Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806007264/wm2005sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536806007264/wm2005Isup2.hkl |
Key indicators
- Single-crystal X-ray study
- T = 291 K
- Mean (e-Ce)= 0.001 Å
- R factor = 0.036
- wR factor = 0.115
- Data-to-parameter ratio = 39.7
checkCIF/PLATON results
No syntax errors found No errors found in this datablock
Data collection: CAD-4 EXPRESS (Enraf–Nonius, 1994); cell refinement: CAD-4 EXPRESS; data reduction: XCAD4 (Harms & Wocadlo, 1995); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: DIAMOND (Brandenburg, 1998) and ORTEP-3 (Farrugia, 1997); software used to prepare material for publication: WinGX (Farrugia, 1999).
Ce5Pt2In4 | F(000) = 1284 |
Mr = 1550.06 | Dx = 8.839 Mg m−3 |
Orthorhombic, Pbam | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: -P 2 2ab | Cell parameters from 25 reflections |
a = 8.2088 (14) Å | θ = 18.2–23.1° |
b = 18.579 (4) Å | µ = 50.69 mm−1 |
c = 3.8188 (8) Å | T = 291 K |
V = 582.4 (2) Å3 | Lath, metallic light-grey |
Z = 2 | 0.07 × 0.04 × 0.01 mm |
Enraf–Nonius CAD-4 diffractometer | 1149 reflections with I > 2σ(I) |
Radiation source: fine-focus sealed tube | Rint = 0.000 |
Graphite monochromator | θmax = 35.0°, θmin = 2.2° |
ω scans | h = −13→0 |
Absorption correction: ψ scan (North et al., 1968) | k = 0→29 |
Tmin = 0.090, Tmax = 0.602 | l = 0→6 |
1430 measured reflections | 1 standard reflections every 120 min |
1430 independent reflections | intensity decay: none |
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)] = 0.037 | w = 1/[σ2(Fo2) + (0.1P)2] where P = (Fo2 + 2Fc2)/3 |
wR(F2) = 0.115 | (Δ/σ)max < 0.001 |
S = 0.82 | Δρmax = 2.46 e Å−3 |
1430 reflections | Δρmin = −4.63 e Å−3 |
36 parameters | Extinction correction: SHELXL97, Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
0 restraints | Extinction coefficient: 0.0017 (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 | ||
Ce1 | 0.12160 (8) | 0.41785 (4) | 0.0000 | 0.01245 (16) | |
Ce2 | 0.24262 (8) | 0.22254 (4) | 0.0000 | 0.01195 (16) | |
Ce3 | 0.0000 | 0.0000 | 0.0000 | 0.0134 (2) | |
Pt | 0.01979 (6) | 0.30468 (2) | 0.5000 | 0.01234 (14) | |
In1 | 0.29027 (10) | 0.07173 (5) | 0.5000 | 0.01462 (19) | |
In2 | 0.43306 (11) | 0.34996 (5) | 0.5000 | 0.01504 (19) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Ce1 | 0.0110 (3) | 0.0103 (3) | 0.0160 (3) | −0.0003 (2) | 0.000 | 0.000 |
Ce2 | 0.0113 (3) | 0.0113 (3) | 0.0133 (3) | 0.00148 (19) | 0.000 | 0.000 |
Ce3 | 0.0122 (4) | 0.0116 (4) | 0.0163 (4) | 0.0001 (3) | 0.000 | 0.000 |
Pt | 0.0122 (2) | 0.0094 (2) | 0.0154 (2) | 0.00008 (13) | 0.000 | 0.000 |
In1 | 0.0102 (3) | 0.0096 (3) | 0.0241 (5) | −0.0013 (3) | 0.000 | 0.000 |
In2 | 0.0123 (4) | 0.0093 (3) | 0.0234 (5) | 0.0008 (3) | 0.000 | 0.000 |
Ce1—Pti | 2.9606 (7) | Ce3—In2xii | 3.4233 (9) |
Ce1—Pt | 2.9606 (7) | Ce3—In2ii | 3.4233 (9) |
Ce1—In1ii | 3.3288 (10) | Ce3—In2xiii | 3.4233 (9) |
Ce1—In1iii | 3.3288 (10) | Ce3—Ce1xiii | 3.4609 (8) |
Ce1—In2 | 3.4313 (10) | Ce3—Ce1ii | 3.4609 (8) |
Ce1—In2i | 3.4313 (10) | Ce3—Ce3viii | 3.8188 (8) |
Ce1—Ce3iv | 3.4609 (8) | Ce3—Ce3i | 3.8188 (8) |
Ce1—In1v | 3.5131 (10) | Pt—In2iii | 2.9599 (11) |
Ce1—In1vi | 3.5131 (10) | Pt—Ce1viii | 2.9606 (7) |
Ce1—Ce1vii | 3.6474 (14) | Pt—In1iii | 2.9703 (10) |
Ce1—Ce2 | 3.7623 (12) | Pt—Ce2ii | 3.0130 (8) |
Ce1—Ce1viii | 3.8188 (8) | Pt—Ce2iii | 3.0130 (8) |
Ce1—Ce1i | 3.8188 (8) | Pt—Ce2viii | 3.0530 (7) |
Ce1—Ce2ii | 4.0597 (11) | Pt—In2 | 3.4952 (12) |
Ce2—Ptix | 3.0130 (8) | Pt—Ptviii | 3.8188 (8) |
Ce2—Ptiv | 3.0130 (8) | Pt—Pti | 3.8188 (8) |
Ce2—Pti | 3.0530 (7) | In1—Ptix | 2.9703 (10) |
Ce2—Pt | 3.0530 (7) | In1—In2iii | 3.2734 (13) |
Ce2—In1i | 3.4132 (11) | In1—Ce1ix | 3.3288 (10) |
Ce2—In1 | 3.4132 (11) | In1—Ce1iv | 3.3288 (10) |
Ce2—In2 | 3.4196 (10) | In1—Ce3viii | 3.3315 (8) |
Ce2—In2i | 3.4196 (10) | In1—Ce2viii | 3.4132 (11) |
Ce2—In2ii | 3.4521 (10) | In1—Ce1xiii | 3.5131 (10) |
Ce2—In2iii | 3.4521 (10) | In1—Ce1xiv | 3.5131 (10) |
Ce2—Ce2viii | 3.8188 (8) | In2—Ptix | 2.9599 (11) |
Ce2—Ce2i | 3.8188 (8) | In2—In1ix | 3.2734 (13) |
Ce2—Ce1iv | 4.0597 (11) | In2—Ce2viii | 3.4196 (10) |
Ce3—In1x | 3.3315 (8) | In2—Ce3ix | 3.4233 (9) |
Ce3—In1 | 3.3315 (8) | In2—Ce3iv | 3.4233 (9) |
Ce3—In1xi | 3.3315 (8) | In2—Ce1viii | 3.4313 (10) |
Ce3—In1i | 3.3315 (8) | In2—Ce2ix | 3.4521 (10) |
Ce3—In2iii | 3.4233 (9) | In2—Ce2iv | 3.4521 (10) |
Pti—Ce1—Pt | 80.32 (3) | In2xii—Ce3—In2ii | 112.20 (2) |
Pti—Ce1—In1ii | 55.995 (19) | In1x—Ce3—In2xiii | 96.24 (2) |
Pt—Ce1—In1ii | 100.40 (3) | In1—Ce3—In2xiii | 83.76 (2) |
Pti—Ce1—In1iii | 100.40 (3) | In1xi—Ce3—In2xiii | 57.95 (2) |
Pt—Ce1—In1iii | 55.995 (19) | In1i—Ce3—In2xiii | 122.05 (2) |
In1ii—Ce1—In1iii | 70.00 (3) | In2iii—Ce3—In2xiii | 112.20 (2) |
Pti—Ce1—In2 | 107.95 (3) | In2xii—Ce3—In2xiii | 67.80 (2) |
Pt—Ce1—In2 | 65.82 (2) | In2ii—Ce3—In2xiii | 180.000 (16) |
In1ii—Ce1—In2 | 161.69 (3) | In1x—Ce3—Ce1xiii | 117.743 (19) |
In1iii—Ce1—In2 | 108.12 (2) | In1—Ce3—Ce1xiii | 62.257 (19) |
Pti—Ce1—In2i | 65.82 (2) | In1xi—Ce3—Ce1xiii | 117.743 (19) |
Pt—Ce1—In2i | 107.95 (3) | In1i—Ce3—Ce1xiii | 62.257 (19) |
In1ii—Ce1—In2i | 108.12 (2) | In2iii—Ce3—Ce1xiii | 120.210 (17) |
In1iii—Ce1—In2i | 161.69 (3) | In2xii—Ce3—Ce1xiii | 59.790 (17) |
In2—Ce1—In2i | 67.62 (2) | In2ii—Ce3—Ce1xiii | 120.210 (17) |
Pti—Ce1—Ce3iv | 124.510 (18) | In2xiii—Ce3—Ce1xiii | 59.790 (17) |
Pt—Ce1—Ce3iv | 124.510 (18) | In1x—Ce3—Ce1ii | 62.257 (19) |
In1ii—Ce1—Ce3iv | 135.05 (2) | In1—Ce3—Ce1ii | 117.743 (19) |
In1iii—Ce1—Ce3iv | 135.05 (2) | In1xi—Ce3—Ce1ii | 62.257 (19) |
In2—Ce1—Ce3iv | 59.56 (2) | In1i—Ce3—Ce1ii | 117.743 (19) |
In2i—Ce1—Ce3iv | 59.56 (2) | In2iii—Ce3—Ce1ii | 59.790 (17) |
Pti—Ce1—In1v | 170.60 (2) | In2xii—Ce3—Ce1ii | 120.210 (17) |
Pt—Ce1—In1v | 106.591 (19) | In2ii—Ce3—Ce1ii | 59.790 (17) |
In1ii—Ce1—In1v | 115.64 (2) | In2xiii—Ce3—Ce1ii | 120.210 (17) |
In1iii—Ce1—In1v | 79.00 (3) | Ce1xiii—Ce3—Ce1ii | 180.00 (2) |
In2—Ce1—In1v | 80.98 (2) | In1x—Ce3—Ce3viii | 124.969 (11) |
In2i—Ce1—In1v | 116.63 (3) | In1—Ce3—Ce3viii | 55.031 (11) |
Ce3iv—Ce1—In1v | 57.065 (17) | In1xi—Ce3—Ce3viii | 55.031 (11) |
Pti—Ce1—In1vi | 106.591 (18) | In1i—Ce3—Ce3viii | 124.969 (11) |
Pt—Ce1—In1vi | 170.60 (2) | In2iii—Ce3—Ce3viii | 56.098 (11) |
In1ii—Ce1—In1vi | 79.00 (3) | In2xii—Ce3—Ce3viii | 123.902 (11) |
In1iii—Ce1—In1vi | 115.64 (2) | In2ii—Ce3—Ce3viii | 123.902 (11) |
In2—Ce1—In1vi | 116.63 (3) | In2xiii—Ce3—Ce3viii | 56.098 (11) |
In2i—Ce1—In1vi | 80.98 (2) | Ce1xiii—Ce3—Ce3viii | 90.0 |
Ce3iv—Ce1—In1vi | 57.065 (17) | Ce1ii—Ce3—Ce3viii | 90.0 |
In1v—Ce1—In1vi | 65.85 (2) | In1x—Ce3—Ce3i | 55.031 (11) |
Pti—Ce1—Ce1vii | 116.09 (3) | In1—Ce3—Ce3i | 124.969 (11) |
Pt—Ce1—Ce1vii | 116.09 (3) | In1xi—Ce3—Ce3i | 124.969 (11) |
In1ii—Ce1—Ce1vii | 60.27 (2) | In1i—Ce3—Ce3i | 55.031 (11) |
In1iii—Ce1—Ce1vii | 60.27 (2) | In2iii—Ce3—Ce3i | 123.902 (11) |
In2—Ce1—Ce1vii | 135.68 (2) | In2xii—Ce3—Ce3i | 56.098 (11) |
In2i—Ce1—Ce1vii | 135.68 (2) | In2ii—Ce3—Ce3i | 56.098 (11) |
Ce3iv—Ce1—Ce1vii | 97.02 (3) | In2xiii—Ce3—Ce3i | 123.902 (11) |
In1v—Ce1—Ce1vii | 55.37 (2) | Ce1xiii—Ce3—Ce3i | 90.0 |
In1vi—Ce1—Ce1vii | 55.37 (2) | Ce1ii—Ce3—Ce3i | 90.0 |
Pti—Ce1—Ce2 | 52.378 (17) | Ce3viii—Ce3—Ce3i | 180.0 |
Pt—Ce1—Ce2 | 52.378 (17) | In2iii—Pt—Ce1viii | 139.222 (13) |
In1ii—Ce1—Ce2 | 105.77 (2) | In2iii—Pt—Ce1 | 139.222 (13) |
In1iii—Ce1—Ce2 | 105.77 (2) | Ce1viii—Pt—Ce1 | 80.32 (3) |
In2—Ce1—Ce2 | 56.542 (18) | In2iii—Pt—In1iii | 126.71 (3) |
In2i—Ce1—Ce2 | 56.542 (18) | Ce1viii—Pt—In1iii | 68.29 (2) |
Ce3iv—Ce1—Ce2 | 100.86 (2) | Ce1—Pt—In1iii | 68.29 (2) |
In1v—Ce1—Ce2 | 136.93 (2) | In2iii—Pt—Ce2ii | 69.85 (2) |
In1vi—Ce1—Ce2 | 136.93 (2) | Ce1viii—Pt—Ce2ii | 137.82 (3) |
Ce1vii—Ce1—Ce2 | 162.12 (3) | Ce1—Pt—Ce2ii | 85.622 (19) |
Pti—Ce1—Ce1viii | 130.161 (13) | In1iii—Pt—Ce2ii | 69.56 (2) |
Pt—Ce1—Ce1viii | 49.839 (13) | In2iii—Pt—Ce2iii | 69.85 (2) |
In1ii—Ce1—Ce1viii | 125.001 (13) | Ce1viii—Pt—Ce2iii | 85.622 (19) |
In1iii—Ce1—Ce1viii | 54.999 (13) | Ce1—Pt—Ce2iii | 137.82 (3) |
In2—Ce1—Ce1viii | 56.188 (12) | In1iii—Pt—Ce2iii | 69.56 (2) |
In2i—Ce1—Ce1viii | 123.812 (12) | Ce2ii—Pt—Ce2iii | 78.65 (3) |
Ce3iv—Ce1—Ce1viii | 90.0 | In2iii—Pt—Ce2viii | 70.06 (2) |
In1v—Ce1—Ce1viii | 57.077 (12) | Ce1viii—Pt—Ce2viii | 77.44 (2) |
In1vi—Ce1—Ce1viii | 122.923 (12) | Ce1—Pt—Ce2viii | 126.10 (3) |
Ce1vii—Ce1—Ce1viii | 90.0 | In1iii—Pt—Ce2viii | 140.040 (13) |
Ce2—Ce1—Ce1viii | 90.0 | Ce2ii—Pt—Ce2viii | 139.896 (19) |
Pti—Ce1—Ce1i | 49.839 (13) | Ce2iii—Pt—Ce2viii | 88.407 (15) |
Pt—Ce1—Ce1i | 130.161 (13) | In2iii—Pt—Ce2 | 70.06 (2) |
In1ii—Ce1—Ce1i | 54.999 (13) | Ce1viii—Pt—Ce2 | 126.10 (3) |
In1iii—Ce1—Ce1i | 125.001 (13) | Ce1—Pt—Ce2 | 77.44 (2) |
In2—Ce1—Ce1i | 123.812 (12) | In1iii—Pt—Ce2 | 140.040 (13) |
In2i—Ce1—Ce1i | 56.188 (12) | Ce2ii—Pt—Ce2 | 88.407 (15) |
Ce3iv—Ce1—Ce1i | 90.0 | Ce2iii—Pt—Ce2 | 139.896 (19) |
In1v—Ce1—Ce1i | 122.923 (12) | Ce2viii—Pt—Ce2 | 77.43 (2) |
In1vi—Ce1—Ce1i | 57.078 (12) | In2iii—Pt—In2 | 117.84 (3) |
Ce1vii—Ce1—Ce1i | 90.0 | Ce1viii—Pt—In2 | 63.582 (18) |
Ce2—Ce1—Ce1i | 90.0 | Ce1—Pt—In2 | 63.582 (18) |
Ce1viii—Ce1—Ce1i | 180.00 (4) | In1iii—Pt—In2 | 115.44 (3) |
Pti—Ce1—Ce2ii | 47.732 (14) | Ce2ii—Pt—In2 | 140.654 (13) |
Pt—Ce1—Ce2ii | 47.732 (14) | Ce2iii—Pt—In2 | 140.654 (13) |
In1ii—Ce1—Ce2ii | 53.93 (2) | Ce2viii—Pt—In2 | 62.53 (2) |
In1iii—Ce1—Ce2ii | 53.93 (2) | Ce2—Pt—In2 | 62.53 (2) |
In2—Ce1—Ce2ii | 109.56 (2) | In2iii—Pt—Ptviii | 90.0 |
In2i—Ce1—Ce2ii | 109.56 (2) | Ce1viii—Pt—Ptviii | 49.839 (13) |
Ce3iv—Ce1—Ce2ii | 166.19 (2) | Ce1—Pt—Ptviii | 130.161 (13) |
In1v—Ce1—Ce2ii | 132.89 (2) | In1iii—Pt—Ptviii | 90.0 |
In1vi—Ce1—Ce2ii | 132.89 (2) | Ce2ii—Pt—Ptviii | 129.325 (12) |
Ce1vii—Ce1—Ce2ii | 96.79 (3) | Ce2iii—Pt—Ptviii | 50.675 (13) |
Ce2—Ce1—Ce2ii | 65.333 (17) | Ce2viii—Pt—Ptviii | 51.287 (12) |
Ce1viii—Ce1—Ce2ii | 90.0 | Ce2—Pt—Ptviii | 128.713 (12) |
Ce1i—Ce1—Ce2ii | 90.0 | In2—Pt—Ptviii | 90.0 |
Ptix—Ce2—Ptiv | 78.65 (3) | In2iii—Pt—Pti | 90.0 |
Ptix—Ce2—Pti | 158.86 (3) | Ce1viii—Pt—Pti | 130.161 (13) |
Ptiv—Ce2—Pti | 98.047 (16) | Ce1—Pt—Pti | 49.839 (13) |
Ptix—Ce2—Pt | 98.047 (16) | In1iii—Pt—Pti | 90.0 |
Ptiv—Ce2—Pt | 158.86 (3) | Ce2ii—Pt—Pti | 50.675 (12) |
Pti—Ce2—Pt | 77.43 (2) | Ce2iii—Pt—Pti | 129.325 (13) |
Ptix—Ce2—In1i | 97.48 (2) | Ce2viii—Pt—Pti | 128.713 (12) |
Ptiv—Ce2—In1i | 54.632 (18) | Ce2—Pt—Pti | 51.287 (12) |
Pti—Ce2—In1i | 97.42 (2) | In2—Pt—Pti | 90.0 |
Pt—Ce2—In1i | 145.99 (3) | Ptviii—Pt—Pti | 180.00 (4) |
Ptix—Ce2—In1 | 54.632 (18) | Ptix—In1—In2iii | 102.98 (3) |
Ptiv—Ce2—In1 | 97.48 (2) | Ptix—In1—Ce1ix | 55.719 (19) |
Pti—Ce2—In1 | 145.99 (3) | In2iii—In1—Ce1ix | 134.91 (2) |
Pt—Ce2—In1 | 97.42 (2) | Ptix—In1—Ce1iv | 55.719 (19) |
In1i—Ce2—In1 | 68.03 (3) | In2iii—In1—Ce1iv | 134.91 (2) |
Ptix—Ce2—In2 | 54.35 (2) | Ce1ix—In1—Ce1iv | 70.00 (3) |
Ptiv—Ce2—In2 | 97.17 (3) | Ptix—In1—Ce3 | 139.720 (18) |
Pti—Ce2—In2 | 106.08 (3) | In2iii—In1—Ce3 | 62.43 (2) |
Pt—Ce2—In2 | 65.08 (2) | Ce1ix—In1—Ce3 | 159.45 (3) |
In1i—Ce2—In2 | 145.92 (3) | Ce1iv—In1—Ce3 | 106.194 (17) |
In1—Ce2—In2 | 101.74 (2) | Ptix—In1—Ce3viii | 139.720 (18) |
Ptix—Ce2—In2i | 97.17 (3) | In2iii—In1—Ce3viii | 62.43 (2) |
Ptiv—Ce2—In2i | 54.35 (2) | Ce1ix—In1—Ce3viii | 106.194 (17) |
Pti—Ce2—In2i | 65.08 (2) | Ce1iv—In1—Ce3viii | 159.45 (3) |
Pt—Ce2—In2i | 106.08 (3) | Ce3—In1—Ce3viii | 69.94 (2) |
In1i—Ce2—In2i | 101.74 (2) | Ptix—In1—Ce2viii | 55.81 (2) |
In1—Ce2—In2i | 145.92 (3) | In2iii—In1—Ce2viii | 62.12 (2) |
In2—Ce2—In2i | 67.89 (3) | Ce1ix—In1—Ce2viii | 74.04 (2) |
Ptix—Ce2—In2ii | 147.23 (3) | Ce1iv—In1—Ce2viii | 111.52 (3) |
Ptiv—Ce2—In2ii | 98.04 (2) | Ce3—In1—Ce2viii | 124.54 (3) |
Pti—Ce2—In2ii | 53.71 (2) | Ce3viii—In1—Ce2viii | 85.74 (2) |
Pt—Ce2—In2ii | 95.74 (3) | Ptix—In1—Ce2 | 55.81 (2) |
In1i—Ce2—In2ii | 56.95 (2) | In2iii—In1—Ce2 | 62.12 (2) |
In1—Ce2—In2ii | 94.21 (3) | Ce1ix—In1—Ce2 | 111.52 (3) |
In2—Ce2—In2ii | 156.27 (3) | Ce1iv—In1—Ce2 | 74.04 (2) |
In2i—Ce2—In2ii | 107.324 (18) | Ce3—In1—Ce2 | 85.74 (2) |
Ptix—Ce2—In2iii | 98.04 (2) | Ce3viii—In1—Ce2 | 124.54 (3) |
Ptiv—Ce2—In2iii | 147.23 (3) | Ce2viii—In1—Ce2 | 68.03 (3) |
Pti—Ce2—In2iii | 95.74 (3) | Ptix—In1—Ce1xiii | 119.90 (3) |
Pt—Ce2—In2iii | 53.71 (2) | In2iii—In1—Ce1xiii | 123.11 (3) |
In1i—Ce2—In2iii | 94.21 (3) | Ce1ix—In1—Ce1xiii | 101.00 (3) |
In1—Ce2—In2iii | 56.95 (2) | Ce1iv—In1—Ce1xiii | 64.36 (2) |
In2—Ce2—In2iii | 107.324 (18) | Ce3—In1—Ce1xiii | 60.678 (17) |
In2i—Ce2—In2iii | 156.27 (3) | Ce3viii—In1—Ce1xiii | 97.66 (3) |
In2ii—Ce2—In2iii | 67.16 (2) | Ce2viii—In1—Ce1xiii | 174.67 (3) |
Ptix—Ce2—Ce1 | 111.18 (2) | Ce2—In1—Ce1xiii | 112.804 (18) |
Ptiv—Ce2—Ce1 | 111.18 (2) | Ptix—In1—Ce1xiv | 119.90 (3) |
Pti—Ce2—Ce1 | 50.183 (14) | In2iii—In1—Ce1xiv | 123.11 (3) |
Pt—Ce2—Ce1 | 50.183 (14) | Ce1ix—In1—Ce1xiv | 64.36 (2) |
In1i—Ce2—Ce1 | 145.290 (14) | Ce1iv—In1—Ce1xiv | 101.00 (3) |
In1—Ce2—Ce1 | 145.290 (14) | Ce3—In1—Ce1xiv | 97.66 (3) |
In2—Ce2—Ce1 | 56.84 (2) | Ce3viii—In1—Ce1xiv | 60.678 (17) |
In2i—Ce2—Ce1 | 56.84 (2) | Ce2viii—In1—Ce1xiv | 112.804 (18) |
In2ii—Ce2—Ce1 | 100.48 (2) | Ce2—In1—Ce1xiv | 174.67 (3) |
In2iii—Ce2—Ce1 | 100.48 (2) | Ce1xiii—In1—Ce1xiv | 65.85 (2) |
Ptix—Ce2—Ce2viii | 50.675 (13) | Ptix—In2—In1ix | 102.47 (3) |
Ptiv—Ce2—Ce2viii | 129.325 (12) | Ptix—In2—Ce2 | 55.81 (2) |
Pti—Ce2—Ce2viii | 128.713 (12) | In1ix—In2—Ce2 | 135.83 (2) |
Pt—Ce2—Ce2viii | 51.287 (12) | Ptix—In2—Ce2viii | 55.81 (2) |
In1i—Ce2—Ce2viii | 124.016 (13) | In1ix—In2—Ce2viii | 135.83 (2) |
In1—Ce2—Ce2viii | 55.984 (13) | Ce2—In2—Ce2viii | 67.89 (3) |
In2—Ce2—Ce2viii | 56.057 (13) | Ptix—In2—Ce3ix | 138.75 (2) |
In2i—Ce2—Ce2viii | 123.943 (13) | In1ix—In2—Ce3ix | 59.618 (19) |
In2ii—Ce2—Ce2viii | 123.581 (12) | Ce2—In2—Ce3ix | 161.54 (3) |
In2iii—Ce2—Ce2viii | 56.419 (12) | Ce2viii—In2—Ce3ix | 109.006 (18) |
Ce1—Ce2—Ce2viii | 90.0 | Ptix—In2—Ce3iv | 138.75 (2) |
Ptix—Ce2—Ce2i | 129.325 (13) | In1ix—In2—Ce3iv | 59.618 (19) |
Ptiv—Ce2—Ce2i | 50.675 (13) | Ce2—In2—Ce3iv | 109.006 (18) |
Pti—Ce2—Ce2i | 51.287 (12) | Ce2viii—In2—Ce3iv | 161.54 (3) |
Pt—Ce2—Ce2i | 128.713 (12) | Ce3ix—In2—Ce3iv | 67.80 (2) |
In1i—Ce2—Ce2i | 55.984 (13) | Ptix—In2—Ce1 | 122.41 (3) |
In1—Ce2—Ce2i | 124.016 (13) | In1ix—In2—Ce1 | 120.27 (3) |
In2—Ce2—Ce2i | 123.943 (13) | Ce2—In2—Ce1 | 66.62 (2) |
In2i—Ce2—Ce2i | 56.057 (13) | Ce2viii—In2—Ce1 | 102.98 (3) |
In2ii—Ce2—Ce2i | 56.419 (12) | Ce3ix—In2—Ce1 | 97.51 (3) |
In2iii—Ce2—Ce2i | 123.581 (12) | Ce3iv—In2—Ce1 | 60.650 (17) |
Ce1—Ce2—Ce2i | 90.0 | Ptix—In2—Ce1viii | 122.41 (3) |
Ce2viii—Ce2—Ce2i | 180.00 (5) | In1ix—In2—Ce1viii | 120.27 (3) |
Ptix—Ce2—Ce1iv | 46.647 (15) | Ce2—In2—Ce1viii | 102.98 (3) |
Ptiv—Ce2—Ce1iv | 46.647 (15) | Ce2viii—In2—Ce1viii | 66.62 (2) |
Pti—Ce2—Ce1iv | 141.287 (12) | Ce3ix—In2—Ce1viii | 60.650 (17) |
Pt—Ce2—Ce1iv | 141.287 (12) | Ce3iv—In2—Ce1viii | 97.51 (3) |
In1i—Ce2—Ce1iv | 52.031 (18) | Ce1—In2—Ce1viii | 67.62 (2) |
In1—Ce2—Ce1iv | 52.031 (18) | Ptix—In2—Ce2ix | 56.237 (19) |
In2—Ce2—Ce1iv | 95.42 (3) | In1ix—In2—Ce2ix | 60.93 (2) |
In2i—Ce2—Ce1iv | 95.42 (3) | Ce2—In2—Ce2ix | 112.04 (3) |
In2ii—Ce2—Ce1iv | 108.26 (2) | Ce2viii—In2—Ce2ix | 75.970 (17) |
In2iii—Ce2—Ce1iv | 108.26 (2) | Ce3ix—In2—Ce2ix | 83.75 (2) |
Ce1—Ce2—Ce1iv | 145.29 (3) | Ce3iv—In2—Ce2ix | 120.54 (3) |
Ce2viii—Ce2—Ce1iv | 90.0 | Ce1—In2—Ce2ix | 178.60 (3) |
Ce2i—Ce2—Ce1iv | 90.0 | Ce1viii—In2—Ce2ix | 112.589 (16) |
In1x—Ce3—In1 | 180.00 (3) | Ptix—In2—Ce2iv | 56.237 (19) |
In1x—Ce3—In1xi | 69.94 (2) | In1ix—In2—Ce2iv | 60.93 (2) |
In1—Ce3—In1xi | 110.06 (2) | Ce2—In2—Ce2iv | 75.970 (17) |
In1x—Ce3—In1i | 110.06 (2) | Ce2viii—In2—Ce2iv | 112.04 (3) |
In1—Ce3—In1i | 69.94 (2) | Ce3ix—In2—Ce2iv | 120.54 (3) |
In1xi—Ce3—In1i | 180.00 (3) | Ce3iv—In2—Ce2iv | 83.75 (2) |
In1x—Ce3—In2iii | 122.05 (2) | Ce1—In2—Ce2iv | 112.589 (16) |
In1—Ce3—In2iii | 57.95 (2) | Ce1viii—In2—Ce2iv | 178.60 (3) |
In1xi—Ce3—In2iii | 83.76 (2) | Ce2ix—In2—Ce2iv | 67.16 (2) |
In1i—Ce3—In2iii | 96.24 (2) | Ptix—In2—Pt | 89.99 (3) |
In1x—Ce3—In2xii | 57.95 (2) | In1ix—In2—Pt | 167.53 (3) |
In1—Ce3—In2xii | 122.05 (2) | Ce2—In2—Pt | 52.387 (17) |
In1xi—Ce3—In2xii | 96.24 (2) | Ce2viii—In2—Pt | 52.387 (17) |
In1i—Ce3—In2xii | 83.76 (2) | Ce3ix—In2—Pt | 110.60 (2) |
In2iii—Ce3—In2xii | 180.00 (4) | Ce3iv—In2—Pt | 110.60 (2) |
In1x—Ce3—In2ii | 83.76 (2) | Ce1—In2—Pt | 50.599 (18) |
In1—Ce3—In2ii | 96.24 (2) | Ce1viii—In2—Pt | 50.599 (18) |
In1xi—Ce3—In2ii | 122.05 (2) | Ce2ix—In2—Pt | 128.36 (2) |
In1i—Ce3—In2ii | 57.95 (2) | Ce2iv—In2—Pt | 128.36 (2) |
In2iii—Ce3—In2ii | 67.80 (2) |
Symmetry codes: (i) x, y, z−1; (ii) x−1/2, −y+1/2, −z; (iii) x−1/2, −y+1/2, −z+1; (iv) x+1/2, −y+1/2, −z; (v) −x+1/2, y+1/2, z; (vi) −x+1/2, y+1/2, z−1; (vii) −x, −y+1, −z; (viii) x, y, z+1; (ix) x+1/2, −y+1/2, −z+1; (x) −x, −y, −z; (xi) −x, −y, −z+1; (xii) −x+1/2, y−1/2, z−1; (xiii) −x+1/2, y−1/2, z; (xiv) −x+1/2, y−1/2, z+1. |
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