Bis(ferrocenium) bis[tetrachloroantimonate(III)] trichloroantimony(III)

In the title compound, [Fe(C₅H₅)₂]₂[SbCl₄]₂[SbCl₃], the cyclo­penta­dienyl rings in both cations are parallel, with a nearly eclipsed conformation. The Sb³⁺ ions are coordinated by six Cl^- ions to form octahedral arrangements, of which two are slightly distorted. These octahedra form infinite chains along the c axis through Cl-Sb-Cl bridges.

Computing details

Data collection: XSCANS (Siemens, 1994); cell refinement: XSCANS; data reduction: XSCANS; program(s) used to solve structure: SHELXTL (Sheldrick, 1997); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL and PLATON (Spek, 1990).

Bis(ferrocenium) bis[tetrachloroantimonate(III)] trichloroantimony(III)

Crystal data

[Fe(C5H5)2]2[SbCl4]2[SbCl3]	Z = 2
Mr = 1127.26	F(000) = 1064
Triclinic, P1	Dx = 2.222 Mg m^−3
a = 11.615 (2) Å	Mo Kα radiation, λ = 0.71073 Å
b = 12.000 (1) Å	Cell parameters from 41 reflections
c = 13.789 (1) Å	θ = 5.0–12.3°
α = 80.03 (1)°	µ = 4.10 mm^−1
β = 84.42 (1)°	T = 293 K
γ = 62.92 (1)°	Needle, dark blue
V = 1685.0 (3) Å^3	0.36 × 0.18 × 0.08 mm

Data collection

Siemens P4 diffractometer	3378 reflections with I > 2σ(I)
Radiation source: fine-focus sealed tube	Rint = 0.046
Graphite monochromator	θmax = 25°, θmin = 1.9°
θ/2θ scans	h = −1→13
Absorption correction: empirical (using intensity measurements) ψ scans (XSCANS; Siemens, 1994)	k = −13→14
Tmin = 0.320, Tmax = 0.735	l = −16→16
6898 measured reflections	3 standard reflections every 97 reflections
5935 independent reflections	intensity decay: <3%

Refinement

Refinement on F^2	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F^2 > 2σ(F^2)] = 0.040	Hydrogen site location: inferred from neighbouring sites
wR(F^2) = 0.085	H-atom parameters constrained
S = 0.81	w = 1/[σ^2(Fo^2) + (0.0226P)^2] where P = (Fo^2 + 2Fc^2)/3
5935 reflections	(Δ/σ)max < 0.001
325 parameters	Δρmax = 0.71 e Å^−3
0 restraints	Δρmin = −1.04 e Å^−3

Special details

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.

Since there were not enough high-intensity reflections with a ψ-value close to 90°, this may have resulted in the slightly low value of the goodness-of-fit S.

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

	x	y	z	Uiso*/Ueq
Sb1	0.50308 (6)	0.84703 (5)	0.10473 (4)	0.03887 (16)
Sb2	0.62331 (6)	0.77279 (5)	−0.21095 (4)	0.03795 (16)
Sb3	0.68274 (6)	0.89146 (5)	0.42706 (4)	0.03969 (16)
Fe1	0.76761 (12)	0.33822 (11)	0.48678 (8)	0.0403 (3)
Fe2	1.08012 (12)	−0.26271 (10)	0.99722 (8)	0.0357 (3)
Cl1	0.6049 (3)	0.7659 (3)	0.2731 (2)	0.0937 (11)
Cl2	0.3924 (3)	0.9321 (2)	−0.07215 (18)	0.0629 (7)
Cl3	0.4538 (3)	0.6735 (2)	0.12231 (19)	0.0588 (7)
Cl4	0.2989 (3)	0.9819 (2)	0.17531 (19)	0.0643 (7)
Cl5	0.5271 (2)	0.8210 (2)	−0.39897 (17)	0.0580 (6)
Cl6	0.5515 (2)	0.6156 (2)	−0.17989 (17)	0.0529 (6)
Cl7	0.7293 (2)	0.6949 (2)	−0.04529 (16)	0.0581 (6)
Cl8	0.8288 (2)	0.6394 (2)	−0.27700 (16)	0.0543 (6)
Cl9	0.8514 (2)	0.6802 (2)	0.45212 (17)	0.0574 (6)
Cl10	0.8081 (3)	0.9565 (2)	0.30316 (18)	0.0718 (8)
Cl11	0.7545 (3)	0.9583 (2)	0.55247 (17)	0.0612 (7)
C1	0.8438 (14)	0.2852 (19)	0.6268 (7)	0.097 (5)
H1A	0.9341	0.2294	0.6444	0.116*
C2	0.789 (2)	0.4120 (19)	0.6044 (9)	0.095 (5)
H2A	0.8345	0.4642	0.6017	0.114*
C3	0.663 (2)	0.4563 (13)	0.5893 (8)	0.104 (6)
H3A	0.6024	0.5459	0.5738	0.125*
C4	0.6316 (14)	0.355 (2)	0.5995 (8)	0.105 (6)
H4A	0.5458	0.3594	0.5957	0.126*
C5	0.747 (2)	0.2488 (11)	0.6209 (8)	0.090 (5)
H5A	0.7580	0.1617	0.6347	0.108*
C6	0.8363 (16)	0.4042 (13)	0.3581 (8)	0.079 (4)
H6A	0.8553	0.4772	0.3472	0.095*
C7	0.9200 (10)	0.2834 (13)	0.3874 (7)	0.066 (3)
H7A	1.0107	0.2539	0.4031	0.080*
C8	0.8611 (14)	0.2083 (9)	0.3909 (7)	0.068 (3)
H8A	0.9021	0.1162	0.4091	0.082*
C9	0.7351 (13)	0.2822 (15)	0.3624 (8)	0.078 (4)
H9A	0.6710	0.2518	0.3568	0.093*
C10	0.7157 (14)	0.4057 (13)	0.3402 (7)	0.092 (5)
H10A	0.6366	0.4794	0.3153	0.110*
C11	1.2367 (11)	−0.3748 (11)	0.9166 (7)	0.075 (4)
H11A	1.3194	−0.4419	0.9424	0.090*
C12	1.2070 (10)	−0.2497 (10)	0.8864 (7)	0.058 (3)
H12A	1.2655	−0.2119	0.8890	0.070*
C13	1.0828 (11)	−0.1854 (9)	0.8505 (6)	0.060 (3)
H13A	1.0390	−0.0954	0.8236	0.072*
C14	1.0323 (10)	−0.2707 (10)	0.8577 (6)	0.060 (3)
H14A	0.9465	−0.2525	0.8368	0.072*
C15	1.1273 (13)	−0.3885 (10)	0.8988 (6)	0.067 (3)
H15A	1.1195	−0.4677	0.9113	0.080*
C16	1.1265 (11)	−0.3114 (10)	1.1441 (6)	0.068 (3)
H16A	1.2096	−0.3763	1.1710	0.081*
C17	1.0942 (10)	−0.1833 (9)	1.1149 (6)	0.057 (3)
H17A	1.1487	−0.1414	1.1184	0.069*
C18	0.9628 (10)	−0.1248 (9)	1.0847 (6)	0.057 (3)
H18A	0.9113	−0.0346	1.0612	0.068*
C19	0.9205 (10)	−0.2169 (10)	1.0947 (6)	0.057 (3)
H19A	0.8341	−0.2028	1.0787	0.069*
C20	1.0193 (12)	−0.3315 (10)	1.1303 (6)	0.064 (3)
H20A	1.0148	−0.4123	1.1457	0.077*

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Sb1	0.0467 (4)	0.0386 (3)	0.0394 (3)	−0.0253 (3)	−0.0036 (3)	−0.0064 (2)
Sb2	0.0432 (4)	0.0377 (3)	0.0392 (3)	−0.0234 (3)	−0.0013 (3)	−0.0055 (2)
Sb3	0.0458 (4)	0.0416 (3)	0.0337 (3)	−0.0210 (3)	−0.0030 (3)	−0.0050 (2)
Fe1	0.0447 (8)	0.0504 (7)	0.0326 (6)	−0.0258 (7)	0.0062 (6)	−0.0138 (5)
Fe2	0.0350 (7)	0.0405 (7)	0.0336 (6)	−0.0172 (6)	0.0013 (5)	−0.0106 (5)
Cl1	0.125 (3)	0.101 (2)	0.077 (2)	−0.069 (2)	−0.050 (2)	0.0153 (16)
Cl2	0.0597 (18)	0.0547 (14)	0.0707 (16)	−0.0192 (14)	−0.0201 (14)	−0.0080 (12)
Cl3	0.0628 (17)	0.0436 (13)	0.0836 (17)	−0.0352 (13)	0.0069 (14)	−0.0145 (12)
Cl4	0.0646 (18)	0.0522 (14)	0.0748 (17)	−0.0236 (14)	0.0147 (14)	−0.0218 (12)
Cl5	0.0518 (17)	0.0634 (15)	0.0562 (14)	−0.0242 (14)	−0.0077 (12)	−0.0031 (12)
Cl6	0.0548 (16)	0.0489 (13)	0.0665 (15)	−0.0350 (13)	0.0060 (12)	−0.0064 (11)
Cl7	0.0575 (17)	0.0692 (16)	0.0489 (13)	−0.0294 (14)	−0.0104 (12)	−0.0036 (12)
Cl8	0.0416 (15)	0.0696 (15)	0.0520 (14)	−0.0257 (13)	0.0051 (11)	−0.0108 (11)
Cl9	0.0589 (17)	0.0449 (13)	0.0621 (15)	−0.0149 (13)	−0.0104 (13)	−0.0112 (11)
Cl10	0.094 (2)	0.0771 (17)	0.0528 (15)	−0.0499 (17)	0.0253 (15)	−0.0120 (13)
Cl11	0.080 (2)	0.0555 (14)	0.0569 (14)	−0.0327 (14)	−0.0174 (13)	−0.0151 (11)
C1	0.096 (12)	0.155 (15)	0.028 (6)	−0.043 (12)	−0.012 (6)	−0.014 (8)
C2	0.158 (17)	0.139 (14)	0.051 (7)	−0.116 (14)	0.022 (9)	−0.043 (9)
C3	0.132 (15)	0.082 (9)	0.046 (7)	−0.003 (11)	0.026 (9)	−0.024 (6)
C4	0.067 (11)	0.231 (19)	0.051 (7)	−0.090 (13)	0.031 (7)	−0.054 (11)
C5	0.181 (16)	0.053 (7)	0.045 (6)	−0.065 (10)	0.046 (9)	−0.019 (5)
C6	0.128 (13)	0.105 (10)	0.051 (7)	−0.094 (10)	0.043 (7)	−0.036 (7)
C7	0.047 (7)	0.108 (10)	0.042 (6)	−0.030 (8)	0.011 (5)	−0.026 (6)
C8	0.107 (11)	0.049 (6)	0.046 (6)	−0.033 (7)	0.022 (7)	−0.022 (5)
C9	0.077 (10)	0.147 (12)	0.053 (7)	−0.078 (10)	0.026 (6)	−0.058 (8)
C10	0.084 (11)	0.087 (9)	0.044 (6)	0.016 (8)	−0.002 (6)	−0.014 (6)
C11	0.054 (8)	0.077 (8)	0.058 (6)	0.008 (7)	0.010 (6)	−0.032 (6)
C12	0.053 (7)	0.084 (8)	0.052 (6)	−0.040 (7)	0.014 (5)	−0.028 (6)
C13	0.082 (9)	0.052 (6)	0.036 (5)	−0.021 (6)	0.007 (5)	−0.013 (4)
C14	0.060 (7)	0.091 (8)	0.040 (5)	−0.036 (7)	−0.003 (5)	−0.029 (5)
C15	0.115 (11)	0.058 (7)	0.038 (5)	−0.044 (7)	0.010 (6)	−0.023 (5)
C16	0.075 (8)	0.083 (8)	0.023 (5)	−0.015 (7)	−0.012 (5)	−0.003 (5)
C17	0.064 (8)	0.073 (7)	0.049 (6)	−0.035 (6)	−0.001 (5)	−0.034 (5)
C18	0.054 (7)	0.056 (6)	0.052 (6)	−0.009 (6)	−0.002 (5)	−0.032 (5)
C19	0.046 (7)	0.087 (8)	0.051 (6)	−0.039 (6)	0.019 (5)	−0.025 (6)
C20	0.101 (10)	0.068 (7)	0.037 (5)	−0.053 (8)	0.012 (6)	−0.005 (5)

Geometric parameters (Å, º)

Sb1—Cl3	2.367 (2)	Fe2—C15	2.057 (9)
Sb1—Cl4	2.407 (3)	Fe2—C11	2.061 (9)
Sb1—Cl1	2.538 (3)	Fe2—C16	2.062 (8)
Sb1—Cl2	2.683 (2)	Fe2—C17	2.073 (8)
Sb1—Cl7	3.225 (3)	Fe2—C20	2.074 (9)
Sb1—Cl2^i	3.334 (3)	Fe2—C13	2.078 (9)
Sb2—Cl6	2.350 (2)	Fe2—C14	2.083 (8)
Sb2—Cl8	2.386 (2)	Fe2—C18	2.090 (8)
Sb2—Cl7	2.523 (2)	Fe2—C19	2.095 (9)
Sb2—Cl5	2.786 (2)	C1—C2	1.345 (17)
Sb2—Cl2	3.180 (3)	C1—C5	1.390 (18)
Sb2—Cl4^i	3.568 (3)	C2—C3	1.331 (18)
Sb3—Cl9	2.386 (2)	C3—C4	1.403 (18)
Sb3—Cl11	2.387 (2)	C4—C5	1.380 (17)
Sb3—Cl10	2.395 (3)	C6—C7	1.342 (14)
Sb3—Cl5^ii	3.096 (3)	C6—C10	1.437 (17)
Sb3—Cl5^i	3.172 (2)	C7—C8	1.349 (14)
Sb3—Cl1	3.212 (3)	C8—C9	1.376 (14)
Fe1—C5	2.021 (10)	C9—C10	1.377 (15)
Fe1—C7	2.055 (10)	C11—C12	1.373 (13)
Fe1—C6	2.055 (10)	C11—C15	1.403 (15)
Fe1—C8	2.061 (9)	C12—C13	1.383 (13)
Fe1—C2	2.063 (11)	C13—C14	1.379 (13)
Fe1—C3	2.067 (11)	C14—C15	1.400 (13)
Fe1—C4	2.072 (11)	C16—C17	1.398 (13)
Fe1—C9	2.073 (9)	C16—C20	1.407 (14)
Fe1—C1	2.076 (10)	C17—C18	1.430 (13)
Fe1—C10	2.081 (10)	C18—C19	1.382 (12)
Fe2—C12	2.054 (9)	C19—C20	1.374 (13)
Cl3—Sb1—Cl4	93.46 (9)	C11—Fe2—C17	124.0 (5)
Cl3—Sb1—Cl1	89.35 (9)	C16—Fe2—C17	39.5 (4)
Cl4—Sb1—Cl1	91.27 (11)	C12—Fe2—C20	157.7 (5)
Cl3—Sb1—Cl2	90.00 (9)	C15—Fe2—C20	109.8 (4)
Cl4—Sb1—Cl2	88.16 (9)	C11—Fe2—C20	123.1 (5)
Cl1—Sb1—Cl2	179.11 (10)	C16—Fe2—C20	39.8 (4)
Cl3—Sb1—Cl7	85.30 (8)	C17—Fe2—C20	66.8 (4)
Cl4—Sb1—Cl7	163.82 (8)	C12—Fe2—C13	39.1 (4)
Cl1—Sb1—Cl7	104.84 (10)	C15—Fe2—C13	65.5 (4)
Cl2—Sb1—Cl7	75.71 (7)	C11—Fe2—C13	66.1 (4)
Cl3—Sb1—Cl2^i	173.24 (8)	C16—Fe2—C13	158.1 (5)
Cl4—Sb1—Cl2^i	93.24 (8)	C17—Fe2—C13	124.1 (4)
Cl1—Sb1—Cl2^i	89.58 (8)	C20—Fe2—C13	161.3 (5)
Cl2—Sb1—Cl2^i	91.14 (7)	C12—Fe2—C14	65.4 (4)
Cl6—Sb2—Cl8	94.61 (9)	C15—Fe2—C14	39.5 (4)
Cl6—Sb2—Cl7	89.41 (8)	C11—Fe2—C14	66.6 (4)
Cl8—Sb2—Cl7	86.41 (8)	C16—Fe2—C14	161.2 (5)
Cl6—Sb2—Cl5	85.40 (8)	C17—Fe2—C14	158.4 (4)
Cl8—Sb2—Cl5	87.10 (8)	C20—Fe2—C14	126.0 (4)
Cl7—Sb2—Cl5	171.34 (8)	C13—Fe2—C14	38.7 (4)
Cl6—Sb2—Cl2	87.87 (8)	C12—Fe2—C18	127.4 (4)
Cl8—Sb2—Cl2	164.86 (7)	C15—Fe2—C18	158.2 (5)
Cl7—Sb2—Cl2	78.67 (7)	C11—Fe2—C18	161.2 (5)
Cl5—Sb2—Cl2	108.00 (7)	C16—Fe2—C18	65.9 (4)
Cl6—Sb2—Cl4^i	161.15 (7)	C17—Fe2—C18	40.2 (3)
Cl8—Sb2—Cl4^i	96.94 (7)	C20—Fe2—C18	65.2 (4)
Cl7—Sb2—Cl4^i	76.54 (7)	C13—Fe2—C18	111.8 (4)
Cl5—Sb2—Cl4^i	109.97 (7)	C14—Fe2—C18	124.4 (4)
Cl2—Sb2—Cl4^i	77.20 (6)	C12—Fe2—C19	162.5 (4)
Cl9—Sb3—Cl11	94.08 (8)	C15—Fe2—C19	124.2 (4)
Cl9—Sb3—Cl10	91.82 (10)	C11—Fe2—C19	157.7 (5)
Cl11—Sb3—Cl10	91.86 (10)	C16—Fe2—C19	65.5 (4)
Cl9—Sb3—Cl5^ii	89.55 (8)	C17—Fe2—C19	66.3 (4)
Cl11—Sb3—Cl5^ii	82.59 (8)	C20—Fe2—C19	38.5 (4)
Cl10—Sb3—Cl5^ii	174.37 (8)	C13—Fe2—C19	127.5 (4)
Cl9—Sb3—Cl5^i	175.73 (8)	C14—Fe2—C19	111.5 (4)
Cl11—Sb3—Cl5^i	82.22 (8)	C18—Fe2—C19	38.6 (3)
Cl10—Sb3—Cl5^i	86.20 (8)	C2—C1—C5	106.7 (13)
Cl5^ii—Sb3—Cl5^i	92.07 (6)	C2—C1—Fe1	70.5 (7)
Cl9—Sb3—Cl1	79.29 (8)	C5—C1—Fe1	68.0 (6)
Cl11—Sb3—Cl1	172.73 (8)	C3—C2—C1	109.9 (14)
Cl10—Sb3—Cl1	91.32 (9)	C3—C2—Fe1	71.4 (7)
Cl5^ii—Sb3—Cl1	94.30 (8)	C1—C2—Fe1	71.6 (7)
Cl5^i—Sb3—Cl1	104.51 (7)	C2—C3—C4	109.6 (14)
C5—Fe1—C7	129.6 (6)	C2—C3—Fe1	71.0 (7)
C5—Fe1—C6	165.8 (8)	C4—C3—Fe1	70.4 (7)
C7—Fe1—C6	38.1 (4)	C5—C4—C3	104.4 (12)
C5—Fe1—C8	109.9 (4)	C5—C4—Fe1	68.3 (6)
C7—Fe1—C8	38.3 (4)	C3—C4—Fe1	70.0 (7)
C6—Fe1—C8	64.7 (4)	C4—C5—C1	109.4 (12)
C5—Fe1—C2	65.0 (5)	C4—C5—Fe1	72.3 (7)
C7—Fe1—C2	116.2 (6)	C1—C5—Fe1	72.3 (6)
C6—Fe1—C2	111.2 (5)	C7—C6—C10	107.2 (10)
C8—Fe1—C2	145.2 (7)	C7—C6—Fe1	70.9 (6)
C5—Fe1—C3	65.1 (5)	C10—C6—Fe1	70.6 (6)
C7—Fe1—C3	147.9 (8)	C6—C7—C8	109.9 (11)
C6—Fe1—C3	121.1 (6)	C6—C7—Fe1	71.0 (6)
C8—Fe1—C3	173.6 (7)	C8—C7—Fe1	71.1 (6)
C2—Fe1—C3	37.6 (5)	C7—C8—C9	108.7 (10)
C5—Fe1—C4	39.4 (5)	C7—C8—Fe1	70.6 (5)
C7—Fe1—C4	168.4 (8)	C9—C8—Fe1	71.0 (6)
C6—Fe1—C4	153.4 (8)	C8—C9—C10	108.1 (11)
C8—Fe1—C4	134.0 (7)	C8—C9—Fe1	70.1 (6)
C2—Fe1—C4	65.4 (5)	C10—C9—Fe1	71.0 (6)
C3—Fe1—C4	39.6 (5)	C9—C10—C6	106.1 (11)
C5—Fe1—C9	119.0 (6)	C9—C10—Fe1	70.3 (6)
C7—Fe1—C9	64.9 (4)	C6—C10—Fe1	68.7 (6)
C6—Fe1—C9	66.0 (4)	C12—C11—C15	106.3 (10)
C8—Fe1—C9	38.9 (4)	C12—C11—Fe2	70.2 (5)
C2—Fe1—C9	174.4 (8)	C15—C11—Fe2	69.9 (6)
C3—Fe1—C9	139.0 (7)	C11—C12—C13	109.9 (10)
C4—Fe1—C9	114.7 (5)	C11—C12—Fe2	70.8 (6)
C5—Fe1—C1	39.6 (5)	C13—C12—Fe2	71.4 (6)
C7—Fe1—C1	107.6 (5)	C14—C13—C12	108.0 (9)
C6—Fe1—C1	128.9 (7)	C14—C13—Fe2	70.8 (5)
C8—Fe1—C1	115.3 (6)	C12—C13—Fe2	69.5 (5)
C2—Fe1—C1	37.9 (5)	C13—C14—C15	107.3 (9)
C3—Fe1—C1	63.8 (5)	C13—C14—Fe2	70.5 (5)
C4—Fe1—C1	66.0 (5)	C15—C14—Fe2	69.2 (5)
C9—Fe1—C1	147.7 (7)	C14—C15—C11	108.5 (10)
C5—Fe1—C10	151.1 (8)	C14—C15—Fe2	71.2 (5)
C7—Fe1—C10	65.5 (4)	C11—C15—Fe2	70.3 (5)
C6—Fe1—C10	40.6 (5)	C17—C16—C20	108.8 (10)
C8—Fe1—C10	65.1 (4)	C17—C16—Fe2	70.7 (5)
C2—Fe1—C10	136.0 (7)	C20—C16—Fe2	70.6 (5)
C3—Fe1—C10	117.1 (5)	C16—C17—C18	105.9 (9)
C4—Fe1—C10	122.2 (6)	C16—C17—Fe2	69.8 (5)
C9—Fe1—C10	38.7 (4)	C18—C17—Fe2	70.6 (5)
C1—Fe1—C10	169.2 (8)	C19—C18—C17	108.3 (9)
C12—Fe2—C15	65.4 (4)	C19—C18—Fe2	70.9 (5)
C12—Fe2—C11	39.0 (4)	C17—C18—Fe2	69.3 (5)
C15—Fe2—C11	39.8 (4)	C20—C19—C18	109.1 (9)
C12—Fe2—C16	123.3 (5)	C20—C19—Fe2	69.9 (6)
C15—Fe2—C16	125.2 (4)	C18—C19—Fe2	70.5 (5)
C11—Fe2—C16	108.7 (4)	C19—C20—C16	107.8 (9)
C12—Fe2—C17	109.8 (4)	C19—C20—Fe2	71.6 (5)
C15—Fe2—C17	160.1 (5)	C16—C20—Fe2	69.6 (5)
C5—Fe1—C1—C2	−118.1 (13)	C1—Fe1—C10—C6	15 (3)
C7—Fe1—C1—C2	110.3 (11)	C15—Fe2—C11—C12	116.7 (9)
C6—Fe1—C1—C2	73.8 (11)	C16—Fe2—C11—C12	−120.3 (7)
C8—Fe1—C1—C2	150.7 (10)	C17—Fe2—C11—C12	−79.3 (7)
C3—Fe1—C1—C2	−36.3 (9)	C20—Fe2—C11—C12	−161.9 (6)
C4—Fe1—C1—C2	−80.2 (10)	C13—Fe2—C11—C12	36.8 (6)
C9—Fe1—C1—C2	−179.0 (9)	C14—Fe2—C11—C12	79.2 (7)
C10—Fe1—C1—C2	61 (3)	C18—Fe2—C11—C12	−50.7 (15)
C7—Fe1—C1—C5	−131.6 (9)	C19—Fe2—C11—C12	169.0 (9)
C6—Fe1—C1—C5	−168.1 (8)	C12—Fe2—C11—C15	−116.7 (9)
C8—Fe1—C1—C5	−91.2 (9)	C16—Fe2—C11—C15	123.0 (7)
C2—Fe1—C1—C5	118.1 (13)	C17—Fe2—C11—C15	164.0 (6)
C3—Fe1—C1—C5	81.8 (9)	C20—Fe2—C11—C15	81.4 (8)
C4—Fe1—C1—C5	37.9 (8)	C13—Fe2—C11—C15	−79.9 (7)
C9—Fe1—C1—C5	−60.9 (13)	C14—Fe2—C11—C15	−37.5 (6)
C10—Fe1—C1—C5	179 (2)	C18—Fe2—C11—C15	−167.4 (10)
C5—C1—C2—C3	2.7 (14)	C19—Fe2—C11—C15	52.3 (14)
Fe1—C1—C2—C3	61.4 (9)	Fe2—C11—C12—C13	−61.0 (7)
C5—C1—C2—Fe1	−58.7 (8)	C15—C11—C12—Fe2	60.9 (7)
C5—Fe1—C2—C3	−81.0 (10)	C15—Fe2—C12—C11	−39.0 (6)
C7—Fe1—C2—C3	155.3 (10)	C16—Fe2—C12—C11	78.2 (8)
C6—Fe1—C2—C3	113.9 (11)	C17—Fe2—C12—C11	120.1 (7)
C8—Fe1—C2—C3	−170.3 (9)	C20—Fe2—C12—C11	43.3 (13)
C4—Fe1—C2—C3	−37.4 (9)	C13—Fe2—C12—C11	−119.8 (9)
C9—Fe1—C2—C3	55 (6)	C14—Fe2—C12—C11	−82.7 (7)
C1—Fe1—C2—C3	−119.4 (14)	C18—Fe2—C12—C11	161.7 (6)
C10—Fe1—C2—C3	74.3 (12)	C19—Fe2—C12—C11	−166.1 (12)
C5—Fe1—C2—C1	38.4 (9)	C15—Fe2—C12—C13	80.8 (6)
C7—Fe1—C2—C1	−85.3 (11)	C11—Fe2—C12—C13	119.8 (9)
C6—Fe1—C2—C1	−126.7 (11)	C16—Fe2—C12—C13	−162.0 (6)
C8—Fe1—C2—C1	−50.9 (14)	C17—Fe2—C12—C13	−120.1 (6)
C3—Fe1—C2—C1	119.4 (14)	C20—Fe2—C12—C13	163.2 (9)
C4—Fe1—C2—C1	82.0 (10)	C14—Fe2—C12—C13	37.2 (5)
C9—Fe1—C2—C1	174 (5)	C18—Fe2—C12—C13	−78.5 (7)
C10—Fe1—C2—C1	−166.3 (9)	C19—Fe2—C12—C13	−46.3 (15)
C1—C2—C3—C4	−1.5 (15)	Fe2—C12—C13—C14	−60.7 (6)
Fe1—C2—C3—C4	60.0 (9)	C11—C12—C13—Fe2	60.6 (7)
C1—C2—C3—Fe1	−61.5 (9)	C12—Fe2—C13—C14	118.6 (8)
C5—Fe1—C3—C2	80.8 (10)	C15—Fe2—C13—C14	38.1 (6)
C7—Fe1—C3—C2	−44.8 (15)	C11—Fe2—C13—C14	81.9 (7)
C6—Fe1—C3—C2	−84.7 (11)	C16—Fe2—C13—C14	162.4 (10)
C8—Fe1—C3—C2	120 (6)	C17—Fe2—C13—C14	−162.0 (6)
C4—Fe1—C3—C2	120.0 (13)	C20—Fe2—C13—C14	−41.4 (14)
C9—Fe1—C3—C2	−173.0 (9)	C18—Fe2—C13—C14	−118.3 (6)
C1—Fe1—C3—C2	36.6 (9)	C19—Fe2—C13—C14	−77.3 (7)
C10—Fe1—C3—C2	−131.3 (11)	C15—Fe2—C13—C12	−80.5 (7)
C5—Fe1—C3—C4	−39.2 (8)	C11—Fe2—C13—C12	−36.7 (6)
C7—Fe1—C3—C4	−164.8 (10)	C16—Fe2—C13—C12	43.8 (13)
C6—Fe1—C3—C4	155.3 (10)	C17—Fe2—C13—C12	79.4 (7)
C2—Fe1—C3—C4	−120.0 (13)	C20—Fe2—C13—C12	−160.0 (11)
C9—Fe1—C3—C4	67.1 (12)	C14—Fe2—C13—C12	−118.6 (8)
C1—Fe1—C3—C4	−83.3 (9)	C18—Fe2—C13—C12	123.1 (6)
C10—Fe1—C3—C4	108.7 (11)	C19—Fe2—C13—C12	164.1 (6)
Fe1—C3—C4—C5	60.0 (8)	Fe2—C13—C14—C15	−59.7 (6)
C2—C3—C4—Fe1	−60.4 (9)	C12—C13—C14—Fe2	59.8 (6)
C7—Fe1—C4—C5	21 (3)	C12—Fe2—C14—C13	−37.5 (6)
C6—Fe1—C4—C5	−168.4 (11)	C15—Fe2—C14—C13	−118.1 (9)
C8—Fe1—C4—C5	64.6 (11)	C11—Fe2—C14—C13	−80.4 (7)
C2—Fe1—C4—C5	−79.9 (9)	C16—Fe2—C14—C13	−159.5 (12)
C3—Fe1—C4—C5	−115.4 (12)	C17—Fe2—C14—C13	44.0 (14)
C9—Fe1—C4—C5	106.3 (10)	C20—Fe2—C14—C13	164.8 (6)
C1—Fe1—C4—C5	−38.1 (8)	C18—Fe2—C14—C13	82.2 (7)
C10—Fe1—C4—C5	149.8 (10)	C19—Fe2—C14—C13	123.7 (6)
C5—Fe1—C4—C3	115.4 (12)	C12—Fe2—C14—C15	80.6 (7)
C7—Fe1—C4—C3	136 (3)	C11—Fe2—C14—C15	37.8 (7)
C6—Fe1—C4—C3	−53.0 (15)	C16—Fe2—C14—C15	−41.3 (16)
C8—Fe1—C4—C3	−180.0 (10)	C17—Fe2—C14—C15	162.1 (10)
C2—Fe1—C4—C3	35.5 (8)	C20—Fe2—C14—C15	−77.1 (8)
C9—Fe1—C4—C3	−138.3 (10)	C13—Fe2—C14—C15	118.1 (9)
C1—Fe1—C4—C3	77.3 (9)	C18—Fe2—C14—C15	−159.7 (7)
C10—Fe1—C4—C3	−94.8 (11)	C19—Fe2—C14—C15	−118.2 (7)
C3—C4—C5—C1	2.1 (13)	Fe2—C14—C15—C11	−60.6 (7)
Fe1—C4—C5—C1	63.2 (8)	C13—C14—C15—Fe2	60.5 (6)
C3—C4—C5—Fe1	−61.2 (8)	Fe2—C11—C15—C14	61.3 (7)
C2—C1—C5—C4	−3.0 (13)	C12—C11—C15—Fe2	−61.1 (6)
Fe1—C1—C5—C4	−63.2 (8)	C12—Fe2—C15—C14	−80.5 (7)
C2—C1—C5—Fe1	60.2 (8)	C11—Fe2—C15—C14	−118.6 (10)
C7—Fe1—C5—C4	−174.6 (9)	C16—Fe2—C15—C14	164.9 (7)
C6—Fe1—C5—C4	158.6 (16)	C17—Fe2—C15—C14	−160.7 (11)
C8—Fe1—C5—C4	−136.2 (10)	C20—Fe2—C15—C14	123.1 (7)
C2—Fe1—C5—C4	81.1 (9)	C13—Fe2—C15—C14	−37.3 (6)
C3—Fe1—C5—C4	39.4 (8)	C18—Fe2—C15—C14	50.5 (13)
C9—Fe1—C5—C4	−94.5 (10)	C19—Fe2—C15—C14	82.7 (7)
C1—Fe1—C5—C4	117.8 (11)	C12—Fe2—C15—C11	38.2 (6)
C10—Fe1—C5—C4	−61.9 (13)	C16—Fe2—C15—C11	−76.5 (8)
C7—Fe1—C5—C1	67.5 (10)	C17—Fe2—C15—C11	−42.1 (15)
C6—Fe1—C5—C1	41 (2)	C20—Fe2—C15—C11	−118.3 (7)
C8—Fe1—C5—C1	105.9 (10)	C13—Fe2—C15—C11	81.3 (7)
C2—Fe1—C5—C1	−36.8 (8)	C14—Fe2—C15—C11	118.6 (10)
C3—Fe1—C5—C1	−78.4 (9)	C18—Fe2—C15—C11	169.1 (9)
C4—Fe1—C5—C1	−117.8 (11)	C19—Fe2—C15—C11	−158.7 (7)
C9—Fe1—C5—C1	147.7 (9)	C12—Fe2—C16—C17	80.7 (7)
C10—Fe1—C5—C1	−179.8 (10)	C15—Fe2—C16—C17	162.4 (7)
C5—Fe1—C6—C7	34 (2)	C11—Fe2—C16—C17	121.3 (7)
C8—Fe1—C6—C7	−36.4 (7)	C20—Fe2—C16—C17	−119.1 (10)
C2—Fe1—C6—C7	105.9 (10)	C13—Fe2—C16—C17	49.2 (13)
C3—Fe1—C6—C7	146.5 (9)	C14—Fe2—C16—C17	−166.7 (12)
C4—Fe1—C6—C7	−176.9 (11)	C18—Fe2—C16—C17	−39.4 (6)
C9—Fe1—C6—C7	−79.4 (7)	C19—Fe2—C16—C17	−81.9 (7)
C1—Fe1—C6—C7	66.6 (10)	C12—Fe2—C16—C20	−160.2 (6)
C10—Fe1—C6—C7	−117.0 (10)	C15—Fe2—C16—C20	−78.5 (8)
C5—Fe1—C6—C10	151.2 (17)	C11—Fe2—C16—C20	−119.6 (7)
C7—Fe1—C6—C10	117.0 (10)	C17—Fe2—C16—C20	119.1 (10)
C8—Fe1—C6—C10	80.5 (7)	C13—Fe2—C16—C20	168.3 (9)
C2—Fe1—C6—C10	−137.2 (10)	C14—Fe2—C16—C20	−47.6 (16)
C3—Fe1—C6—C10	−96.5 (10)	C18—Fe2—C16—C20	79.7 (7)
C4—Fe1—C6—C10	−60.0 (13)	C19—Fe2—C16—C20	37.2 (6)
C9—Fe1—C6—C10	37.6 (7)	C20—C16—C17—C18	1.2 (10)
C1—Fe1—C6—C10	−176.4 (9)	Fe2—C16—C17—C18	61.7 (6)
Fe1—C6—C7—C8	60.7 (7)	C20—C16—C17—Fe2	−60.5 (6)
C10—C6—C7—Fe1	−61.7 (7)	C12—Fe2—C17—C16	−118.8 (7)
C5—Fe1—C7—C6	−169.7 (9)	C15—Fe2—C17—C16	−46.6 (15)
C8—Fe1—C7—C6	119.9 (10)	C11—Fe2—C17—C16	−77.8 (8)
C2—Fe1—C7—C6	−91.4 (9)	C20—Fe2—C17—C16	37.5 (7)
C3—Fe1—C7—C6	−62.8 (12)	C13—Fe2—C17—C16	−160.0 (7)
C4—Fe1—C7—C6	173 (2)	C14—Fe2—C17—C16	168.4 (10)
C9—Fe1—C7—C6	82.5 (8)	C18—Fe2—C17—C16	116.1 (9)
C1—Fe1—C7—C6	−131.4 (9)	C19—Fe2—C17—C16	79.6 (7)
C10—Fe1—C7—C6	39.6 (7)	C12—Fe2—C17—C18	125.1 (6)
C5—Fe1—C7—C8	70.5 (10)	C15—Fe2—C17—C18	−162.7 (11)
C6—Fe1—C7—C8	−119.9 (10)	C11—Fe2—C17—C18	166.2 (6)
C2—Fe1—C7—C8	148.7 (9)	C16—Fe2—C17—C18	−116.1 (9)
C3—Fe1—C7—C8	177.3 (9)	C20—Fe2—C17—C18	−78.6 (7)
C4—Fe1—C7—C8	53 (3)	C13—Fe2—C17—C18	83.9 (7)
C9—Fe1—C7—C8	−37.4 (7)	C14—Fe2—C17—C18	52.3 (14)
C1—Fe1—C7—C8	108.7 (9)	C19—Fe2—C17—C18	−36.5 (6)
C10—Fe1—C7—C8	−80.2 (7)	Fe2—C17—C18—C19	60.4 (6)
Fe1—C7—C8—C9	61.1 (7)	C16—C17—C18—Fe2	−61.2 (6)
C6—C7—C8—Fe1	−60.6 (7)	C12—Fe2—C18—C19	165.1 (6)
C5—Fe1—C8—C7	−129.4 (9)	C15—Fe2—C18—C19	45.0 (13)
C6—Fe1—C8—C7	36.3 (7)	C11—Fe2—C18—C19	−157.1 (12)
C2—Fe1—C8—C7	−54.9 (11)	C16—Fe2—C18—C19	−80.4 (7)
C3—Fe1—C8—C7	−167 (5)	C17—Fe2—C18—C19	−119.2 (8)
C4—Fe1—C8—C7	−167.0 (8)	C20—Fe2—C18—C19	−36.5 (6)
C9—Fe1—C8—C7	118.8 (9)	C13—Fe2—C18—C19	123.4 (7)
C1—Fe1—C8—C7	−86.7 (9)	C14—Fe2—C18—C19	81.5 (7)
C10—Fe1—C8—C7	81.4 (8)	C12—Fe2—C18—C17	−75.7 (7)
C5—Fe1—C8—C9	111.8 (10)	C15—Fe2—C18—C17	164.1 (9)
C7—Fe1—C8—C9	−118.8 (9)	C11—Fe2—C18—C17	−38.0 (15)
C6—Fe1—C8—C9	−82.5 (8)	C16—Fe2—C18—C17	38.8 (6)
C2—Fe1—C8—C9	−173.6 (9)	C20—Fe2—C18—C17	82.7 (6)
C3—Fe1—C8—C9	74 (5)	C13—Fe2—C18—C17	−117.5 (6)
C4—Fe1—C8—C9	74.2 (9)	C14—Fe2—C18—C17	−159.3 (6)
C1—Fe1—C8—C9	154.5 (9)	C19—Fe2—C18—C17	119.2 (8)
C10—Fe1—C8—C9	−37.4 (7)	Fe2—C18—C19—C20	59.5 (6)
Fe1—C8—C9—C10	61.1 (7)	C17—C18—C19—Fe2	−59.4 (6)
C7—C8—C9—Fe1	−60.8 (7)	C12—Fe2—C19—C20	−162.5 (12)
C5—Fe1—C9—C8	−86.2 (9)	C15—Fe2—C19—C20	78.7 (7)
C7—Fe1—C9—C8	36.8 (6)	C11—Fe2—C19—C20	40.9 (14)
C6—Fe1—C9—C8	78.9 (7)	C16—Fe2—C19—C20	−38.4 (6)
C2—Fe1—C9—C8	140 (5)	C17—Fe2—C19—C20	−81.9 (7)
C3—Fe1—C9—C8	−170.6 (9)	C13—Fe2—C19—C20	162.4 (6)
C4—Fe1—C9—C8	−130.3 (9)	C14—Fe2—C19—C20	121.4 (7)
C1—Fe1—C9—C8	−46.6 (13)	C18—Fe2—C19—C20	−119.9 (9)
C10—Fe1—C9—C8	118.3 (10)	C12—Fe2—C19—C18	−42.7 (15)
C5—Fe1—C9—C10	155.5 (10)	C15—Fe2—C19—C18	−161.5 (6)
C7—Fe1—C9—C10	−81.5 (8)	C11—Fe2—C19—C18	160.7 (10)
C6—Fe1—C9—C10	−39.4 (8)	C16—Fe2—C19—C18	81.4 (6)
C8—Fe1—C9—C10	−118.3 (10)	C17—Fe2—C19—C18	38.0 (5)
C2—Fe1—C9—C10	22 (6)	C20—Fe2—C19—C18	119.9 (9)
C3—Fe1—C9—C10	71.1 (12)	C13—Fe2—C19—C18	−77.8 (7)
C4—Fe1—C9—C10	111.4 (10)	C14—Fe2—C19—C18	−118.7 (6)
C1—Fe1—C9—C10	−164.9 (11)	Fe2—C19—C20—C16	60.5 (7)
Fe1—C9—C10—C6	59.7 (7)	C18—C19—C20—Fe2	−59.9 (6)
C8—C9—C10—Fe1	−60.6 (7)	C17—C16—C20—C19	−1.1 (11)
C7—C6—C10—C9	1.1 (12)	Fe2—C16—C20—C19	−61.7 (6)
Fe1—C6—C10—C9	−60.8 (7)	C17—C16—C20—Fe2	60.6 (6)
C7—C6—C10—Fe1	61.9 (7)	C12—Fe2—C20—C19	166.2 (9)
C5—Fe1—C10—C9	−48.8 (13)	C15—Fe2—C20—C19	−120.5 (7)
C7—Fe1—C10—C9	79.9 (8)	C11—Fe2—C20—C19	−162.8 (7)
C6—Fe1—C10—C9	117.1 (10)	C16—Fe2—C20—C19	117.9 (9)
C8—Fe1—C10—C9	37.6 (7)	C17—Fe2—C20—C19	80.7 (6)
C2—Fe1—C10—C9	−177.0 (10)	C13—Fe2—C20—C19	−48.4 (14)
C3—Fe1—C10—C9	−135.8 (10)	C14—Fe2—C20—C19	−79.2 (7)
C4—Fe1—C10—C9	−90.2 (10)	C18—Fe2—C20—C19	36.5 (6)
C1—Fe1—C10—C9	132 (3)	C12—Fe2—C20—C16	48.3 (13)
C5—Fe1—C10—C6	−165.8 (10)	C15—Fe2—C20—C16	121.6 (7)
C7—Fe1—C10—C6	−37.2 (6)	C11—Fe2—C20—C16	79.3 (8)
C8—Fe1—C10—C6	−79.5 (7)	C17—Fe2—C20—C16	−37.3 (6)
C2—Fe1—C10—C6	65.9 (11)	C13—Fe2—C20—C16	−166.4 (10)
C3—Fe1—C10—C6	107.2 (10)	C14—Fe2—C20—C16	162.9 (6)
C4—Fe1—C10—C6	152.8 (10)	C18—Fe2—C20—C16	−81.4 (7)
C9—Fe1—C10—C6	−117.1 (10)	C19—Fe2—C20—C16	−117.9 (9)

Symmetry codes: (i) −x+1, −y+2, −z; (ii) x, y, z+1.