 (7) | C3xiv—Fe6—Fe7xii | 51.37 (7) |
C1—Fe2—Fe5 | 59.13 (7) | C3xiv—Fe6—C3xv | 90.27 (11) |
C1—Fe2—Fe6 | 115.15 (7) | C3xv—Fe6—C2iii | 95.21 (9) |
C1—Fe2—Fe6vii | 158.29 (7) | C3xiv—Fe6—C2iii | 112.13 (9) |
C1—Fe2—C2iii | 147.75 (10) | C3xiv—Fe6—C2xiii | 145.99 (11) |
C2iii—Fe2—Fe1i | 102.97 (7) | C2iii—Fe6—Fe1x | 47.31 (6) |
C2—Fe2—Fe1i | 47.51 (7) | C2xiii—Fe6—Fe1x | 108.21 (7) |
C2—Fe2—Fe2iii | 151.03 (7) | C2xiii—Fe6—Fe2iii | 49.66 (7) |
C2iii—Fe2—Fe2iii | 46.72 (7) | C2xiii—Fe6—Fe2 | 74.04 (7) |
C2—Fe2—Fe3 | 111.76 (7) | C2iii—Fe6—Fe2iii | 45.77 (6) |
C2iii—Fe2—Fe3 | 110.61 (7) | C2iii—Fe6—Fe2 | 47.43 (6) |
C2—Fe2—Fe4 | 111.51 (7) | C2iii—Fe6—Fe3xii | 142.76 (6) |
C2—Fe2—Fe4vii | 49.95 (7) | C2xiii—Fe6—Fe3xii | 103.40 (7) |
C2iii—Fe2—Fe4 | 51.99 (7) | C2xiii—Fe6—Fe5 | 51.25 (7) |
C2iii—Fe2—Fe4vii | 127.59 (7) | C2iii—Fe6—Fe5 | 105.78 (6) |
C2iii—Fe2—Fe5 | 116.35 (7) | C2xiii—Fe6—Fe6iii | 63.39 (7) |
C2iii—Fe2—Fe5i | 159.13 (7) | C2iii—Fe6—Fe6iii | 95.50 (6) |
C2—Fe2—Fe5i | 62.34 (7) | C2xiii—Fe6—Fe6vii | 133.91 (7) |
C2—Fe2—Fe5 | 103.92 (7) | C2iii—Fe6—Fe6vii | 49.32 (6) |
C2iii—Fe2—Fe6 | 60.66 (7) | C2iii—Fe6—Fe7xii | 150.86 (6) |
C2—Fe2—Fe6 | 103.06 (7) | C2xiii—Fe6—Fe7xii | 96.47 (7) |
C2iii—Fe2—Fe6vii | 49.93 (7) | C2xiii—Fe6—C3xv | 112.84 (9) |
C2—Fe2—Fe6vii | 61.11 (7) | C2xiii—Fe6—C2iii | 91.10 (10) |
C2—Fe2—C1 | 106.49 (10) | Fe1—Fe7—Fe1ii | 123.858 (17) |
C2—Fe2—C2iii | 105.47 (11) | Fe1—Fe7—Fe3ii | 61.371 (13) |
Fe1vi—Fe3—Fe4iii | 121.009 (15) | Fe1ii—Fe7—Fe3 | 116.763 (17) |
Fe1vi—Fe3—Fe4vii | 89.901 (13) | Fe1ii—Fe7—Fe3ii | 91.308 (15) |
Fe1vi—Fe3—Fe6viii | 56.894 (14) | Fe1—Fe7—Fe3 | 92.541 (15) |
Fe1vi—Fe3—Fe7 | 61.792 (12) | Fe1—Fe7—Fe4iii | 61.309 (13) |
Fe2—Fe3—Fe1vi | 145.446 (16) | Fe1ii—Fe7—Fe4xvi | 116.743 (16) |
Fe2—Fe3—Fe4vii | 61.500 (12) | Fe1—Fe7—Fe4xvi | 92.718 (15) |
Fe2—Fe3—Fe4 | 60.083 (12) | Fe1ii—Fe7—Fe4iii | 91.305 (14) |
Fe2—Fe3—Fe4iii | 63.347 (12) | Fe1—Fe7—Fe5ix | 150.072 (18) |
Fe2—Fe3—Fe6viii | 144.164 (16) | Fe1—Fe7—Fe6ix | 149.012 (19) |
Fe2—Fe3—Fe6ix | 147.334 (16) | Fe1—Fe7—Fe7ii | 65.016 (17) |
Fe2—Fe3—Fe7vi | 89.919 (14) | Fe1—Fe7—Fe7vi | 62.251 (17) |
Fe2—Fe3—Fe7 | 112.147 (15) | Fe3ii—Fe7—Fe3 | 150.088 (16) |
Fe4—Fe3—Fe1vi | 144.992 (16) | Fe3ii—Fe7—Fe4xvi | 60.994 (13) |
Fe4—Fe3—Fe4vii | 90.228 (16) | Fe3—Fe7—Fe4xvi | 109.846 (16) |
Fe4—Fe3—Fe4iii | 90.258 (16) | Fe3ii—Fe7—Fe4iii | 111.512 (15) |
Fe4iii—Fe3—Fe4vii | 115.096 (16) | Fe4iii—Fe7—Fe3 | 60.862 (13) |
Fe4—Fe3—Fe6viii | 89.261 (14) | Fe4iii—Fe7—Fe4xvi | 150.162 (17) |
Fe4—Fe3—Fe6ix | 109.037 (17) | Fe5ix—Fe7—Fe1ii | 64.364 (12) |
Fe4—Fe3—Fe7 | 144.997 (17) | Fe5ix—Fe7—Fe3 | 109.428 (15) |
Fe4—Fe3—Fe7vi | 146.385 (16) | Fe5ix—Fe7—Fe3ii | 91.343 (14) |
Fe6ix—Fe3—Fe1vi | 61.616 (13) | Fe5ix—Fe7—Fe4iii | 147.466 (17) |
Fe6viii—Fe3—Fe4iii | 140.810 (16) | Fe5ix—Fe7—Fe4xvi | 61.268 (12) |
Fe6ix—Fe3—Fe4vii | 150.752 (16) | Fe6ix—Fe7—Fe1ii | 64.507 (13) |
Fe6viii—Fe3—Fe4vii | 104.092 (14) | Fe6ix—Fe7—Fe3ii | 148.285 (17) |
Fe6ix—Fe3—Fe4iii | 87.390 (13) | Fe6ix—Fe7—Fe3 | 60.682 (13) |
Fe6ix—Fe3—Fe6viii | 56.064 (11) | Fe6ix—Fe7—Fe4xvi | 110.192 (16) |
Fe6ix—Fe3—Fe7vi | 104.491 (16) | Fe6ix—Fe7—Fe4iii | 90.316 (15) |
Fe6ix—Fe3—Fe7 | 57.223 (14) | Fe6ix—Fe7—Fe5ix | 60.464 (13) |
Fe7vi—Fe3—Fe1vi | 57.417 (12) | Fe7vi—Fe7—Fe1ii | 173.89 (2) |
Fe7—Fe3—Fe4vii | 116.978 (16) | Fe7ii—Fe7—Fe1ii | 58.842 (11) |
Fe7—Fe3—Fe4iii | 59.233 (12) | Fe7vi—Fe7—Fe3ii | 92.24 (2) |
Fe7vi—Fe3—Fe4iii | 88.884 (14) | Fe7ii—Fe7—Fe3ii | 62.037 (16) |
Fe7vi—Fe3—Fe4vii | 60.147 (13) | Fe7vi—Fe7—Fe3 | 60.821 (14) |
Fe7vi—Fe3—Fe6viii | 111.874 (16) | Fe7ii—Fe7—Fe3 | 122.50 (2) |
Fe7—Fe3—Fe6viii | 103.630 (16) | Fe7ii—Fe7—Fe4xvi | 122.68 (2) |
Fe7vi—Fe3—Fe7 | 57.142 (9) | Fe7vi—Fe7—Fe4iii | 92.02 (2) |
C3—Fe3—Fe1vi | 48.84 (7) | Fe7vi—Fe7—Fe4xvi | 61.075 (14) |
C3iii—Fe3—Fe1vi | 102.24 (7) | Fe7ii—Fe7—Fe4iii | 61.979 (16) |
C3—Fe3—Fe2 | 110.24 (7) | Fe7ii—Fe7—Fe5ix | 114.884 (18) |
C3iii—Fe3—Fe2 | 110.19 (7) | Fe7vi—Fe7—Fe5ix | 110.562 (17) |
C3iii—Fe3—Fe4 | 51.55 (7) | Fe7ii—Fe7—Fe6ix | 114.435 (18) |
C3iii—Fe3—Fe4vii | 126.24 (7) | Fe7vi—Fe7—Fe6ix | 110.340 (17) |
C3—Fe3—Fe4vii | 49.32 (7) | Fe7ii—Fe7—Fe7vi | 127.27 (3) |
C3—Fe3—Fe4 | 108.88 (7) | C3xiii—Fe7—Fe1 | 108.17 (7) |
C3—Fe3—Fe4iii | 153.73 (8) | C3xiii—Fe7—Fe1ii | 49.01 (7) |
C3iii—Fe3—Fe4iii | 102.76 (7) | C3xiii—Fe7—Fe3ii | 126.91 (7) |
C3iii—Fe3—Fe6viii | 49.29 (7) | C3xiii—Fe7—Fe3 | 72.69 (7) |
C3—Fe3—Fe6ix | 102.42 (7) | C3xiii—Fe7—Fe4iii | 50.00 (7) |
C3iii—Fe3—Fe6ix | 60.14 (7) | C3xiii—Fe7—Fe4xvi | 158.96 (7) |
C3—Fe3—Fe6viii | 59.75 (7) | C3xiii—Fe7—Fe5ix | 97.89 (7) |
C3iii—Fe3—Fe7 | 114.80 (7) | C3xiii—Fe7—Fe6ix | 51.75 (7) |
C3iii—Fe3—Fe7vi | 159.64 (7) | C3xiii—Fe7—Fe7vi | 131.10 (7) |
C3—Fe3—Fe7 | 105.69 (7) | C3xiii—Fe7—Fe7ii | 66.76 (7) |
C3—Fe3—Fe7vi | 65.16 (8) | C3xiii—Fe7—C1ii | 97.44 (10) |
C3—Fe3—C3iii | 103.26 (11) | C1ii—Fe7—Fe1 | 108.75 (7) |
C3—Fe3—C1 | 107.83 (10) | C1ii—Fe7—Fe1ii | 48.85 (7) |
C3iii—Fe3—C1 | 147.84 (10) | C1ii—Fe7—Fe3ii | 50.46 (7) |
C1—Fe3—Fe1vi | 104.25 (7) | C1ii—Fe7—Fe3 | 158.55 (7) |
C1—Fe3—Fe2 | 50.83 (7) | C1ii—Fe7—Fe4iii | 127.22 (7) |
C1—Fe3—Fe4iii | 47.28 (7) | C1ii—Fe7—Fe4xvi | 72.64 (7) |
C1—Fe3—Fe4vii | 71.82 (7) | C1ii—Fe7—Fe5ix | 52.00 (7) |
C1—Fe3—Fe4 | 108.99 (7) | C1ii—Fe7—Fe6ix | 98.13 (7) |
C1—Fe3—Fe6ix | 119.17 (7) | C1ii—Fe7—Fe7vi | 131.45 (7) |
C1—Fe3—Fe6viii | 161.07 (7) | C1ii—Fe7—Fe7ii | 67.23 (7) |
C1—Fe3—Fe7vi | 49.68 (7) | Fe1vi—C3—Fe3vii | 141.84 (14) |
C1—Fe3—Fe7 | 64.26 (7) | Fe1vi—C3—Fe4vii | 136.34 (13) |
Fe1vii—Fe4—Fe2iii | 121.493 (16) | Fe1vi—C3—Fe6viii | 69.57 (8) |
Fe1vii—Fe4—Fe3vii | 89.574 (14) | Fe1vi—C3—Fe6xvii | 85.69 (9) |
Fe1vii—Fe4—Fe5x | 60.905 (13) | Fe1vi—C3—Fe7xviii | 80.93 (9) |
Fe1vii—Fe4—Fe7vii | 57.221 (12) | Fe3—C3—Fe1vi | 82.80 (9) |
Fe1vii—Fe4—Fe7xi | 61.680 (13) | Fe3—C3—Fe3vii | 85.46 (10) |
Fe2—Fe4—Fe1vii | 145.235 (16) | Fe3vii—C3—Fe4vii | 77.52 (8) |
Fe2—Fe4—Fe2iii | 62.129 (11) | Fe3—C3—Fe4vii | 83.49 (9) |
Fe2—Fe4—Fe3vii | 89.428 (15) | Fe3—C3—Fe6xvii | 142.12 (14) |
Fe2iii—Fe4—Fe3vii | 148.395 (18) | Fe3vii—C3—Fe6viii | 72.31 (8) |
Fe2—Fe4—Fe3 | 59.502 (14) | Fe3vii—C3—Fe6xvii | 81.69 (9) |
Fe2—Fe4—Fe5vii | 89.246 (14) | Fe3—C3—Fe6viii | 74.42 (8) |
Fe2—Fe4—Fe5x | 110.849 (15) | Fe3—C3—Fe7xviii | 135.82 (13) |
Fe2—Fe4—Fe7xi | 145.899 (18) | Fe4vii—C3—Fe6viii | 143.61 (12) |
Fe2—Fe4—Fe7vii | 145.397 (17) | Fe6xvii—C3—Fe4vii | 127.43 (12) |
Fe3—Fe4—Fe1vii | 145.777 (16) | Fe6xvii—C3—Fe6viii | 67.74 (7) |
Fe3—Fe4—Fe2iii | 89.544 (15) | Fe7xviii—C3—Fe3vii | 129.92 (12) |
Fe3—Fe4—Fe3vii | 62.606 (11) | Fe7xviii—C3—Fe4vii | 80.68 (9) |
Fe3—Fe4—Fe5x | 146.983 (18) | Fe7xviii—C3—Fe6xvii | 76.88 (9) |
Fe3—Fe4—Fe5vii | 144.237 (17) | Fe7xviii—C3—Fe6viii | 134.83 (12) |
Fe3—Fe4—Fe7xi | 111.374 (15) | Fe1—C1—Fe2 | 143.90 (12) |
Fe3—Fe4—Fe7vii | 90.147 (13) | Fe1—C1—Fe3 | 135.36 (12) |
Fe5vii—Fe4—Fe1vii | 57.353 (12) | Fe1—C1—Fe5 | 70.80 (8) |
Fe5vii—Fe4—Fe2iii | 90.315 (13) | Fe1—C1—Fe5i | 85.34 (10) |
Fe5x—Fe4—Fe2iii | 60.590 (12) | Fe1—C1—Fe7vi | 80.88 (9) |
Fe5x—Fe4—Fe3vii | 149.806 (18) | Fe2—C1—Fe3 | 76.81 (9) |
Fe5vii—Fe4—Fe3vii | 103.596 (15) | Fe2—C1—Fe5 | 73.11 (7) |
Fe5vii—Fe4—Fe5x | 56.543 (14) | Fe2—C1—Fe5i | 82.56 (9) |
Fe5x—Fe4—Fe7xi | 56.951 (14) | Fe2—C1—Fe7vi | 128.32 (13) |
Fe5vii—Fe4—Fe7vii | 111.969 (17) | Fe3—C1—Fe5 | 143.08 (12) |
Fe5vii—Fe4—Fe7xi | 104.299 (16) | Fe4iii—C1—Fe1 | 82.99 (10) |
Fe7xi—Fe4—Fe2iii | 86.265 (15) | Fe4iii—C1—Fe2 | 86.47 (10) |
Fe7vii—Fe4—Fe2iii | 140.027 (17) | Fe4iii—C1—Fe3 | 83.11 (9) |
Fe7vii—Fe4—Fe3vii | 59.905 (12) | Fe4iii—C1—Fe5i | 142.90 (12) |
Fe7xi—Fe4—Fe3vii | 116.547 (15) | Fe4iii—C1—Fe5 | 74.22 (8) |
Fe7vii—Fe4—Fe5x | 103.703 (16) | Fe4iii—C1—Fe7vi | 135.29 (12) |
Fe7vii—Fe4—Fe7xi | 56.947 (9) | Fe5i—C1—Fe3 | 127.86 (13) |
C3iii—Fe4—Fe1vii | 103.63 (7) | Fe5i—C1—Fe5 | 68.68 (7) |
C3iii—Fe4—Fe2 | 109.01 (7) | Fe7vi—C1—Fe3 | 79.86 (8) |
C3iii—Fe4—Fe2iii | 103.10 (7) | Fe7vi—C1—Fe5 | 136.25 (12) |
C3iii—Fe4—Fe3 | 50.92 (7) | Fe7vi—C1—Fe5i | 76.59 (9) |
C3iii—Fe4—Fe3vii | 71.83 (7) | Fe1i—C2—Fe2vii | 141.27 (13) |
C3iii—Fe4—Fe5vii | 160.87 (7) | Fe1i—C2—Fe4vii | 138.36 (13) |
C3iii—Fe4—Fe5x | 118.66 (7) | Fe1i—C2—Fe5xviii | 83.61 (9) |
C3iii—Fe4—Fe7vii | 49.32 (7) | Fe1i—C2—Fe5i | 67.74 (7) |
C3iii—Fe4—Fe7xi | 63.73 (7) | Fe1i—C2—Fe6vii | 69.37 (7) |
C3iii—Fe4—C2iii | 147.88 (10) | Fe1i—C2—Fe6xviii | 83.96 (9) |
C1vii—Fe4—Fe1vii | 48.61 (7) | Fe2—C2—Fe1i | 85.31 (10) |
C1vii—Fe4—Fe2 | 108.22 (7) | Fe2—C2—Fe2vii | 84.55 (9) |
C1vii—Fe4—Fe2iii | 148.81 (7) | Fe2—C2—Fe4vii | 82.97 (9) |
C1vii—Fe4—Fe3vii | 49.60 (7) | Fe2vii—C2—Fe4vii | 76.93 (8) |
C1vii—Fe4—Fe3 | 111.61 (7) | Fe2vii—C2—Fe5i | 142.28 (11) |
C1vii—Fe4—Fe5x | 101.41 (7) | Fe2—C2—Fe5i | 73.05 (8) |
C1vii—Fe4—Fe5vii | 59.02 (7) | Fe2—C2—Fe5xviii | 138.98 (13) |
C1vii—Fe4—Fe7xi | 105.56 (7) | Fe2vii—C2—Fe5xviii | 126.28 (12) |
C1vii—Fe4—Fe7vii | 65.41 (7) | Fe2vii—C2—Fe6vii | 71.91 (8) |
C1vii—Fe4—C3iii | 108.02 (10) | Fe2—C2—Fe6vii | 73.11 (8) |
C1vii—Fe4—C2iii | 102.78 (9) | Fe2—C2—Fe6xviii | 140.27 (13) |
C2iii—Fe4—Fe1vii | 103.42 (7) | Fe2vii—C2—Fe6xviii | 80.41 (9) |
C2iii—Fe4—Fe2 | 51.08 (7) | Fe4vii—C2—Fe5i | 70.62 (7) |
C2iii—Fe4—Fe2iii | 47.08 (7) | Fe4vii—C2—Fe6vii | 142.05 (12) |
C2iii—Fe4—Fe3 | 108.85 (7) | Fe5xviii—C2—Fe4vii | 79.63 (9) |
C2iii—Fe4—Fe3vii | 125.28 (7) | Fe5xviii—C2—Fe5i | 66.19 (7) |
C2iii—Fe4—Fe5x | 62.22 (7) | Fe5xviii—C2—Fe6xviii | 77.33 (8) |
C2iii—Fe4—Fe5vii | 49.81 (7) | Fe5xviii—C2—Fe6vii | 136.93 (11) |
C2iii—Fe4—Fe7xi | 116.33 (7) | Fe6xviii—C2—Fe4vii | 128.02 (12) |
C2iii—Fe4—Fe7vii | 160.64 (7) | Fe6xviii—C2—Fe5i | 135.35 (11) |
Fe1—Fe5—Fe2 | 95.958 (16) | Fe6vii—C2—Fe5i | 126.54 (10) |
Fe1—Fe5—Fe4v | 93.739 (16) | Fe6xviii—C2—Fe6vii | 67.29 (7) |
Symmetry codes: (i) −x+1, −y+1, −z+1; (ii) −x+1, y−1/2, −z+1/2; (iii) −x+1/2, y−1/2, z; (iv) −x+1, −y, −z+1; (v) x+1/2, −y+1/2, −z+1; (vi) −x+1, y+1/2, −z+1/2; (vii) −x+1/2, y+1/2, z; (viii) −x+1/2, −y+1, z−1/2; (ix) x, −y+1/2, z−1/2; (x) x−1/2, −y+1/2, −z+1; (xi) x−1/2, y, −z+1/2; (xii) x, −y+1/2, z+1/2; (xiii) x, y−1, z; (xiv) x, −y+3/2, z+1/2; (xv) −x+1/2, −y+1, z+1/2; (xvi) x+1/2, y, −z+1/2; (xvii) x, −y+3/2, z−1/2; (xviii) x, y+1, z. |
Crystal data top
C6Fe14 | Dx = 7.622 Mg m−3 |
Mr = 853.90 | Mo Kα radiation, λ = 0.71073 Å |
Orthorhombic, Pbca | Cell parameters from 2015 reflections |
a = 4.5251 (4) Å | θ = 6.8–30.3° |
b = 13.7555 (10) Å | µ = 26.30 mm−1 |
c = 23.9096 (16) Å | T = 298 K |
V = 1488.3 (2) Å3 | Block, metallic light gray |
Z = 8 | 0.08 × 0.04 × 0.04 mm |
F(000) = 3240.5764 | |
Data collection top
Bruker DUO CCD area-detector diffractometer | 2275 independent reflections |
Radiation source: fine-focus sealed tube | 1095 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.060 |
Detector resolution: 25 pixels mm-1 | θmax = 30.5°, θmin = 1.7° |
φ and ω scans | h = −6→6 |
Absorption correction: multi-scan SADABS-2008/1 (Bruker,2008) was used for absorption correction. wR2(int) was
0.0871 before and 0.0484 after correction. The Ratio of minimum to maximum
transmission is 0.7968. The λ/2 correction factor is 0.0015. | k = −16→19 |
Tmin = 0.595, Tmax = 0.746 | l = −34→20 |
12211 measured reflections | |
Refinement top
Refinement on F2 | 0 restraints |
Least-squares matrix: full | 0 constraints |
R[F2 > 2σ(F2)] = 0.059 | Primary atom site location: dual |
wR(F2) = 0.226 | w = 1/[σ2(Fo2) + (0.1074P)2 + 12.8085P] where P = (Fo2 + 2Fc2)/3 |
S = 1.10 | (Δ/σ)max = 0.001 |
2275 reflections | Δρmax = 4.19 e Å−3 |
208 parameters | Δρmin = −3.66 e Å−3 |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top | x | y | z | Uiso*/Ueq | Occ. (<1) |
Fe1 | 0.5723 (5) | 0.84167 (13) | 0.53065 (8) | 0.0007 (4) | |
Fe2 | 0.5649 (4) | 0.65837 (13) | 0.53111 (8) | −0.0004 (4) | |
Fe3 | 0.5640 (4) | 0.75145 (13) | 0.43871 (8) | 0.0004 (4) | |
Fe4 | 0.2416 (4) | 0.99970 (15) | 0.41610 (11) | −0.0001 (5) | |
Fe5 | 0.7398 (4) | 0.75294 (16) | 0.33380 (12) | 0.0045 (6) | |
Fe6 | 0.7268 (4) | 0.91103 (18) | 0.38672 (12) | 0.0048 (5) | |
Fe7 | 0.2508 (4) | 0.99774 (16) | 0.52140 (11) | 0.0019 (5) | |
Fe8 | 0.2291 (4) | 0.84099 (17) | 0.36319 (10) | 0.0008 (5) | |
Fe9 | 1.2476 (4) | 0.65815 (17) | 0.36272 (11) | 0.0022 (5) | |
Fe10 | 0.7481 (4) | 0.75144 (16) | 0.22873 (11) | 0.0035 (5) | |
Fe11 | 0.7483 (4) | 0.59542 (17) | 0.38669 (12) | 0.0037 (5) | |
Fe12 | 0.9272 (6) | 0.59407 (16) | 0.28047 (9) | 0.0095 (5) | |
Fe13 | 0.9366 (6) | 0.50077 (15) | 0.18834 (9) | 0.0094 (5) | |
Fe14 | 0.9379 (6) | 0.41051 (16) | 0.28174 (10) | 0.0096 (5) | |
C1 | 0.464 (3) | 0.8960 (9) | 0.4544 (6) | 0.004 (2) | |
C2 | 0.971 (3) | 0.8921 (10) | 0.5472 (6) | 0.004 (2) | |
C3 | 0.965 (3) | 0.7466 (9) | 0.4050 (5) | 0.002 (2) | |
C4 | 0.529 (3) | 0.6457 (16) | 0.2971 (8) | −0.001 (4) | 0.666700 |
C5 | 0.540 (4) | 0.3586 (15) | 0.2964 (8) | −0.002 (3) | 0.666700 |
C6 | 1.058 (5) | 0.5023 (13) | 0.3139 (11) | −0.025 (3) | 0.333330 |
C7 | 0.538 (4) | 0.5095 (15) | 0.1548 (9) | 0.001 (4) | 0.666700 |
C8 | 1.077 (6) | 0.4066 (19) | 0.2180 (13) | −0.017 (5) | 0.333330 |
C9 | 1.060 (6) | 0.5929 (18) | 0.2180 (9) | −0.023 (4) | 0.333330 |
Atomic displacement parameters (Å2) top | U11 | U22 | U33 | U12 | U13 | U23 |
Fe1 | 0.0008 (9) | 0.0005 (8) | 0.0008 (8) | −0.0003 (7) | 0.0005 (8) | 0.0002 (6) |
Fe2 | −0.0004 (8) | 0.0004 (8) | −0.0010 (8) | 0.0011 (7) | 0.0003 (7) | −0.0004 (6) |
Fe3 | 0.0002 (8) | 0.0006 (8) | 0.0003 (8) | 0.0000 (7) | 0.0009 (7) | 0.0004 (6) |
Fe4 | 0.0009 (12) | −0.0016 (10) | 0.0003 (11) | 0.0009 (5) | 0.0000 (6) | 0.0005 (8) |
Fe5 | 0.0034 (13) | 0.0063 (11) | 0.0038 (12) | −0.0004 (7) | 0.0000 (6) | 0.0003 (9) |
Fe6 | 0.0034 (11) | 0.0053 (11) | 0.0055 (12) | −0.0023 (7) | −0.0002 (7) | −0.0011 (9) |
Fe7 | 0.0007 (13) | 0.0028 (10) | 0.0022 (12) | −0.0008 (6) | −0.0001 (6) | −0.0001 (8) |
Fe8 | −0.0003 (10) | 0.0017 (10) | 0.0011 (11) | 0.0003 (6) | 0.0005 (6) | −0.0019 (8) |
Fe9 | 0.0023 (13) | −0.0002 (10) | 0.0046 (13) | −0.0006 (6) | 0.0000 (6) | 0.0010 (8) |
Fe10 | 0.0031 (13) | 0.0060 (11) | 0.0014 (11) | 0.0009 (6) | 0.0001 (6) | −0.0006 (9) |
Fe11 | 0.0015 (12) | 0.0059 (12) | 0.0038 (12) | 0.0019 (6) | 0.0000 (6) | −0.0007 (9) |
Fe12 | 0.0122 (12) | 0.0107 (11) | 0.0057 (10) | −0.0002 (9) | 0.0003 (10) | −0.0004 (8) |
Fe13 | 0.0114 (11) | 0.0095 (10) | 0.0073 (10) | 0.0010 (9) | 0.0000 (9) | 0.0001 (9) |
Fe14 | 0.0109 (11) | 0.0087 (10) | 0.0091 (11) | 0.0013 (9) | −0.0027 (10) | 0.0004 (8) |
C1 | 0.005 (6) | −0.001 (5) | 0.008 (6) | −0.009 (5) | 0.003 (5) | 0.000 (4) |
C2 | −0.001 (6) | 0.001 (5) | 0.013 (6) | −0.004 (5) | −0.001 (5) | −0.008 (5) |
C3 | 0.004 (6) | 0.009 (6) | −0.007 (5) | 0.000 (5) | 0.001 (4) | −0.003 (4) |
C4 | −0.018 (6) | 0.017 (11) | 0.000 (8) | −0.007 (6) | −0.008 (6) | 0.011 (8) |
C5 | −0.004 (8) | 0.003 (9) | −0.006 (7) | 0.012 (7) | −0.009 (6) | −0.001 (7) |
C6 | −0.025 (9) | −0.034 (7) | −0.017 (11) | −0.007 (6) | −0.001 (8) | 0.005 (7) |
C7 | −0.003 (8) | 0.011 (10) | −0.004 (9) | −0.003 (7) | 0.006 (7) | −0.012 (7) |
C8 | −0.027 (9) | −0.023 (10) | −0.001 (14) | 0.003 (8) | 0.000 (9) | −0.010 (10) |
C9 | −0.016 (11) | −0.019 (10) | −0.033 (7) | −0.005 (8) | −0.002 (8) | 0.000 (7) |
Geometric parameters (Å, º) top
Fe1—Fe2 | 2.522 (3) | Fe7—Fe7vi | 2.490 (4) |
Fe1—Fe2i | 2.730 (3) | Fe7—Fe11i | 2.544 (4) |
Fe1—Fe2ii | 2.674 (3) | Fe7—C1iii | 2.033 (13) |
Fe1—Fe3ii | 2.670 (3) | Fe7—C1 | 2.336 (13) |
Fe1—Fe3 | 2.525 (3) | Fe7—C2iii | 2.447 (14) |
Fe1—Fe3i | 2.733 (3) | Fe7—C2v | 2.024 (14) |
Fe1—Fe4iii | 2.663 (3) | Fe8—Fe9v | 2.516 (4) |
Fe1—Fe7iii | 2.659 (3) | Fe8—Fe10xi | 2.521 (4) |
Fe1—Fe7 | 2.603 (3) | Fe8—Fe13ix | 2.629 (3) |
Fe1—Fe9i | 2.670 (3) | Fe8—Fe14vii | 2.641 (3) |
Fe1—Fe11i | 2.609 (3) | Fe8—C1 | 2.542 (14) |
Fe1—C1 | 2.029 (14) | Fe8—C3v | 2.028 (13) |
Fe1—C2 | 1.973 (13) | Fe8—C5viii | 2.02 (2) |
Fe1—C3i | 2.019 (13) | Fe8—C7ix | 2.583 (19) |
Fe2—Fe3i | 2.683 (3) | Fe8—C8ix | 2.55 (3) |
Fe2—Fe3ii | 2.676 (3) | Fe9—Fe10xii | 2.535 (4) |
Fe2—Fe3 | 2.553 (3) | Fe9—Fe11 | 2.486 (3) |
Fe2—Fe4ii | 2.638 (3) | Fe9—Fe11x | 2.491 (2) |
Fe2—Fe6i | 2.667 (3) | Fe9—Fe12 | 2.597 (3) |
Fe2—Fe7iv | 2.641 (3) | Fe9—Fe13xii | 2.628 (3) |
Fe2—Fe7ii | 2.626 (3) | Fe9—C2ii | 2.478 (15) |
Fe2—Fe8ii | 2.634 (3) | Fe9—C3 | 2.034 (13) |
Fe2—C1ii | 1.986 (13) | Fe9—C4x | 2.03 (2) |
Fe2—C2i | 2.042 (14) | Fe9—C6 | 2.59 (2) |
Fe2—C3i | 2.060 (12) | Fe9—C7xii | 2.29 (2) |
Fe3—Fe5 | 2.631 (3) | Fe9—C9xii | 2.56 (3) |
Fe3—Fe6 | 2.628 (3) | Fe10—Fe10xii | 2.481 (2) |
Fe3—Fe8 | 2.660 (3) | Fe10—Fe10xi | 2.481 (2) |
Fe3—Fe9v | 2.645 (3) | Fe10—Fe12 | 2.622 (3) |
Fe3—Fe11 | 2.617 (3) | Fe10—Fe12xi | 2.616 (3) |
Fe3—C1 | 2.073 (13) | Fe10—Fe14vii | 2.665 (3) |
Fe3—C2i | 2.048 (14) | Fe10—Fe14xiii | 2.621 (3) |
Fe3—C3 | 1.987 (13) | Fe10—C4xii | 2.030 (19) |
Fe4—Fe6v | 2.722 (3) | Fe10—C4 | 2.401 (18) |
Fe4—Fe6 | 2.608 (3) | Fe10—C5ix | 2.06 (2) |
Fe4—Fe7vi | 2.683 (3) | Fe10—C5vii | 2.390 (17) |
Fe4—Fe7iii | 2.740 (3) | Fe11—Fe12 | 2.666 (4) |
Fe4—Fe7 | 2.518 (4) | Fe11—Fe13xi | 2.627 (3) |
Fe4—Fe8 | 2.524 (3) | Fe11—C2i | 2.026 (14) |
Fe4—Fe9vii | 2.526 (3) | Fe11—C3 | 2.341 (13) |
Fe4—Fe11vii | 2.749 (3) | Fe11—C4 | 2.459 (17) |
Fe4—Fe11viii | 2.673 (3) | Fe11—C6 | 2.58 (3) |
Fe4—Fe13ix | 2.624 (3) | Fe11—C7xii | 2.02 (2) |
Fe4—C1 | 1.973 (14) | Fe12—Fe12xi | 2.691 (2) |
Fe4—C2iii | 1.977 (13) | Fe12—Fe12xii | 2.691 (2) |
Fe4—C7ix | 1.972 (19) | Fe12—Fe13 | 2.550 (3) |
Fe5—Fe6 | 2.517 (4) | Fe12—Fe13xi | 2.670 (4) |
Fe5—Fe8x | 2.620 (3) | Fe12—Fe13xii | 2.742 (4) |
Fe5—Fe8 | 2.702 (3) | Fe12—Fe14 | 2.526 (3) |
Fe5—Fe9 | 2.731 (3) | Fe12—C4xii | 2.04 (2) |
Fe5—Fe9v | 2.672 (3) | Fe12—C4 | 1.975 (19) |
Fe5—Fe10xi | 2.680 (3) | Fe12—C6 | 1.61 (2) |
Fe5—Fe10 | 2.512 (4) | Fe12—C7xii | 2.000 (18) |
Fe5—Fe10xii | 2.744 (3) | Fe12—C9xi | 1.66 (3) |
Fe5—Fe11 | 2.509 (4) | Fe12—C9 | 1.61 (2) |
Fe5—Fe12 | 2.668 (3) | Fe13—Fe14xi | 2.673 (4) |
Fe5—Fe14vii | 2.626 (3) | Fe13—Fe14 | 2.555 (3) |
Fe5—C3 | 1.986 (12) | Fe13—Fe14xii | 2.683 (4) |
Fe5—C4 | 1.96 (2) | Fe13—C4xii | 2.07 (2) |
Fe5—C5vii | 1.976 (18) | Fe13—C5xii | 2.044 (19) |
Fe5—C8xiii | 2.59 (3) | Fe13—C6xi | 1.71 (2) |
Fe6—Fe7iii | 2.532 (4) | Fe13—C7 | 1.98 (2) |
Fe6—Fe8x | 2.532 (3) | Fe13—C8 | 1.61 (3) |
Fe6—Fe8 | 2.513 (3) | Fe13—C9 | 1.56 (2) |
Fe6—Fe11vii | 2.539 (4) | Fe14—Fe14xii | 2.724 (3) |
Fe6—Fe13xiii | 2.658 (4) | Fe14—Fe14xi | 2.724 (3) |
Fe6—Fe14vii | 2.618 (4) | Fe14—C5xii | 2.054 (18) |
Fe6—C1 | 2.019 (13) | Fe14—C5 | 1.97 (2) |
Fe6—C3 | 2.543 (13) | Fe14—C6 | 1.58 (2) |
Fe6—C5vii | 2.509 (17) | Fe14—C7xii | 2.09 (2) |
Fe6—C6vii | 2.50 (2) | Fe14—C8 | 1.65 (3) |
Fe6—C7ix | 2.062 (19) | Fe14—C8xi | 1.63 (3) |
Fe7—Fe7iii | 2.478 (4) | | |
| | | |
Fe4iii—Fe1—Fe3ii | 89.91 (8) | Fe5—Fe9—Fe1ii | 89.50 (10) |
Fe4iii—Fe1—Fe3 | 145.46 (10) | Fe5—Fe9—Fe3x | 113.44 (11) |
Fe4iii—Fe1—Fe3i | 121.47 (9) | Fe5x—Fe9—Fe3x | 59.33 (8) |
Fe7—Fe1—Fe3 | 108.85 (10) | Fe5x—Fe9—Fe4xiv | 122.40 (10) |
Fe7iii—Fe1—Fe3i | 140.21 (10) | Fe5—Fe9—Fe4xiv | 123.78 (9) |
Fe7iii—Fe1—Fe3 | 90.30 (9) | Fe8x—Fe9—Fe1ii | 89.14 (10) |
Fe7—Fe1—Fe3i | 86.50 (8) | Fe8x—Fe9—Fe3x | 61.97 (8) |
Fe7iii—Fe1—Fe3ii | 106.02 (9) | Fe8x—Fe9—Fe4xiv | 149.39 (14) |
Fe7—Fe1—Fe3ii | 152.23 (10) | Fe8x—Fe9—Fe5x | 62.69 (8) |
Fe7—Fe1—Fe4iii | 62.71 (8) | Fe8x—Fe9—Fe5 | 59.74 (8) |
Fe7iii—Fe1—Fe4iii | 56.48 (8) | Fe10xii—Fe9—Fe1ii | 145.42 (11) |
Fe9i—Fe1—Fe3i | 89.69 (8) | Fe10xii—Fe9—Fe3x | 110.26 (10) |
Fe9i—Fe1—Fe3ii | 59.39 (7) | Fe10xii—Fe9—Fe4xiv | 150.74 (13) |
Fe9i—Fe1—Fe3 | 146.75 (10) | Fe10xii—Fe9—Fe5x | 61.90 (9) |
Fe9i—Fe1—Fe4iii | 56.55 (8) | Fe10xii—Fe9—Fe5 | 62.67 (9) |
Fe9i—Fe1—Fe7iii | 110.90 (10) | Fe10xii—Fe9—Fe8x | 59.87 (9) |
Fe9i—Fe1—Fe7 | 104.27 (10) | Fe11—Fe9—Fe1ii | 60.66 (8) |
Fe11i—Fe1—Fe3ii | 114.82 (9) | Fe11x—Fe9—Fe1ii | 92.91 (10) |
Fe11i—Fe1—Fe3 | 144.53 (11) | Fe11x—Fe9—Fe3x | 61.17 (8) |
Fe11i—Fe1—Fe3i | 58.62 (7) | Fe11—Fe9—Fe3x | 120.13 (11) |
Fe11i—Fe1—Fe4iii | 62.85 (8) | Fe11—Fe9—Fe4xiv | 66.51 (8) |
Fe11i—Fe1—Fe7 | 58.44 (9) | Fe11x—Fe9—Fe4xiv | 64.37 (8) |
Fe11i—Fe1—Fe7iii | 104.37 (10) | Fe11—Fe9—Fe5x | 170.69 (11) |
Fe11i—Fe1—Fe9i | 56.17 (8) | Fe11—Fe9—Fe5 | 57.26 (8) |
C1—Fe1—Fe3i | 102.2 (4) | Fe11x—Fe9—Fe5x | 58.03 (8) |
C1—Fe1—Fe3ii | 128.6 (4) | Fe11x—Fe9—Fe5 | 171.43 (11) |
C1—Fe1—Fe3 | 52.8 (4) | Fe11x—Fe9—Fe8x | 112.05 (9) |
C1—Fe1—Fe4iii | 101.8 (4) | Fe11—Fe9—Fe8x | 108.40 (9) |
C1—Fe1—Fe7 | 59.0 (4) | Fe11x—Fe9—Fe10xii | 111.90 (9) |
C1—Fe1—Fe7iii | 49.2 (4) | Fe11—Fe9—Fe10xii | 112.05 (9) |
C1—Fe1—Fe9i | 158.2 (4) | Fe12—Fe9—Fe1ii | 123.88 (10) |
C1—Fe1—Fe11i | 115.0 (4) | Fe12—Fe9—Fe3x | 170.67 (12) |
C2—Fe1—Fe3i | 151.7 (4) | Fe12—Fe9—Fe4xiv | 95.77 (10) |
C2—Fe1—Fe3 | 111.2 (4) | Fe12—Fe9—Fe5 | 60.04 (9) |
C2—Fe1—Fe3ii | 49.6 (4) | Fe12—Fe9—Fe5x | 115.78 (13) |
C2—Fe1—Fe4iii | 47.7 (4) | Fe12—Fe9—Fe8x | 108.90 (11) |
C2—Fe1—Fe7 | 103.8 (4) | Fe12—Fe9—Fe10xii | 61.27 (9) |
C2—Fe1—Fe7iii | 61.7 (4) | Fe12—Fe9—Fe11 | 63.22 (9) |
C2—Fe1—Fe9i | 62.4 (4) | Fe12—Fe9—Fe11x | 124.35 (11) |
C2—Fe1—Fe11i | 104.2 (4) | Fe13xii—Fe9—Fe1ii | 122.75 (11) |
C2—Fe1—C1 | 105.7 (6) | Fe13xii—Fe9—Fe3x | 122.85 (11) |
C3i—Fe1—Fe3 | 111.4 (4) | Fe13xii—Fe9—Fe4xiv | 61.17 (9) |
C3i—Fe1—Fe3i | 46.5 (4) | Fe13xii—Fe9—Fe5x | 90.60 (10) |
C3i—Fe1—Fe3ii | 72.7 (4) | Fe13xii—Fe9—Fe5 | 123.33 (12) |
C3i—Fe1—Fe4iii | 101.8 (4) | Fe13xii—Fe9—Fe8x | 146.73 (12) |
C3i—Fe1—Fe7iii | 158.2 (4) | Fe13xii—Fe9—Fe10xii | 90.92 (10) |
C3i—Fe1—Fe7 | 115.3 (4) | Fe13xii—Fe9—Fe11 | 96.72 (10) |
C3i—Fe1—Fe9i | 49.0 (4) | Fe13xii—Fe9—Fe11x | 61.68 (9) |
C3i—Fe1—Fe11i | 59.2 (4) | Fe13xii—Fe9—Fe12 | 63.29 (9) |
C3i—Fe1—C1 | 148.0 (5) | C2ii—Fe9—Fe1ii | 44.9 (3) |
C3i—Fe1—C2 | 106.2 (6) | C2ii—Fe9—Fe3x | 47.0 (3) |
Fe3i—Fe2—Fe1ii | 148.89 (9) | C2ii—Fe9—Fe4xiv | 46.5 (3) |
Fe3—Fe2—Fe1ii | 62.19 (7) | C2ii—Fe9—Fe5x | 91.2 (3) |
Fe3ii—Fe2—Fe1i | 148.51 (9) | C2ii—Fe9—Fe5 | 134.1 (3) |
Fe3—Fe2—Fe1 | 59.66 (7) | C2ii—Fe9—Fe8x | 106.8 (3) |
Fe3ii—Fe2—Fe1 | 61.74 (7) | C2ii—Fe9—Fe10xii | 153.0 (3) |
Fe3i—Fe2—Fe1 | 63.26 (8) | C2ii—Fe9—Fe11x | 48.1 (3) |
Fe3ii—Fe2—Fe1ii | 55.68 (7) | C2ii—Fe9—Fe11 | 94.2 (3) |
Fe3—Fe2—Fe1i | 61.38 (7) | C2ii—Fe9—Fe12 | 142.3 (3) |
Fe3i—Fe2—Fe1i | 56.24 (7) | C2ii—Fe9—Fe13xii | 92.4 (3) |
Fe4ii—Fe2—Fe1i | 121.11 (9) | C3—Fe9—Fe1ii | 48.6 (4) |
Fe4ii—Fe2—Fe1 | 145.30 (10) | C3—Fe9—Fe3x | 73.1 (4) |
Fe4ii—Fe2—Fe1ii | 90.21 (8) | C3—Fe9—Fe4xiv | 106.1 (4) |
Fe4ii—Fe2—Fe3ii | 89.84 (8) | C3—Fe9—Fe5x | 111.1 (4) |
Fe4ii—Fe2—Fe3 | 145.86 (10) | C3—Fe9—Fe5 | 46.5 (4) |
Fe4ii—Fe2—Fe3i | 120.56 (9) | C3—Fe9—Fe8x | 51.6 (4) |
Fe6i—Fe2—Fe1i | 85.90 (9) | C3—Fe9—Fe10xii | 97.3 (4) |
Fe6i—Fe2—Fe1 | 111.63 (10) | C3—Fe9—Fe11x | 131.6 (4) |
Fe6i—Fe2—Fe1ii | 151.76 (10) | C3—Fe9—Fe11 | 61.4 (4) |
Fe6i—Fe2—Fe3ii | 116.84 (9) | C3—Fe9—Fe12 | 103.2 (4) |
Fe6i—Fe2—Fe3 | 144.68 (11) | C3—Fe9—Fe13xii | 158.1 (4) |
Fe6i—Fe2—Fe3i | 58.84 (7) | C3—Fe9—C2ii | 89.5 (5) |
Fe6i—Fe2—Fe4ii | 61.73 (8) | C6—Fe9—C4x | 77.8 (8) |
Fe7iv—Fe2—Fe1 | 147.48 (10) | C9xii—Fe9—C7xii | 77.2 (8) |
Fe7ii—Fe2—Fe1ii | 58.12 (7) | Fe8xii—Fe10—Fe5xii | 62.50 (9) |
Fe7ii—Fe2—Fe1i | 90.16 (8) | Fe8xii—Fe10—Fe5 | 150.13 (13) |
Fe7iv—Fe2—Fe1ii | 114.03 (9) | Fe8xii—Fe10—Fe5xi | 59.51 (8) |
Fe7ii—Fe2—Fe1 | 144.24 (10) | Fe9xi—Fe10—Fe5xi | 62.16 (8) |
Fe7iv—Fe2—Fe1i | 60.03 (7) | Fe9xi—Fe10—Fe5 | 150.05 (13) |
Fe7ii—Fe2—Fe3ii | 103.75 (9) | Fe9xi—Fe10—Fe5xii | 61.55 (8) |
Fe7iv—Fe2—Fe3i | 87.33 (8) | Fe9xi—Fe10—Fe8xii | 59.69 (10) |
Fe7iv—Fe2—Fe3 | 110.03 (10) | Fe10xi—Fe10—Fe5xii | 170.29 (17) |
Fe7ii—Fe2—Fe3 | 89.82 (9) | Fe10xi—Fe10—Fe5 | 64.93 (12) |
Fe7ii—Fe2—Fe3i | 141.02 (10) | Fe10xi—Fe10—Fe5xi | 57.22 (9) |
Fe7iv—Fe2—Fe3ii | 150.22 (9) | Fe10xii—Fe10—Fe5xi | 171.17 (17) |
Fe7ii—Fe2—Fe4ii | 57.16 (9) | Fe10xii—Fe10—Fe5xii | 58.11 (9) |
Fe7iv—Fe2—Fe4ii | 61.09 (7) | Fe10xii—Fe10—Fe5 | 66.66 (13) |
Fe7ii—Fe2—Fe6i | 104.08 (10) | Fe10xii—Fe10—Fe8xii | 112.86 (11) |
Fe7iv—Fe2—Fe6i | 56.97 (9) | Fe10xi—Fe10—Fe8xii | 109.04 (10) |
Fe8ii—Fe2—Fe1i | 139.90 (10) | Fe10xii—Fe10—Fe9xi | 110.76 (10) |
Fe8ii—Fe2—Fe1 | 89.83 (9) | Fe10xi—Fe10—Fe9xi | 110.65 (10) |
Fe8ii—Fe2—Fe1ii | 106.37 (9) | Fe12—Fe10—Fe5xi | 121.50 (11) |
Fe8ii—Fe2—Fe3ii | 60.11 (7) | Fe12xi—Fe10—Fe5xii | 114.84 (11) |
Fe8ii—Fe2—Fe3i | 88.78 (8) | Fe12xi—Fe10—Fe5xi | 59.66 (8) |
Fe8ii—Fe2—Fe3 | 145.98 (10) | Fe12—Fe10—Fe5xii | 90.74 (9) |
Fe8ii—Fe2—Fe4ii | 57.20 (8) | Fe12—Fe10—Fe5 | 62.59 (9) |
Fe8ii—Fe2—Fe6i | 57.06 (8) | Fe12xi—Fe10—Fe5 | 94.73 (10) |
Fe8ii—Fe2—Fe7ii | 111.78 (10) | Fe12—Fe10—Fe8xii | 145.63 (12) |
Fe8ii—Fe2—Fe7iv | 103.86 (10) | Fe12xi—Fe10—Fe8xii | 108.18 (11) |
C1ii—Fe2—Fe1i | 148.7 (4) | Fe12xi—Fe10—Fe9xi | 60.53 (9) |
C1ii—Fe2—Fe1 | 111.4 (4) | Fe12—Fe10—Fe9xi | 89.38 (10) |
C1ii—Fe2—Fe1ii | 47.8 (4) | Fe12xi—Fe10—Fe10xi | 61.84 (7) |
C1ii—Fe2—Fe3 | 109.9 (4) | Fe12—Fe10—Fe10xi | 95.08 (11) |
C1ii—Fe2—Fe3i | 153.6 (4) | Fe14xiii—Fe10—Fe5xii | 59.36 (8) |
C1ii—Fe2—Fe3ii | 50.2 (4) | Fe14xiii—Fe10—Fe5 | 95.56 (11) |
C1ii—Fe2—Fe4ii | 48.0 (4) | Fe14vii—Fe10—Fe5 | 60.86 (9) |
C1ii—Fe2—Fe6i | 105.0 (4) | Fe14xiii—Fe10—Fe5xi | 113.34 (11) |
C1ii—Fe2—Fe7ii | 58.9 (4) | Fe14vii—Fe10—Fe5xi | 89.32 (9) |
C1ii—Fe2—Fe7iv | 101.1 (4) | Fe14vii—Fe10—Fe5xii | 121.41 (11) |
C1ii—Fe2—Fe8ii | 65.0 (4) | Fe14vii—Fe10—Fe8xii | 90.15 (10) |
C2i—Fe2—Fe1 | 109.8 (4) | Fe14xiii—Fe10—Fe8xii | 61.79 (9) |
C2i—Fe2—Fe1ii | 71.3 (4) | Fe14vii—Fe10—Fe9xi | 145.63 (12) |
C2i—Fe2—Fe1i | 47.1 (4) | Fe14xiii—Fe10—Fe9xi | 109.92 (12) |
C2i—Fe2—Fe3ii | 125.5 (4) | Fe14vii—Fe10—Fe10xi | 61.11 (8) |
C2i—Fe2—Fe3i | 103.2 (4) | Fe14xiii—Fe10—Fe10xi | 122.25 (8) |
C2i—Fe2—Fe3 | 51.5 (4) | Fe14vii—Fe10—Fe12 | 123.45 (12) |
C2i—Fe2—Fe4ii | 102.8 (4) | Fe14vii—Fe10—Fe12xi | 122.96 (10) |
C2i—Fe2—Fe6i | 115.7 (4) | Fe14xiii—Fe10—Fe12xi | 169.66 (14) |
C2i—Fe2—Fe7ii | 49.5 (4) | Fe14xiii—Fe10—Fe12 | 124.54 (10) |
C2i—Fe2—Fe7iv | 61.4 (4) | C5vii—Fe10—C4xii | 113.3 (7) |
C2i—Fe2—Fe8ii | 160.0 (4) | C5vii—Fe10—C4 | 94.5 (7) |
C2i—Fe2—C1ii | 102.8 (5) | C5ix—Fe10—C4 | 111.8 (7) |
C3i—Fe2—Fe1i | 103.1 (4) | C5ix—Fe10—C4xii | 145.3 (8) |
C3i—Fe2—Fe1ii | 125.9 (4) | Fe3—Fe11—Fe1ii | 63.06 (9) |
C3i—Fe2—Fe1 | 51.1 (4) | Fe4iv—Fe11—Fe1ii | 115.49 (12) |
C3i—Fe2—Fe3ii | 72.0 (4) | Fe4xiv—Fe11—Fe1ii | 59.54 (8) |
C3i—Fe2—Fe3 | 108.9 (4) | Fe4iv—Fe11—Fe3 | 90.85 (9) |
C3i—Fe2—Fe3i | 47.3 (4) | Fe4xiv—Fe11—Fe3 | 122.60 (11) |
C3i—Fe2—Fe4ii | 103.6 (4) | Fe5—Fe11—Fe1ii | 95.97 (11) |
C3i—Fe2—Fe6i | 63.6 (4) | Fe5—Fe11—Fe3 | 61.73 (9) |
C3i—Fe2—Fe7ii | 160.6 (4) | Fe5—Fe11—Fe4iv | 123.05 (9) |
C3i—Fe2—Fe7iv | 118.5 (4) | Fe5—Fe11—Fe4xiv | 123.74 (9) |
C3i—Fe2—Fe8ii | 49.3 (4) | Fe6xiv—Fe11—Fe1ii | 107.84 (11) |
C3i—Fe2—C1ii | 108.0 (5) | Fe6xiv—Fe11—Fe3 | 146.45 (13) |
C3i—Fe2—C2i | 148.2 (5) | Fe6xiv—Fe11—Fe4xiv | 58.94 (8) |
Fe5—Fe3—Fe1 | 145.26 (10) | Fe6xiv—Fe11—Fe4iv | 62.91 (8) |
Fe5—Fe3—Fe1ii | 90.28 (8) | Fe6xiv—Fe11—Fe5 | 149.71 (15) |
Fe5—Fe3—Fe1i | 121.14 (9) | Fe7ii—Fe11—Fe1ii | 60.67 (8) |
Fe6—Fe3—Fe1i | 139.82 (10) | Fe7ii—Fe11—Fe3 | 90.23 (11) |
Fe6—Fe3—Fe1 | 89.84 (9) | Fe7ii—Fe11—Fe4iv | 61.85 (9) |
Fe6—Fe3—Fe1ii | 106.41 (9) | Fe7ii—Fe11—Fe4xiv | 62.22 (8) |
Fe6—Fe3—Fe5 | 57.18 (9) | Fe7ii—Fe11—Fe5 | 150.52 (14) |
Fe8—Fe3—Fe1 | 111.84 (10) | Fe7ii—Fe11—Fe6xiv | 59.76 (10) |
Fe8—Fe3—Fe1i | 86.19 (9) | Fe9v—Fe11—Fe1ii | 124.79 (11) |
Fe8—Fe3—Fe1ii | 151.48 (10) | Fe9—Fe11—Fe1ii | 63.17 (8) |
Fe8—Fe3—Fe5 | 61.41 (8) | Fe9—Fe11—Fe3 | 96.57 (9) |
Fe8—Fe3—Fe6 | 56.75 (8) | Fe9v—Fe11—Fe3 | 62.32 (8) |
Fe9v—Fe3—Fe1 | 147.62 (11) | Fe9—Fe11—Fe4xiv | 57.45 (8) |
Fe9v—Fe3—Fe1ii | 114.35 (9) | Fe9—Fe11—Fe4iv | 170.31 (11) |
Fe9v—Fe3—Fe1i | 60.31 (8) | Fe9v—Fe11—Fe4xiv | 171.28 (11) |
Fe9v—Fe3—Fe5 | 60.83 (8) | Fe9v—Fe11—Fe4iv | 58.46 (8) |
Fe9v—Fe3—Fe6 | 103.42 (11) | Fe9—Fe11—Fe5 | 66.29 (8) |
Fe9v—Fe3—Fe8 | 56.63 (9) | Fe9v—Fe11—Fe5 | 64.59 (8) |
Fe11—Fe3—Fe1i | 90.14 (8) | Fe9—Fe11—Fe6xiv | 107.84 (9) |
Fe11—Fe3—Fe1ii | 58.32 (7) | Fe9v—Fe11—Fe6xiv | 112.74 (10) |
Fe11—Fe3—Fe1 | 144.31 (11) | Fe9—Fe11—Fe7ii | 111.72 (10) |
Fe11—Fe3—Fe5 | 57.12 (9) | Fe9v—Fe11—Fe7ii | 112.17 (10) |
Fe11—Fe3—Fe6 | 111.78 (10) | Fe12—Fe11—Fe1ii | 123.60 (10) |
Fe11—Fe3—Fe8 | 103.81 (10) | Fe12—Fe11—Fe3 | 123.73 (11) |
Fe11—Fe3—Fe9v | 56.51 (7) | Fe12—Fe11—Fe4xiv | 89.16 (10) |
C1—Fe3—Fe1 | 51.2 (4) | Fe12—Fe11—Fe4iv | 119.95 (12) |
C1—Fe3—Fe1ii | 125.7 (4) | Fe12—Fe11—Fe5 | 61.99 (10) |
C1—Fe3—Fe1i | 103.2 (4) | Fe12—Fe11—Fe6xiv | 88.84 (11) |
C1—Fe3—Fe5 | 103.4 (4) | Fe12—Fe11—Fe7ii | 144.90 (12) |
C1—Fe3—Fe6 | 49.1 (4) | Fe12—Fe11—Fe9v | 93.41 (10) |
C1—Fe3—Fe8 | 63.6 (4) | Fe12—Fe11—Fe9 | 60.44 (9) |
C1—Fe3—Fe9v | 118.2 (4) | Fe13xi—Fe11—Fe1ii | 169.57 (12) |
C1—Fe3—Fe11 | 160.4 (4) | Fe13xi—Fe11—Fe3 | 124.05 (10) |
C2i—Fe3—Fe1 | 109.5 (4) | Fe13xi—Fe11—Fe4xiv | 112.83 (11) |
C2i—Fe3—Fe1ii | 71.2 (4) | Fe13xi—Fe11—Fe4iv | 59.35 (9) |
C2i—Fe3—Fe1i | 47.2 (4) | Fe13xi—Fe11—Fe5 | 94.33 (11) |
C2i—Fe3—Fe5 | 103.1 (4) | Fe13xi—Fe11—Fe6xiv | 61.90 (10) |
C2i—Fe3—Fe6 | 160.3 (4) | Fe13xi—Fe11—Fe7ii | 110.04 (11) |
C2i—Fe3—Fe8 | 116.2 (4) | Fe13xi—Fe11—Fe9v | 61.73 (9) |
C2i—Fe3—Fe9v | 62.2 (4) | Fe13xi—Fe11—Fe9 | 120.17 (12) |
C2i—Fe3—Fe11 | 49.7 (4) | Fe13xi—Fe11—Fe12 | 60.59 (10) |
C2i—Fe3—C1 | 148.2 (5) | C2i—Fe11—Fe1ii | 74.3 (4) |
C3—Fe3—Fe1i | 148.9 (4) | C2i—Fe11—Fe3 | 50.4 (4) |
C3—Fe3—Fe1ii | 47.5 (4) | C2i—Fe11—Fe4iv | 47.3 (4) |
C3—Fe3—Fe1 | 110.9 (4) | C2i—Fe11—Fe4xiv | 111.2 (4) |
C3—Fe3—Fe5 | 48.5 (4) | C2i—Fe11—Fe5 | 108.1 (4) |
C3—Fe3—Fe6 | 65.2 (4) | C2i—Fe11—Fe6xiv | 96.4 (4) |
C3—Fe3—Fe8 | 105.1 (4) | C2i—Fe11—Fe7ii | 51.0 (4) |
C3—Fe3—Fe9v | 101.5 (4) | C2i—Fe11—Fe9v | 65.6 (4) |
C3—Fe3—Fe11 | 59.3 (4) | C2i—Fe11—Fe9 | 135.6 (4) |
C3—Fe3—C1 | 107.7 (5) | C2i—Fe11—Fe12 | 158.8 (4) |
C3—Fe3—C2i | 102.9 (5) | C2i—Fe11—Fe13xi | 104.0 (4) |
Fe6—Fe4—Fe1iii | 104.23 (9) | C3—Fe11—Fe1ii | 47.8 (3) |
Fe6v—Fe4—Fe1iii | 139.57 (10) | C3—Fe11—Fe3 | 46.8 (3) |
Fe7iii—Fe4—Fe1iii | 57.57 (8) | C3—Fe11—Fe4iv | 137.4 (3) |
Fe7vi—Fe4—Fe1iii | 89.17 (9) | C3—Fe11—Fe4xiv | 91.5 (3) |
Fe7—Fe4—Fe1iii | 61.68 (8) | C3—Fe11—Fe5 | 48.2 (3) |
Fe7vi—Fe4—Fe6 | 148.79 (12) | C3—Fe11—Fe6xiv | 150.3 (3) |
Fe7iii—Fe4—Fe6v | 149.76 (11) | C3—Fe11—Fe7ii | 106.5 (3) |
Fe7iii—Fe4—Fe6 | 56.45 (8) | C3—Fe11—Fe9v | 96.7 (3) |
Fe7—Fe4—Fe6 | 104.51 (10) | C3—Fe11—Fe9 | 49.7 (3) |
Fe7—Fe4—Fe6v | 105.51 (10) | C3—Fe11—Fe12 | 93.3 (3) |
Fe7vi—Fe4—Fe6v | 55.86 (8) | C3—Fe11—Fe13xi | 142.5 (3) |
Fe8—Fe4—Fe1iii | 162.85 (9) | C3—Fe11—C2i | 92.2 (5) |
Fe8—Fe4—Fe6 | 58.62 (8) | C6—Fe11—C4 | 76.7 (8) |
Fe8—Fe4—Fe6v | 57.58 (8) | Fe9—Fe12—Fe5 | 62.47 (8) |
Fe8—Fe4—Fe7iii | 107.65 (9) | Fe10xii—Fe12—Fe5 | 62.55 (8) |
Fe8—Fe4—Fe7 | 119.49 (11) | Fe10—Fe12—Fe5 | 56.70 (9) |
Fe8—Fe4—Fe7vi | 105.78 (9) | Fe10xii—Fe12—Fe9 | 58.20 (9) |
Fe9vii—Fe4—Fe1iii | 61.87 (8) | Fe10—Fe12—Fe9 | 104.45 (11) |
Fe9vii—Fe4—Fe6 | 104.55 (11) | Fe11—Fe12—Fe5 | 56.12 (9) |
Fe9vii—Fe4—Fe6v | 105.82 (10) | Fe11—Fe12—Fe9 | 56.35 (8) |
Fe9vii—Fe4—Fe7iii | 104.38 (9) | Fe11—Fe12—Fe10xii | 104.06 (11) |
Fe9vii—Fe4—Fe7 | 120.93 (12) | Fe11—Fe12—Fe10 | 110.48 (11) |
Fe9vii—Fe4—Fe7vi | 106.62 (9) | Fe12xii—Fe12—Fe5 | 121.73 (7) |
Fe9vii—Fe4—Fe8 | 119.57 (13) | Fe12xi—Fe12—Fe5 | 89.51 (7) |
Fe11viii—Fe4—Fe1iii | 89.10 (9) | Fe12xii—Fe12—Fe9 | 86.59 (8) |
Fe11vii—Fe4—Fe1iii | 57.61 (8) | Fe12xi—Fe12—Fe9 | 151.55 (10) |
Fe11vii—Fe4—Fe6v | 150.15 (14) | Fe12xii—Fe12—Fe10 | 90.25 (10) |
Fe11viii—Fe4—Fe6v | 56.14 (8) | Fe12xii—Fe12—Fe10xii | 59.18 (7) |
Fe11vii—Fe4—Fe6 | 56.51 (8) | Fe12xi—Fe12—Fe10 | 58.98 (8) |
Fe11viii—Fe4—Fe6 | 149.07 (14) | Fe12xi—Fe12—Fe10xii | 114.91 (9) |
Fe11viii—Fe4—Fe7 | 106.38 (10) | Fe12xi—Fe12—Fe11 | 105.10 (9) |
Fe11viii—Fe4—Fe7iii | 146.34 (11) | Fe12xii—Fe12—Fe11 | 140.46 (12) |
Fe11vii—Fe4—Fe7 | 104.30 (10) | Fe13xi—Fe12—Fe5 | 89.76 (10) |
Fe11viii—Fe4—Fe7vi | 56.72 (8) | Fe13xii—Fe12—Fe5 | 121.37 (11) |
Fe11vii—Fe4—Fe7vi | 146.46 (11) | Fe13—Fe12—Fe5 | 146.13 (12) |
Fe11vii—Fe4—Fe7iii | 55.22 (8) | Fe13xi—Fe12—Fe9 | 114.56 (11) |
Fe11vii—Fe4—Fe8 | 107.75 (11) | Fe13xii—Fe12—Fe9 | 58.91 (9) |
Fe11viii—Fe4—Fe8 | 106.00 (11) | Fe13—Fe12—Fe9 | 144.65 (13) |
Fe11viii—Fe4—Fe9vii | 57.18 (7) | Fe13xii—Fe12—Fe10xii | 86.76 (10) |
Fe11vii—Fe4—Fe9vii | 56.04 (7) | Fe13xii—Fe12—Fe10 | 140.78 (12) |
Fe13ix—Fe4—Fe1iii | 123.20 (11) | Fe13xi—Fe12—Fe10 | 105.76 (11) |
Fe13ix—Fe4—Fe6 | 90.29 (11) | Fe13—Fe12—Fe10 | 90.76 (10) |
Fe13ix—Fe4—Fe6v | 59.59 (10) | Fe13—Fe12—Fe10xii | 109.55 (12) |
Fe13ix—Fe4—Fe7 | 163.04 (10) | Fe13xi—Fe12—Fe10xii | 151.96 (12) |
Fe13ix—Fe4—Fe7vi | 105.94 (10) | Fe13—Fe12—Fe11 | 146.27 (12) |
Fe13ix—Fe4—Fe7iii | 140.94 (11) | Fe13xi—Fe12—Fe11 | 58.99 (9) |
Fe13ix—Fe4—Fe8 | 61.38 (9) | Fe13xii—Fe12—Fe11 | 89.97 (10) |
Fe13ix—Fe4—Fe9vii | 61.33 (9) | Fe13xii—Fe12—Fe12xi | 148.67 (9) |
Fe13ix—Fe4—Fe11vii | 90.69 (11) | Fe13xi—Fe12—Fe12xi | 56.79 (6) |
Fe13ix—Fe4—Fe11viii | 59.46 (10) | Fe13—Fe12—Fe12xi | 63.02 (11) |
C1—Fe4—Fe1iii | 102.1 (4) | Fe14—Fe12—Fe5 | 144.99 (12) |
C1—Fe4—Fe6 | 50.0 (4) | Fe14—Fe12—Fe9 | 108.63 (11) |
C1—Fe4—Fe6v | 103.5 (4) | Fe14—Fe12—Fe10 | 146.84 (12) |
C1—Fe4—Fe7 | 61.3 (4) | Fe14—Fe12—Fe10xii | 144.85 (13) |
C1—Fe4—Fe7vi | 100.1 (4) | Fe14—Fe12—Fe11 | 90.07 (10) |
C1—Fe4—Fe7iii | 47.8 (4) | Fe14—Fe12—Fe12xi | 91.30 (8) |
C1—Fe4—Fe8 | 67.6 (4) | Fe14—Fe12—Fe13 | 60.45 (9) |
C1—Fe4—Fe9vii | 148.1 (4) | Fe14—Fe12—Fe13xii | 60.83 (9) |
C1—Fe4—Fe11viii | 154.5 (4) | Fe14—Fe12—Fe13xi | 62.10 (9) |
C1—Fe4—Fe11vii | 92.1 (4) | C6—Fe12—C4 | 121.2 (11) |
C1—Fe4—Fe13ix | 127.1 (4) | C6—Fe12—C4xii | 129.9 (11) |
C2iii—Fe4—Fe1iii | 47.5 (4) | C9—Fe12—C7xii | 128.2 (12) |
C2iii—Fe4—Fe6 | 151.8 (4) | C9xi—Fe12—C7xii | 103.1 (9) |
C2iii—Fe4—Fe6v | 92.0 (4) | Fe6xv—Fe13—Fe4xvi | 62.03 (8) |
C2iii—Fe4—Fe7iii | 99.0 (4) | Fe8xvi—Fe13—Fe4xvi | 57.43 (8) |
C2iii—Fe4—Fe7vi | 48.6 (4) | Fe8xvi—Fe13—Fe6xv | 57.23 (8) |
C2iii—Fe4—Fe7 | 64.7 (4) | Fe9xi—Fe13—Fe4xvi | 57.50 (8) |
C2iii—Fe4—Fe8 | 149.6 (4) | Fe9xi—Fe13—Fe6xv | 104.80 (11) |
C2iii—Fe4—Fe9vii | 65.4 (4) | Fe9xi—Fe13—Fe8xvi | 112.22 (11) |
C2iii—Fe4—Fe11viii | 48.9 (4) | Fe11xii—Fe13—Fe4xvi | 61.18 (8) |
C2iii—Fe4—Fe11vii | 99.3 (4) | Fe11xii—Fe13—Fe6xv | 57.42 (10) |
C2iii—Fe4—Fe13ix | 105.6 (4) | Fe11xii—Fe13—Fe8xvi | 104.33 (11) |
C2iii—Fe4—C1 | 125.9 (6) | Fe11xii—Fe13—Fe9xi | 56.59 (8) |
Fe6—Fe5—Fe3 | 61.34 (10) | Fe12—Fe13—Fe4xvi | 145.06 (12) |
Fe8x—Fe5—Fe3 | 90.19 (11) | Fe12xii—Fe13—Fe4xvi | 121.60 (11) |
Fe8—Fe5—Fe3 | 59.81 (9) | Fe12xi—Fe13—Fe4xvi | 90.17 (10) |
Fe8x—Fe5—Fe6 | 59.03 (8) | Fe12xi—Fe13—Fe6xv | 151.99 (13) |
Fe8—Fe5—Fe6 | 57.44 (8) | Fe12xii—Fe13—Fe6xv | 86.29 (11) |
Fe9—Fe5—Fe3 | 90.53 (11) | Fe12—Fe13—Fe6xv | 145.76 (14) |
Fe9v—Fe5—Fe3 | 59.84 (9) | Fe12xi—Fe13—Fe8xvi | 106.20 (11) |
Fe9—Fe5—Fe6 | 107.75 (11) | Fe12xii—Fe13—Fe8xvi | 140.34 (12) |
Fe9v—Fe5—Fe6 | 105.79 (11) | Fe12—Fe13—Fe8xvi | 145.18 (12) |
Fe9v—Fe5—Fe8 | 55.85 (8) | Fe12xi—Fe13—Fe9xi | 57.81 (8) |
Fe9—Fe5—Fe8x | 56.06 (8) | Fe12xii—Fe13—Fe9xi | 90.25 (10) |
Fe9—Fe5—Fe8 | 150.20 (14) | Fe12—Fe13—Fe9xi | 88.93 (10) |
Fe9v—Fe5—Fe8x | 149.40 (15) | Fe12xii—Fe13—Fe11xii | 60.42 (9) |
Fe10—Fe5—Fe3 | 163.25 (10) | Fe12—Fe13—Fe11xii | 110.46 (11) |
Fe10xi—Fe5—Fe3 | 106.31 (10) | Fe12xi—Fe13—Fe11xii | 113.90 (10) |
Fe10xii—Fe5—Fe3 | 140.60 (11) | Fe14—Fe13—Fe4xvi | 146.06 (12) |
Fe10xi—Fe5—Fe6 | 105.52 (10) | Fe14xi—Fe13—Fe4xvi | 89.57 (10) |
Fe10xii—Fe5—Fe6 | 107.46 (10) | Fe14xii—Fe13—Fe4xvi | 120.73 (11) |
Fe10—Fe5—Fe6 | 120.67 (13) | Fe14—Fe13—Fe6xv | 111.29 (11) |
Fe10xii—Fe5—Fe8 | 149.56 (12) | Fe14xi—Fe13—Fe6xv | 116.67 (11) |
Fe10—Fe5—Fe8x | 105.02 (10) | Fe14xii—Fe13—Fe6xv | 58.71 (9) |
Fe10xi—Fe5—Fe8x | 148.72 (12) | Fe14xii—Fe13—Fe8xvi | 88.81 (9) |
Fe10—Fe5—Fe8 | 106.06 (10) | Fe14xi—Fe13—Fe8xvi | 59.75 (9) |
Fe10xi—Fe5—Fe8 | 55.85 (8) | Fe14—Fe13—Fe8xvi | 90.23 (10) |
Fe10xii—Fe5—Fe8x | 56.01 (8) | Fe14—Fe13—Fe9xi | 143.79 (12) |
Fe10—Fe5—Fe9v | 105.51 (11) | Fe14xi—Fe13—Fe9xi | 103.42 (11) |
Fe10xi—Fe5—Fe9v | 56.55 (8) | Fe14xii—Fe13—Fe9xi | 141.27 (12) |
Fe10xi—Fe5—Fe9 | 146.71 (12) | Fe14xii—Fe13—Fe11xii | 87.57 (10) |
Fe10—Fe5—Fe9 | 103.68 (10) | Fe14—Fe13—Fe11xii | 146.76 (13) |
Fe10xii—Fe5—Fe9v | 146.75 (12) | Fe14xi—Fe13—Fe11xii | 150.00 (13) |
Fe10xii—Fe5—Fe9 | 55.17 (8) | Fe14—Fe13—Fe12 | 59.31 (9) |
Fe11—Fe5—Fe3 | 61.15 (9) | Fe14xi—Fe13—Fe12xii | 148.24 (12) |
Fe11—Fe5—Fe6 | 119.55 (14) | Fe14xi—Fe13—Fe12xi | 55.58 (9) |
Fe11—Fe5—Fe8 | 105.61 (11) | Fe14xii—Fe13—Fe12xi | 148.75 (12) |
Fe11—Fe5—Fe8x | 104.54 (11) | Fe14—Fe13—Fe12xii | 89.29 (10) |
Fe11—Fe5—Fe9v | 57.38 (8) | Fe14xi—Fe13—Fe12 | 89.34 (11) |
Fe11—Fe5—Fe9 | 56.44 (8) | Fe14xii—Fe13—Fe12 | 90.96 (11) |
Fe11—Fe5—Fe10xii | 104.79 (10) | Fe14—Fe13—Fe12xi | 89.52 (10) |
Fe11—Fe5—Fe10xi | 106.69 (10) | Fe14xii—Fe13—Fe12xii | 56.30 (9) |
Fe11—Fe5—Fe10 | 119.78 (13) | C5xii—Fe13—C4xii | 147.8 (8) |
Fe12—Fe5—Fe3 | 123.04 (11) | C6xi—Fe13—C4xii | 101.3 (7) |
Fe12—Fe5—Fe6 | 162.81 (11) | C6xi—Fe13—C5xii | 104.2 (8) |
Fe12—Fe5—Fe8x | 103.77 (10) | C8—Fe13—C7 | 126.1 (12) |
Fe12—Fe5—Fe8 | 139.75 (11) | C9—Fe13—C7 | 117.6 (12) |
Fe12—Fe5—Fe9 | 57.49 (9) | C9—Fe13—C8 | 108.3 (14) |
Fe12—Fe5—Fe9v | 89.37 (10) | Fe6xiv—Fe14—Fe5xiv | 57.36 (9) |
Fe12—Fe5—Fe10 | 60.71 (9) | Fe8xiv—Fe14—Fe5xiv | 61.72 (8) |
Fe12—Fe5—Fe10xi | 89.49 (10) | Fe8xiv—Fe14—Fe6xiv | 57.08 (9) |
Fe12—Fe5—Fe10xii | 57.79 (8) | Fe10xv—Fe14—Fe5xiv | 61.45 (8) |
Fe12—Fe5—Fe11 | 61.89 (9) | Fe10xiv—Fe14—Fe5xiv | 56.70 (9) |
Fe14vii—Fe5—Fe3 | 111.45 (11) | Fe10xv—Fe14—Fe6xiv | 104.37 (11) |
Fe14vii—Fe5—Fe6 | 61.17 (10) | Fe10xiv—Fe14—Fe6xiv | 111.61 (12) |
Fe14vii—Fe5—Fe8x | 90.24 (10) | Fe10xiv—Fe14—Fe8xiv | 103.50 (10) |
Fe14vii—Fe5—Fe8 | 59.43 (9) | Fe10xv—Fe14—Fe8xiv | 57.25 (9) |
Fe14vii—Fe5—Fe9v | 105.68 (10) | Fe12—Fe14—Fe5xiv | 145.61 (13) |
Fe14vii—Fe5—Fe9 | 140.51 (11) | Fe12—Fe14—Fe6xiv | 90.19 (11) |
Fe14vii—Fe5—Fe10 | 62.44 (9) | Fe12—Fe14—Fe8xiv | 112.44 (11) |
Fe14vii—Fe5—Fe10xii | 90.26 (10) | Fe12—Fe14—Fe10xv | 147.55 (13) |
Fe14vii—Fe5—Fe10xi | 59.19 (9) | Fe12—Fe14—Fe10xiv | 144.00 (12) |
Fe14vii—Fe5—Fe11 | 163.04 (10) | Fe13xi—Fe14—Fe5xiv | 89.82 (10) |
Fe14vii—Fe5—Fe12 | 123.15 (13) | Fe13xii—Fe14—Fe5xiv | 121.00 (11) |
C3—Fe5—Fe3 | 48.5 (4) | Fe13—Fe14—Fe5xiv | 144.56 (12) |
C3—Fe5—Fe6 | 67.6 (4) | Fe13xi—Fe14—Fe6xiv | 60.17 (9) |
C3—Fe5—Fe8x | 49.9 (4) | Fe13xii—Fe14—Fe6xiv | 88.99 (10) |
C3—Fe5—Fe8 | 103.6 (4) | Fe13—Fe14—Fe6xiv | 146.71 (12) |
C3—Fe5—Fe9 | 48.0 (4) | Fe13xi—Fe14—Fe8xiv | 116.95 (11) |
C3—Fe5—Fe9v | 100.6 (4) | Fe13xii—Fe14—Fe8xiv | 59.29 (9) |
C3—Fe5—Fe10 | 148.1 (4) | Fe13—Fe14—Fe8xiv | 145.24 (13) |
C3—Fe5—Fe10xi | 154.7 (4) | Fe13—Fe14—Fe10xv | 108.87 (12) |
C3—Fe5—Fe10xii | 92.1 (4) | Fe13xii—Fe14—Fe10xv | 87.46 (10) |
C3—Fe5—Fe11 | 61.5 (4) | Fe13xi—Fe14—Fe10xiv | 103.87 (10) |
C3—Fe5—Fe12 | 102.2 (4) | Fe13xii—Fe14—Fe10xiv | 140.83 (12) |
C3—Fe5—Fe14vii | 126.8 (4) | Fe13xi—Fe14—Fe10xv | 150.47 (12) |
C5vii—Fe5—C4 | 126.5 (7) | Fe13—Fe14—Fe10xiv | 89.00 (10) |
Fe4—Fe6—Fe3 | 91.57 (10) | Fe13—Fe14—Fe12 | 60.24 (9) |
Fe4x—Fe6—Fe3 | 119.47 (11) | Fe13xii—Fe14—Fe12 | 63.58 (9) |
Fe5—Fe6—Fe3 | 61.48 (9) | Fe13xi—Fe14—Fe12 | 61.60 (9) |
Fe5—Fe6—Fe4 | 124.01 (10) | Fe14xii—Fe14—Fe5xiv | 121.22 (7) |
Fe5—Fe6—Fe4x | 119.80 (10) | Fe14xi—Fe14—Fe5xiv | 90.56 (7) |
Fe7iii—Fe6—Fe3 | 90.85 (11) | Fe14xi—Fe14—Fe6xiv | 107.32 (10) |
Fe7iii—Fe6—Fe4x | 61.29 (8) | Fe14xii—Fe14—Fe6xiv | 140.39 (12) |
Fe7iii—Fe6—Fe4 | 64.42 (9) | Fe14xi—Fe14—Fe8xiv | 152.18 (10) |
Fe7iii—Fe6—Fe5 | 149.71 (14) | Fe14xii—Fe14—Fe8xiv | 86.39 (8) |
Fe8x—Fe6—Fe3 | 92.22 (9) | Fe14xi—Fe14—Fe10xiv | 58.18 (8) |
Fe8—Fe6—Fe3 | 62.26 (8) | Fe14xi—Fe14—Fe10xv | 113.39 (9) |
Fe8—Fe6—Fe4 | 59.02 (8) | Fe14xii—Fe14—Fe10xv | 59.77 (7) |
Fe8—Fe6—Fe4x | 175.22 (12) | Fe14xii—Fe14—Fe10xiv | 89.85 (10) |
Fe8x—Fe6—Fe4 | 173.47 (11) | Fe14xi—Fe14—Fe12 | 88.70 (8) |
Fe8x—Fe6—Fe4x | 57.28 (8) | Fe14xii—Fe14—Fe12 | 90.53 (8) |
Fe8—Fe6—Fe5 | 64.98 (8) | Fe14xi—Fe14—Fe13xi | 56.39 (6) |
Fe8x—Fe6—Fe5 | 62.52 (8) | Fe14xi—Fe14—Fe13 | 60.74 (11) |
Fe8x—Fe6—Fe7iii | 110.20 (10) | Fe14xi—Fe14—Fe13xii | 148.23 (9) |
Fe8—Fe6—Fe7iii | 114.85 (10) | Fe14xii—Fe14—Fe13xii | 56.50 (6) |
Fe11vii—Fe6—Fe3 | 147.89 (14) | Fe14xii—Fe14—Fe13 | 60.98 (11) |
Fe11vii—Fe6—Fe4 | 64.55 (8) | Fe14xii—Fe14—Fe13xi | 148.28 (9) |
Fe11vii—Fe6—Fe4x | 60.95 (7) | C6—Fe14—C5xii | 130.2 (11) |
Fe11vii—Fe6—Fe5 | 149.55 (15) | C6—Fe14—C5 | 121.3 (11) |
Fe11vii—Fe6—Fe7iii | 60.22 (10) | C8xi—Fe14—C7xii | 103.5 (11) |
Fe11vii—Fe6—Fe8x | 109.88 (9) | C8—Fe14—C7xii | 127.6 (11) |
Fe11vii—Fe6—Fe8 | 115.01 (10) | Fe3—C1—Fe1 | 76.0 (5) |
Fe13xiii—Fe6—Fe3 | 150.22 (12) | Fe4—C1—Fe1 | 143.8 (7) |
Fe13xiii—Fe6—Fe4x | 58.38 (9) | Fe4—C1—Fe3 | 136.1 (7) |
Fe13xiii—Fe6—Fe4 | 116.56 (12) | Fe6—C1—Fe1 | 128.1 (7) |
Fe13xiii—Fe6—Fe5 | 92.78 (11) | Fe6—C1—Fe3 | 79.9 (5) |
Fe13xiii—Fe6—Fe7iii | 109.43 (11) | Fe6—C1—Fe4 | 81.6 (5) |
Fe13xiii—Fe6—Fe8 | 122.71 (12) | Fe7—C1—Fe1 | 72.8 (4) |
Fe13xiii—Fe6—Fe8x | 60.81 (9) | Fe7iii—C1—Fe1 | 81.8 (5) |
Fe13xiii—Fe6—Fe11vii | 60.68 (9) | Fe7—C1—Fe3 | 142.1 (6) |
Fe14vii—Fe6—Fe3 | 111.80 (11) | Fe7iii—C1—Fe3 | 127.1 (7) |
Fe14vii—Fe6—Fe4x | 119.49 (12) | Fe7—C1—Fe4 | 71.0 (4) |
Fe14vii—Fe6—Fe4 | 91.15 (11) | Fe7iii—C1—Fe4 | 86.3 (5) |
Fe14vii—Fe6—Fe5 | 61.47 (10) | Fe7—C1—Fe6 | 137.0 (6) |
Fe14vii—Fe6—Fe7iii | 147.62 (13) | Fe7iii—C1—Fe6 | 77.3 (5) |
Fe14vii—Fe6—Fe8 | 61.92 (9) | Fe8—C1—Fe1 | 139.6 (6) |
Fe14vii—Fe6—Fe8x | 92.38 (11) | Fe8—C1—Fe3 | 69.5 (4) |
Fe14vii—Fe6—Fe11vii | 90.87 (12) | Fe8—C1—Fe4 | 66.6 (4) |
Fe14vii—Fe6—Fe13xiii | 61.12 (10) | Fe8—C1—Fe6 | 65.7 (4) |
C1—Fe6—Fe3 | 50.9 (4) | Fe8—C1—Fe7iii | 136.3 (6) |
C1—Fe6—Fe4 | 48.4 (4) | Fe8—C1—Fe7 | 126.4 (6) |
C1—Fe6—Fe4x | 110.0 (4) | Fe3ii—C2—Fe1 | 83.2 (5) |
C1—Fe6—Fe5 | 109.2 (4) | Fe4iii—C2—Fe1 | 84.8 (5) |
C1—Fe6—Fe7iii | 51.6 (4) | Fe4iii—C2—Fe3ii | 138.9 (8) |
C1—Fe6—Fe8x | 131.9 (4) | Fe7iii—C2—Fe1 | 73.1 (4) |
C1—Fe6—Fe8 | 67.2 (4) | Fe7x—C2—Fe1 | 139.8 (8) |
C1—Fe6—Fe11vii | 97.4 (4) | Fe7x—C2—Fe3ii | 127.9 (7) |
C1—Fe6—Fe13xiii | 157.9 (4) | Fe7iii—C2—Fe3ii | 142.3 (6) |
C1—Fe6—Fe14vii | 127.0 (4) | Fe7iii—C2—Fe4iii | 68.4 (4) |
C3—Fe6—Fe3 | 45.1 (3) | Fe7x—C2—Fe4iii | 84.2 (5) |
C3—Fe6—Fe4 | 136.6 (3) | Fe9i—C2—Fe1 | 72.7 (4) |
C3—Fe6—Fe4x | 89.5 (3) | Fe9i—C2—Fe3ii | 70.8 (4) |
C3—Fe6—Fe5 | 46.2 (3) | Fe9i—C2—Fe4iii | 68.0 (4) |
C3—Fe6—Fe7iii | 105.9 (3) | Fe9i—C2—Fe7x | 136.1 (6) |
C3—Fe6—Fe8x | 47.1 (3) | Fe9i—C2—Fe7iii | 126.0 (5) |
C3—Fe6—Fe8 | 94.4 (3) | Fe11ii—C2—Fe1 | 138.8 (8) |
C3—Fe6—Fe11vii | 150.4 (3) | Fe11ii—C2—Fe3ii | 79.9 (5) |
C3—Fe6—Fe13xiii | 106.6 (3) | Fe11ii—C2—Fe4iii | 83.8 (5) |
C3—Fe6—Fe14vii | 106.4 (3) | Fe11ii—C2—Fe7iii | 136.4 (6) |
C3—Fe6—C1 | 91.2 (5) | Fe11ii—C2—Fe7x | 77.8 (5) |
C6vii—Fe6—C5vii | 76.3 (8) | Fe11ii—C2—Fe9i | 66.3 (4) |
Fe4—Fe7—Fe1iii | 61.84 (8) | Fe3—C3—Fe1ii | 86.0 (5) |
Fe4vi—Fe7—Fe1iii | 119.99 (10) | Fe5—C3—Fe1ii | 143.4 (7) |
Fe4—Fe7—Fe1 | 95.91 (10) | Fe5—C3—Fe3 | 83.0 (5) |
Fe4iii—Fe7—Fe1iii | 89.55 (8) | Fe6—C3—Fe1ii | 140.2 (6) |
Fe4iii—Fe7—Fe1 | 59.72 (8) | Fe6—C3—Fe3 | 69.7 (4) |
Fe4vi—Fe7—Fe1 | 115.32 (10) | Fe6—C3—Fe5 | 66.2 (4) |
Fe6iii—Fe7—Fe1iii | 88.99 (10) | Fe8x—C3—Fe1ii | 128.2 (7) |
Fe6iii—Fe7—Fe1 | 108.22 (11) | Fe8x—C3—Fe3 | 135.8 (7) |
Fe6iii—Fe7—Fe4iii | 59.13 (8) | Fe8x—C3—Fe5 | 81.5 (5) |
Fe6iii—Fe7—Fe4vi | 62.85 (9) | Fe8x—C3—Fe6 | 66.2 (4) |
Fe6iii—Fe7—Fe4 | 149.64 (13) | Fe9—C3—Fe1ii | 82.4 (5) |
Fe7iii—Fe7—Fe1iii | 60.77 (10) | Fe9—C3—Fe3 | 142.7 (7) |
Fe7vi—Fe7—Fe1 | 124.39 (14) | Fe9—C3—Fe5 | 85.6 (5) |
Fe7iii—Fe7—Fe1 | 63.06 (10) | Fe9—C3—Fe6 | 135.5 (6) |
Fe7vi—Fe7—Fe1iii | 93.52 (13) | Fe9—C3—Fe8x | 76.6 (4) |
Fe7iii—Fe7—Fe4vi | 170.31 (18) | Fe11—C3—Fe1ii | 73.1 (4) |
Fe7iii—Fe7—Fe4 | 66.53 (12) | Fe11—C3—Fe3 | 73.9 (4) |
Fe7vi—Fe7—Fe4 | 64.78 (12) | Fe11—C3—Fe5 | 70.3 (4) |
Fe7iii—Fe7—Fe4iii | 57.44 (10) | Fe11—C3—Fe6 | 125.5 (6) |
Fe7vi—Fe7—Fe4iii | 170.96 (17) | Fe11—C3—Fe8x | 136.3 (6) |
Fe7vi—Fe7—Fe4vi | 58.11 (10) | Fe11—C3—Fe9 | 68.8 (4) |
Fe7vi—Fe7—Fe6iii | 112.38 (14) | Fe9v—C4—Fe5 | 84.0 (9) |
Fe7iii—Fe7—Fe6iii | 108.02 (13) | Fe10—C4—Fe5 | 69.5 (6) |
Fe11i—Fe7—Fe1iii | 145.51 (12) | Fe10xi—C4—Fe5 | 84.3 (9) |
Fe11i—Fe7—Fe1 | 60.89 (8) | Fe10xi—C4—Fe9v | 77.3 (7) |
Fe11i—Fe7—Fe4vi | 61.43 (8) | Fe10—C4—Fe9v | 137.2 (11) |
Fe11i—Fe7—Fe4iii | 62.56 (8) | Fe11—C4—Fe5 | 68.1 (5) |
Fe11i—Fe7—Fe4 | 150.34 (13) | Fe11—C4—Fe9v | 66.6 (5) |
Fe11i—Fe7—Fe6iii | 60.02 (10) | Fe11—C4—Fe10xi | 136.0 (11) |
C1—Fe7—Fe1 | 48.1 (3) | Fe11—C4—Fe10 | 126.7 (6) |
C1iii—Fe7—Fe1iii | 49.0 (4) | Fe12—C4—Fe5 | 85.3 (6) |
C1—Fe7—Fe1iii | 93.0 (3) | Fe12xi—C4—Fe5 | 141.1 (10) |
C1iii—Fe7—Fe1 | 102.4 (4) | Fe12—C4—Fe9v | 139.4 (9) |
C1—Fe7—Fe4 | 47.8 (3) | Fe12xi—C4—Fe9v | 126.2 (7) |
C1iii—Fe7—Fe4iii | 45.9 (4) | Fe12xi—C4—Fe10xi | 80.2 (6) |
C1iii—Fe7—Fe4vi | 111.0 (4) | Fe12—C4—Fe10 | 72.9 (5) |
C1iii—Fe7—Fe4 | 106.7 (4) | Fe12—C4—Fe10xi | 140.2 (10) |
C1—Fe7—Fe4vi | 137.1 (3) | Fe12xi—C4—Fe10 | 71.7 (6) |
C1—Fe7—Fe4iii | 92.0 (4) | Fe12—C4—Fe11 | 73.0 (5) |
C1—Fe7—Fe6iii | 151.1 (4) | Fe12xi—C4—Fe11 | 141.8 (11) |
C1iii—Fe7—Fe6iii | 51.1 (4) | Fe13xi—C4—Fe5 | 138.4 (9) |
C1—Fe7—Fe11i | 107.0 (3) | Fe13xi—C4—Fe9v | 79.8 (6) |
C1iii—Fe7—Fe11i | 96.9 (4) | Fe13xi—C4—Fe10 | 141.5 (11) |
C2iii—Fe7—Fe1 | 142.8 (3) | Fe13xi—C4—Fe10xi | 128.0 (7) |
C2v—Fe7—Fe1iii | 158.1 (4) | Fe13xi—C4—Fe11 | 70.4 (5) |
C2iii—Fe7—Fe1iii | 45.2 (3) | Fe13xi—C4—Fe12xi | 76.8 (8) |
C2v—Fe7—Fe1 | 74.4 (4) | Fe13xi—C4—Fe12 | 82.7 (8) |
C2iii—Fe7—Fe4iii | 134.5 (3) | Fe6xiv—C5—Fe5xiv | 67.1 (5) |
C2v—Fe7—Fe4vi | 47.1 (4) | Fe8iv—C5—Fe5xiv | 81.9 (8) |
C2v—Fe7—Fe4 | 107.6 (4) | Fe8iv—C5—Fe6xiv | 67.0 (5) |
C2iii—Fe7—Fe4 | 46.9 (3) | Fe10xiv—C5—Fe5xiv | 69.5 (5) |
C2v—Fe7—Fe4iii | 111.6 (4) | Fe10xvi—C5—Fe5xiv | 85.7 (9) |
C2iii—Fe7—Fe4vi | 91.4 (3) | Fe10xiv—C5—Fe6xiv | 126.2 (7) |
C2iii—Fe7—Fe6iii | 106.9 (3) | Fe10xvi—C5—Fe6xiv | 136.4 (10) |
C2v—Fe7—Fe6iii | 96.7 (4) | Fe10xvi—C5—Fe8iv | 76.3 (8) |
C2v—Fe7—Fe11i | 51.1 (4) | Fe10xiv—C5—Fe8iv | 134.6 (11) |
C2iii—Fe7—Fe11i | 152.7 (3) | Fe13xi—C5—Fe5xiv | 137.6 (9) |
C2v—Fe7—C1iii | 145.8 (6) | Fe13xi—C5—Fe6xiv | 70.6 (5) |
C2v—Fe7—C1 | 92.1 (5) | Fe13xi—C5—Fe8iv | 80.6 (6) |
C2iii—Fe7—C1 | 94.7 (5) | Fe13xi—C5—Fe10xvi | 126.4 (8) |
C2iii—Fe7—C1iii | 90.3 (5) | Fe13xi—C5—Fe10xiv | 143.4 (11) |
Fe4—Fe8—Fe3 | 92.72 (10) | Fe14—C5—Fe5xiv | 83.5 (6) |
Fe5—Fe8—Fe3 | 58.78 (8) | Fe14xi—C5—Fe5xiv | 141.3 (9) |
Fe5v—Fe8—Fe3 | 116.72 (11) | Fe14xi—C5—Fe6xiv | 141.0 (11) |
Fe5—Fe8—Fe4 | 119.93 (10) | Fe14—C5—Fe6xiv | 70.4 (6) |
Fe5v—Fe8—Fe4 | 123.59 (10) | Fe14—C5—Fe8iv | 137.3 (9) |
Fe6v—Fe8—Fe3 | 122.47 (11) | Fe14xi—C5—Fe8iv | 128.7 (8) |
Fe6—Fe8—Fe3 | 60.99 (8) | Fe14—C5—Fe10xvi | 141.9 (9) |
Fe6v—Fe8—Fe4 | 65.14 (8) | Fe14xi—C5—Fe10xvi | 80.8 (6) |
Fe6—Fe8—Fe4 | 62.36 (8) | Fe14—C5—Fe10xiv | 74.7 (6) |
Fe6—Fe8—Fe5v | 174.05 (11) | Fe14xi—C5—Fe10xiv | 71.8 (5) |
Fe6v—Fe8—Fe5v | 58.45 (8) | Fe14xi—C5—Fe13xi | 77.2 (7) |
Fe6v—Fe8—Fe5 | 174.93 (11) | Fe14—C5—Fe13xi | 83.9 (9) |
Fe6—Fe8—Fe5 | 57.57 (9) | Fe9—C6—Fe6xiv | 105.8 (10) |
Fe9v—Fe8—Fe3 | 61.40 (8) | Fe11—C6—Fe6xiv | 59.9 (6) |
Fe9v—Fe8—Fe4 | 150.00 (13) | Fe11—C6—Fe9 | 57.5 (5) |
Fe9v—Fe8—Fe5v | 64.21 (8) | Fe12—C6—Fe6xiv | 123.3 (13) |
Fe9v—Fe8—Fe5 | 61.47 (8) | Fe12—C6—Fe9 | 72.3 (7) |
Fe9v—Fe8—Fe6v | 114.27 (9) | Fe12—C6—Fe11 | 75.2 (9) |
Fe9v—Fe8—Fe6 | 110.75 (10) | Fe13xii—C6—Fe6xiv | 122.0 (11) |
Fe10xi—Fe8—Fe3 | 110.25 (10) | Fe13xii—C6—Fe9 | 72.1 (7) |
Fe10xi—Fe8—Fe4 | 149.20 (13) | Fe13xii—C6—Fe11 | 124.8 (12) |
Fe10xi—Fe8—Fe5v | 64.48 (9) | Fe13xii—C6—Fe12 | 111.3 (11) |
Fe10xi—Fe8—Fe5 | 61.64 (8) | Fe14—C6—Fe6xiv | 76.1 (7) |
Fe10xi—Fe8—Fe6v | 114.22 (10) | Fe14—C6—Fe9 | 177.3 (14) |
Fe10xi—Fe8—Fe6 | 110.60 (10) | Fe14—C6—Fe11 | 122.7 (12) |
Fe10xi—Fe8—Fe9v | 60.44 (10) | Fe14—C6—Fe12 | 105.1 (15) |
Fe13ix—Fe8—Fe3 | 150.21 (11) | Fe14—C6—Fe13xii | 108.7 (14) |
Fe13ix—Fe8—Fe4 | 61.19 (9) | Fe6xvi—C7—Fe4xvi | 80.5 (7) |
Fe13ix—Fe8—Fe5 | 119.80 (11) | Fe8xvi—C7—Fe4xvi | 65.7 (5) |
Fe13ix—Fe8—Fe5v | 91.13 (10) | Fe8xvi—C7—Fe6xvi | 64.4 (5) |
Fe13ix—Fe8—Fe6v | 61.96 (9) | Fe9xi—C7—Fe4xvi | 72.2 (7) |
Fe13ix—Fe8—Fe6 | 92.29 (10) | Fe9xi—C7—Fe6xvi | 137.6 (11) |
Fe13ix—Fe8—Fe9v | 147.46 (12) | Fe9xi—C7—Fe8xvi | 126.9 (8) |
Fe13ix—Fe8—Fe10xi | 90.55 (10) | Fe11xi—C7—Fe4xvi | 86.9 (9) |
Fe14vii—Fe8—Fe3 | 110.07 (10) | Fe11xi—C7—Fe6xvi | 76.8 (7) |
Fe14vii—Fe8—Fe4 | 92.50 (10) | Fe11xi—C7—Fe8xvi | 135.0 (9) |
Fe14vii—Fe8—Fe5 | 58.85 (9) | Fe11xi—C7—Fe9xi | 70.0 (7) |
Fe14vii—Fe8—Fe5v | 116.86 (12) | Fe12xi—C7—Fe4xvi | 146.3 (11) |
Fe14vii—Fe8—Fe6v | 122.56 (11) | Fe12xi—C7—Fe6xvi | 127.5 (9) |
Fe14vii—Fe8—Fe6 | 60.99 (9) | Fe12xi—C7—Fe8xvi | 138.8 (11) |
Fe14vii—Fe8—Fe9v | 109.85 (11) | Fe12xi—C7—Fe9xi | 74.1 (6) |
Fe14vii—Fe8—Fe10xi | 60.97 (9) | Fe12xi—C7—Fe11xi | 83.0 (7) |
Fe14vii—Fe8—Fe13ix | 60.96 (9) | Fe13—C7—Fe4xvi | 83.2 (7) |
C1—Fe8—Fe3 | 46.9 (3) | Fe13—C7—Fe6xvi | 133.2 (10) |
C1—Fe8—Fe4 | 45.8 (3) | Fe13—C7—Fe8xvi | 68.9 (6) |
C1—Fe8—Fe5 | 89.9 (3) | Fe13—C7—Fe9xi | 75.5 (6) |
C1—Fe8—Fe5v | 136.2 (3) | Fe13—C7—Fe11xi | 145.5 (11) |
C1—Fe8—Fe6v | 94.1 (3) | Fe13—C7—Fe12xi | 87.1 (8) |
C1—Fe8—Fe6 | 47.1 (3) | Fe14xi—C7—Fe4xvi | 133.6 (10) |
C1—Fe8—Fe9v | 106.7 (3) | Fe14xi—C7—Fe6xvi | 78.2 (7) |
C1—Fe8—Fe10xi | 151.5 (3) | Fe14xi—C7—Fe8xvi | 67.9 (6) |
C1—Fe8—Fe13ix | 105.8 (3) | Fe14xi—C7—Fe9xi | 143.5 (10) |
C1—Fe8—Fe14vii | 106.6 (3) | Fe14xi—C7—Fe11xi | 126.6 (9) |
C3v—Fe8—Fe3 | 72.8 (4) | Fe14xi—C7—Fe12xi | 76.3 (7) |
C3v—Fe8—Fe4 | 108.6 (4) | Fe14xi—C7—Fe13 | 82.1 (9) |
C3v—Fe8—Fe5 | 110.2 (4) | Fe8xvi—C8—Fe5xv | 61.3 (7) |
C3v—Fe8—Fe5v | 48.6 (4) | Fe13—C8—Fe5xv | 125.1 (16) |
C3v—Fe8—Fe6 | 131.5 (4) | Fe13—C8—Fe8xvi | 74.6 (11) |
C3v—Fe8—Fe6v | 66.7 (4) | Fe14xii—C8—Fe5xv | 73.1 (9) |
C3v—Fe8—Fe9v | 51.8 (4) | Fe14—C8—Fe5xv | 126.2 (14) |
C3v—Fe8—Fe10xi | 97.9 (4) | Fe14xii—C8—Fe8xvi | 123.9 (15) |
C3v—Fe8—Fe13ix | 126.7 (4) | Fe14—C8—Fe8xvi | 120.4 (13) |
C3v—Fe8—Fe14vii | 158.7 (4) | Fe14xii—C8—Fe13 | 111.8 (16) |
C3v—Fe8—C1 | 90.8 (5) | Fe14—C8—Fe13 | 103.3 (15) |
C8ix—Fe8—C7ix | 77.2 (7) | Fe12—C9—Fe9xi | 119.4 (14) |
Fe3x—Fe9—Fe1ii | 60.30 (8) | Fe12xii—C9—Fe9xi | 124.5 (12) |
Fe4xiv—Fe9—Fe1ii | 61.58 (9) | Fe13—C9—Fe9xi | 75.1 (9) |
Fe4xiv—Fe9—Fe3x | 93.51 (10) | Fe13—C9—Fe12 | 107.3 (15) |
Fe5x—Fe9—Fe1ii | 119.63 (12) | Fe13—C9—Fe12xii | 112.1 (15) |
Symmetry codes: (i) x−1/2, −y+3/2, −z+1; (ii) x+1/2, −y+3/2, −z+1; (iii) −x+1, −y+2, −z+1; (iv) −x+1/2, y−1/2, z; (v) x−1, y, z; (vi) −x, −y+2, −z+1; (vii) −x+3/2, y+1/2, z; (viii) −x+1/2, y+1/2, z; (ix) −x+1, y+1/2, −z+1/2; (x) x+1, y, z; (xi) x−1/2, y, −z+1/2; (xii) x+1/2, y, −z+1/2; (xiii) −x+2, y+1/2, −z+1/2; (xiv) −x+3/2, y−1/2, z; (xv) −x+2, y−1/2, −z+1/2; (xvi) −x+1, y−1/2, −z+1/2. |