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The inter­metallic title compound, cerium triplatinum penta­aluminium, crystallizes in a site-exchange variant of the YNi5Si3-type structure.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805038122/bt6790sup1.cif
Contains datablocks I, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805038122/bt6790Isup2.hkl
Contains datablock I

Key indicators

  • Single-crystal X-ray study
  • T = 291 K
  • Mean [sigma](t-Ce) = 0.001 Å
  • R factor = 0.034
  • wR factor = 0.084
  • Data-to-parameter ratio = 22.5

checkCIF/PLATON results

No syntax errors found



Alert level C DIFMN02_ALERT_2_C The minimum difference density is < -0.1*ZMAX*0.75 _refine_diff_density_min given = -5.874 Test value = -5.850 DIFMN03_ALERT_1_C The minimum difference density is < -0.1*ZMAX*0.75 The relevant atom site should be identified. PLAT061_ALERT_3_C Tmax/Tmin Range Test RR' too Large ............. 0.83
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 3 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 0 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

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).

cerium triplatinum pentaaluminium top
Crystal data top
CePt3Al5F(000) = 1428
Mr = 860.29Dx = 9.180 Mg m3
Orthorhombic, PnmaMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ac 2nCell parameters from 25 reflections
a = 20.651 (4) Åθ = 15.5–20.6°
b = 4.1381 (8) ŵ = 74.96 mm1
c = 7.2842 (15) ÅT = 291 K
V = 622.5 (2) Å3Prism, metallic light grey
Z = 40.04 × 0.04 × 0.04 mm
Data collection top
Enraf–Nonius CAD-4
diffractometer
1041 reflections with I > 2σ(I)
Radiation source: fine-focus sealed tubeRint = 0.058
Graphite monochromatorθmax = 32.5°, θmin = 2.0°
ω scansh = 031
Absorption correction: ψ scan
(North et al., 1968)
k = 64
Tmin = 0.065, Tmax = 0.073l = 011
2062 measured reflections1 standard reflections every 120 min
1259 independent reflections intensity decay: none
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.034 w = 1/[σ2(Fo2) + (0.0516P)2 + 2.6515P]
where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.084(Δ/σ)max < 0.001
S = 0.99Δρmax = 3.95 e Å3
1259 reflectionsΔρmin = 5.87 e Å3
56 parametersExtinction correction: SHELXL97 (Sheldrick, 1997), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4
0 restraintsExtinction coefficient: 0.00169 (14)
Special details top

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.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Ce0.35960 (3)0.25000.88193 (10)0.00572 (16)
Pt10.07245 (2)0.25000.66471 (6)0.00590 (13)
Pt20.08413 (2)0.25000.07650 (7)0.00538 (13)
Pt30.26283 (2)0.25000.38292 (6)0.00499 (13)
Al10.0077 (2)0.25000.3696 (6)0.0073 (7)
Al20.20088 (19)0.25000.6885 (6)0.0071 (7)
Al30.20836 (19)0.25000.0745 (6)0.0075 (7)
Al40.3825 (2)0.25000.3564 (6)0.0072 (7)
Al50.48311 (19)0.25000.6125 (5)0.0055 (7)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ce0.0048 (3)0.0063 (3)0.0060 (3)0.0000.0007 (2)0.000
Pt10.0045 (2)0.0074 (2)0.0058 (2)0.0000.00054 (14)0.000
Pt20.0032 (2)0.0067 (2)0.0062 (2)0.0000.00035 (14)0.000
Pt30.0044 (2)0.0055 (2)0.0051 (2)0.0000.00025 (13)0.000
Al10.0056 (17)0.009 (2)0.0070 (17)0.0000.0005 (13)0.000
Al20.0077 (18)0.0066 (19)0.0070 (17)0.0000.0021 (13)0.000
Al30.0059 (16)0.010 (2)0.0068 (16)0.0000.0003 (13)0.000
Al40.0030 (16)0.0077 (19)0.0110 (18)0.0000.0018 (13)0.000
Al50.0060 (17)0.0042 (19)0.0062 (16)0.0000.0008 (12)0.000
Geometric parameters (Å, º) top
Ce—Al53.218 (4)Pt3—Al2xi2.617 (3)
Ce—Pt1i3.2393 (7)Pt3—Cex3.2670 (8)
Ce—Pt1ii3.2393 (7)Pt3—Cexi3.2670 (8)
Ce—Pt2ii3.2529 (8)Al1—Pt1viii2.661 (3)
Ce—Pt2i3.2529 (8)Al1—Pt1ix2.661 (3)
Ce—Pt3ii3.2670 (8)Al1—Al5x2.797 (4)
Ce—Pt3i3.2670 (8)Al1—Al5xi2.797 (4)
Ce—Al2i3.290 (3)Al1—Al1ix2.827 (6)
Ce—Al2ii3.290 (3)Al1—Al1viii2.827 (6)
Ce—Al3ii3.356 (3)Al1—Cexi3.435 (3)
Ce—Al3i3.356 (3)Al1—Cex3.435 (3)
Ce—Al3iii3.424 (4)Al1—Cevii3.553 (4)
Ce—Al1i3.435 (3)Al2—Pt3i2.617 (3)
Ce—Al1ii3.435 (3)Al2—Pt3ii2.617 (3)
Ce—Al4iii3.488 (4)Al2—Al3iii2.816 (6)
Ce—Al1iv3.553 (4)Al2—Al3i2.912 (4)
Ce—Al23.568 (4)Al2—Al3ii2.912 (4)
Ce—Cev4.1381 (8)Al2—Al4ii2.956 (4)
Ce—Cevi4.1381 (8)Al2—Al4i2.956 (4)
Pt1—Al5vii2.457 (4)Al2—Cex3.290 (3)
Pt1—Al12.532 (4)Al2—Cexi3.290 (3)
Pt1—Al22.658 (4)Al3—Pt3x2.566 (2)
Pt1—Al1viii2.661 (3)Al3—Pt3xi2.566 (2)
Pt1—Al1ix2.661 (3)Al3—Al2xiii2.816 (6)
Pt1—Al4i2.664 (3)Al3—Al2xi2.912 (4)
Pt1—Al4ii2.664 (3)Al3—Al2x2.912 (4)
Pt1—Pt2iii3.0092 (9)Al3—Cexi3.356 (3)
Pt1—Cex3.2393 (7)Al3—Cex3.356 (3)
Pt1—Cexi3.2393 (7)Al3—Cexiii3.424 (4)
Pt2—Al5xii2.500 (4)Al4—Pt1x2.664 (3)
Pt2—Al5x2.506 (2)Al4—Pt1xi2.664 (3)
Pt2—Al5xi2.506 (2)Al4—Pt2i2.707 (3)
Pt2—Al32.566 (4)Al4—Pt2ii2.707 (3)
Pt2—Al12.655 (4)Al4—Al52.793 (6)
Pt2—Al4x2.707 (3)Al4—Al2x2.956 (4)
Pt2—Al4xi2.707 (3)Al4—Al2xi2.956 (4)
Pt2—Pt1xiii3.0092 (9)Al4—Cexiii3.488 (4)
Pt2—Cexi3.2529 (8)Al5—Pt1iv2.457 (4)
Pt2—Cex3.2529 (8)Al5—Pt2xiv2.500 (4)
Pt3—Al42.478 (4)Al5—Pt2ii2.506 (2)
Pt3—Al32.512 (4)Al5—Pt2i2.506 (2)
Pt3—Al3i2.566 (2)Al5—Al5xv2.730 (5)
Pt3—Al3ii2.566 (2)Al5—Al5xvi2.730 (5)
Pt3—Al22.567 (4)Al5—Al1i2.797 (4)
Pt3—Al2x2.617 (3)Al5—Al1ii2.797 (4)
Al5—Ce—Pt1i92.55 (6)Al3—Pt3—Al2x69.16 (10)
Al5—Ce—Pt1ii92.55 (6)Al3i—Pt3—Al2x149.95 (13)
Pt1i—Ce—Pt1ii79.40 (2)Al3ii—Pt3—Al2x65.82 (11)
Al5—Ce—Pt2ii45.56 (3)Al2—Pt3—Al2x127.73 (7)
Pt1i—Ce—Pt2ii133.35 (3)Al4—Pt3—Al2xi70.87 (10)
Pt1ii—Ce—Pt2ii82.755 (19)Al3—Pt3—Al2xi69.16 (10)
Al5—Ce—Pt2i45.56 (3)Al3i—Pt3—Al2xi65.82 (11)
Pt1i—Ce—Pt2i82.755 (19)Al3ii—Pt3—Al2xi149.95 (13)
Pt1ii—Ce—Pt2i133.35 (3)Al2—Pt3—Al2xi127.73 (7)
Pt2ii—Ce—Pt2i79.00 (2)Al2x—Pt3—Al2xi104.48 (14)
Al5—Ce—Pt3ii127.93 (4)Al4—Pt3—Cex140.476 (15)
Pt1i—Ce—Pt3ii137.59 (3)Al3—Pt3—Cex69.61 (7)
Pt1ii—Ce—Pt3ii85.946 (17)Al3i—Pt3—Cex133.74 (9)
Pt2ii—Ce—Pt3ii82.828 (17)Al3ii—Pt3—Cex70.73 (8)
Pt2i—Ce—Pt3ii132.91 (3)Al2—Pt3—Cex67.44 (7)
Al5—Ce—Pt3i127.93 (4)Al2x—Pt3—Cex73.72 (8)
Pt1i—Ce—Pt3i85.946 (17)Al2xi—Pt3—Cex136.15 (9)
Pt1ii—Ce—Pt3i137.59 (3)Al4—Pt3—Cexi140.476 (15)
Pt2ii—Ce—Pt3i132.91 (3)Al3—Pt3—Cexi69.61 (7)
Pt2i—Ce—Pt3i82.828 (17)Al3i—Pt3—Cexi70.73 (8)
Pt3ii—Ce—Pt3i78.59 (2)Al3ii—Pt3—Cexi133.74 (9)
Al5—Ce—Al2i135.62 (6)Al2—Pt3—Cexi67.44 (7)
Pt1i—Ce—Al2i48.03 (7)Al2x—Pt3—Cexi136.15 (9)
Pt1ii—Ce—Al2i97.73 (6)Al2xi—Pt3—Cexi73.72 (8)
Pt2ii—Ce—Al2i178.62 (7)Cex—Pt3—Cexi78.59 (2)
Pt2i—Ce—Al2i101.52 (5)Pt1—Al1—Pt1viii114.09 (11)
Pt3ii—Ce—Al2i95.91 (6)Pt1—Al1—Pt1ix114.09 (11)
Pt3i—Ce—Al2i46.09 (7)Pt1viii—Al1—Pt1ix102.07 (14)
Al5—Ce—Al2ii135.62 (6)Pt1—Al1—Pt2111.62 (15)
Pt1i—Ce—Al2ii97.73 (6)Pt1viii—Al1—Pt2107.11 (11)
Pt1ii—Ce—Al2ii48.03 (7)Pt1ix—Al1—Pt2107.11 (11)
Pt2ii—Ce—Al2ii101.52 (5)Pt1—Al1—Al5x122.17 (13)
Pt2i—Ce—Al2ii178.62 (7)Pt1viii—Al1—Al5x53.44 (9)
Pt3ii—Ce—Al2ii46.09 (7)Pt1ix—Al1—Al5x123.69 (17)
Pt3i—Ce—Al2ii95.91 (6)Pt2—Al1—Al5x54.64 (10)
Al2i—Ce—Al2ii77.93 (9)Pt1—Al1—Al5xi122.17 (13)
Al5—Ce—Al3ii85.68 (9)Pt1viii—Al1—Al5xi123.69 (17)
Pt1i—Ce—Al3ii177.64 (6)Pt1ix—Al1—Al5xi53.44 (9)
Pt1ii—Ce—Al3ii102.22 (5)Pt2—Al1—Al5xi54.64 (10)
Pt2ii—Ce—Al3ii45.65 (7)Al5x—Al1—Al5xi95.42 (17)
Pt2i—Ce—Al3ii94.89 (6)Pt1—Al1—Al1ix59.24 (14)
Pt3ii—Ce—Al3ii44.56 (7)Pt1viii—Al1—Al1ix124.2 (2)
Pt3i—Ce—Al3ii93.91 (6)Pt1ix—Al1—Al1ix54.85 (9)
Al2i—Ce—Al3ii132.97 (10)Pt2—Al1—Al1ix127.37 (16)
Al2ii—Ce—Al3ii84.63 (9)Al5x—Al1—Al1ix177.4 (3)
Al5—Ce—Al3i85.68 (9)Al5xi—Al1—Al1ix85.19 (9)
Pt1i—Ce—Al3i102.22 (5)Pt1—Al1—Al1viii59.24 (14)
Pt1ii—Ce—Al3i177.64 (6)Pt1viii—Al1—Al1viii54.85 (9)
Pt2ii—Ce—Al3i94.89 (6)Pt1ix—Al1—Al1viii124.2 (2)
Pt2i—Ce—Al3i45.65 (7)Pt2—Al1—Al1viii127.37 (16)
Pt3ii—Ce—Al3i93.91 (6)Al5x—Al1—Al1viii85.19 (9)
Pt3i—Ce—Al3i44.56 (7)Al5xi—Al1—Al1viii177.4 (3)
Al2i—Ce—Al3i84.63 (9)Al1ix—Al1—Al1viii94.1 (2)
Al2ii—Ce—Al3i132.97 (10)Pt1—Al1—Cexi63.65 (8)
Al3ii—Ce—Al3i76.11 (9)Pt1viii—Al1—Cexi165.20 (12)
Al5—Ce—Al3iii166.61 (10)Pt1ix—Al1—Cexi91.73 (4)
Pt1i—Ce—Al3iii97.74 (6)Pt2—Al1—Cexi63.04 (8)
Pt1ii—Ce—Al3iii97.74 (6)Al5x—Al1—Cexi114.12 (16)
Pt2ii—Ce—Al3iii127.31 (5)Al5xi—Al1—Cexi61.16 (10)
Pt2i—Ce—Al3iii127.31 (4)Al1ix—Al1—Cexi68.34 (12)
Pt3ii—Ce—Al3iii45.02 (3)Al1viii—Al1—Cexi120.8 (2)
Pt3i—Ce—Al3iii45.02 (3)Pt1—Al1—Cex63.65 (8)
Al2i—Ce—Al3iii51.37 (7)Pt1viii—Al1—Cex91.73 (4)
Al2ii—Ce—Al3iii51.37 (7)Pt1ix—Al1—Cex165.20 (12)
Al3ii—Ce—Al3iii83.79 (4)Pt2—Al1—Cex63.04 (8)
Al3i—Ce—Al3iii83.79 (4)Al5x—Al1—Cex61.16 (10)
Al5—Ce—Al1i49.58 (7)Al5xi—Al1—Cex114.12 (16)
Pt1i—Ce—Al1i44.47 (7)Al1ix—Al1—Cex120.8 (2)
Pt1ii—Ce—Al1i93.19 (6)Al1viii—Al1—Cex68.34 (12)
Pt2ii—Ce—Al1i94.60 (6)Cexi—Al1—Cex74.06 (9)
Pt2i—Ce—Al1i46.68 (7)Pt1—Al1—Cevii91.27 (12)
Pt3ii—Ce—Al1i177.37 (5)Pt1viii—Al1—Cevii60.84 (8)
Pt3i—Ce—Al1i103.66 (5)Pt1ix—Al1—Cevii60.84 (8)
Al2i—Ce—Al1i86.67 (8)Pt2—Al1—Cevii157.11 (15)
Al2ii—Ce—Al1i134.38 (10)Al5x—Al1—Cevii113.55 (13)
Al3ii—Ce—Al1i133.43 (10)Al5xi—Al1—Cevii113.55 (13)
Al3i—Ce—Al1i86.84 (8)Al1ix—Al1—Cevii63.97 (15)
Al3iii—Ce—Al1i137.61 (6)Al1viii—Al1—Cevii63.97 (15)
Al5—Ce—Al1ii49.58 (7)Cexi—Al1—Cevii132.32 (8)
Pt1i—Ce—Al1ii93.19 (6)Cex—Al1—Cevii132.32 (8)
Pt1ii—Ce—Al1ii44.47 (7)Pt3—Al2—Pt3i109.06 (11)
Pt2ii—Ce—Al1ii46.68 (7)Pt3—Al2—Pt3ii109.06 (11)
Pt2i—Ce—Al1ii94.60 (6)Pt3i—Al2—Pt3ii104.48 (14)
Pt3ii—Ce—Al1ii103.66 (5)Pt3—Al2—Pt1116.16 (15)
Pt3i—Ce—Al1ii177.37 (5)Pt3i—Al2—Pt1108.72 (11)
Al2i—Ce—Al1ii134.38 (10)Pt3ii—Al2—Pt1108.72 (11)
Al2ii—Ce—Al1ii86.67 (8)Pt3—Al2—Al3iii146.97 (18)
Al3ii—Ce—Al1ii86.84 (8)Pt3i—Al2—Al3iii56.21 (8)
Al3i—Ce—Al1ii133.43 (10)Pt3ii—Al2—Al3iii56.21 (8)
Al3iii—Ce—Al1ii137.61 (6)Pt1—Al2—Al3iii96.87 (15)
Al1i—Ce—Al1ii74.06 (9)Pt3—Al2—Al3i55.41 (10)
Al5—Ce—Al4iii119.80 (10)Pt3i—Al2—Al3i53.72 (8)
Pt1i—Ce—Al4iii46.47 (3)Pt3ii—Al2—Al3i122.12 (16)
Pt1ii—Ce—Al4iii46.47 (3)Pt1—Al2—Al3i128.58 (11)
Pt2ii—Ce—Al4iii129.00 (4)Al3iii—Al2—Al3i104.43 (13)
Pt2i—Ce—Al4iii129.00 (4)Pt3—Al2—Al3ii55.41 (10)
Pt3ii—Ce—Al4iii95.89 (5)Pt3i—Al2—Al3ii122.12 (16)
Pt3i—Ce—Al4iii95.89 (5)Pt3ii—Al2—Al3ii53.72 (8)
Al2i—Ce—Al4iii51.61 (8)Pt1—Al2—Al3ii128.58 (11)
Al2ii—Ce—Al4iii51.61 (8)Al3iii—Al2—Al3ii104.43 (13)
Al3ii—Ce—Al4iii135.86 (6)Al3i—Al2—Al3ii90.54 (16)
Al3i—Ce—Al4iii135.86 (6)Pt3—Al2—Al4ii130.46 (10)
Al3iii—Ce—Al4iii73.59 (10)Pt3i—Al2—Al4ii119.74 (17)
Al1i—Ce—Al4iii85.29 (9)Pt3ii—Al2—Al4ii52.37 (8)
Al1ii—Ce—Al4iii85.29 (9)Pt1—Al2—Al4ii56.36 (10)
Al5—Ce—Al1iv68.20 (10)Al3iii—Al2—Al4ii67.59 (13)
Pt1i—Ce—Al1iv45.84 (3)Al3i—Al2—Al4ii171.80 (19)
Pt1ii—Ce—Al1iv45.84 (3)Al3ii—Al2—Al4ii89.73 (8)
Pt2ii—Ce—Al1iv92.35 (6)Pt3—Al2—Al4i130.46 (10)
Pt2i—Ce—Al1iv92.35 (6)Pt3i—Al2—Al4i52.37 (8)
Pt3ii—Ce—Al1iv131.67 (4)Pt3ii—Al2—Al4i119.74 (17)
Pt3i—Ce—Al1iv131.67 (4)Pt1—Al2—Al4i56.36 (10)
Al2i—Ce—Al1iv88.91 (9)Al3iii—Al2—Al4i67.59 (13)
Al2ii—Ce—Al1iv88.91 (9)Al3i—Al2—Al4i89.73 (8)
Al3ii—Ce—Al1iv134.40 (7)Al3ii—Al2—Al4i171.80 (19)
Al3i—Ce—Al1iv134.40 (7)Al4ii—Al2—Al4i88.83 (16)
Al3iii—Ce—Al1iv125.19 (10)Pt3—Al2—Cex66.47 (8)
Al1i—Ce—Al1iv47.68 (8)Pt3i—Al2—Cex166.69 (11)
Al1ii—Ce—Al1iv47.68 (8)Pt3ii—Al2—Cex88.79 (3)
Al4iii—Ce—Al1iv51.60 (9)Pt1—Al2—Cex64.98 (8)
Al5—Ce—Al2119.16 (10)Al3iii—Al2—Cex134.30 (9)
Pt1i—Ce—Al2130.48 (4)Al3i—Al2—Cex119.84 (16)
Pt1ii—Ce—Al2130.48 (4)Al3ii—Al2—Cex66.68 (9)
Pt2ii—Ce—Al293.33 (6)Al4ii—Al2—Cex67.65 (9)
Pt2i—Ce—Al293.33 (6)Al4i—Al2—Cex119.99 (15)
Pt3ii—Ce—Al244.76 (3)Pt3—Al2—Cexi66.47 (8)
Pt3i—Ce—Al244.76 (3)Pt3i—Al2—Cexi88.79 (3)
Al2i—Ce—Al285.37 (5)Pt3ii—Al2—Cexi166.69 (11)
Al2ii—Ce—Al285.37 (5)Pt1—Al2—Cexi64.98 (8)
Al3ii—Ce—Al249.63 (7)Al3iii—Al2—Cexi134.30 (9)
Al3i—Ce—Al249.63 (7)Al3i—Al2—Cexi66.68 (9)
Al3iii—Ce—Al247.45 (10)Al3ii—Al2—Cexi119.84 (16)
Al1i—Ce—Al2136.27 (7)Al4ii—Al2—Cexi119.99 (15)
Al1ii—Ce—Al2136.27 (7)Al4i—Al2—Cexi67.65 (9)
Al4iii—Ce—Al2121.04 (10)Cex—Al2—Cexi77.93 (9)
Al1iv—Ce—Al2172.64 (9)Pt3—Al2—Ce83.38 (11)
Al5—Ce—Cev90.0Pt3i—Al2—Ce61.52 (8)
Pt1i—Ce—Cev129.698 (12)Pt3ii—Al2—Ce61.52 (8)
Pt1ii—Ce—Cev50.302 (12)Pt1—Al2—Ce160.47 (16)
Pt2ii—Ce—Cev50.501 (12)Al3iii—Al2—Ce63.59 (11)
Pt2i—Ce—Cev129.499 (12)Al3i—Al2—Ce61.41 (10)
Pt3ii—Ce—Cev50.704 (12)Al3ii—Al2—Ce61.41 (10)
Pt3i—Ce—Cev129.296 (12)Al4ii—Al2—Ce111.80 (12)
Al2i—Ce—Cev128.96 (5)Al4i—Al2—Ce111.80 (12)
Al2ii—Ce—Cev51.04 (5)Cex—Al2—Ce128.08 (9)
Al3ii—Ce—Cev51.94 (4)Cexi—Al2—Ce128.08 (9)
Al3i—Ce—Cev128.06 (4)Pt3—Al3—Pt3x112.49 (10)
Al3iii—Ce—Cev90.0Pt3—Al3—Pt3xi112.49 (10)
Al1i—Ce—Cev127.03 (4)Pt3x—Al3—Pt3xi107.50 (15)
Al1ii—Ce—Cev52.97 (4)Pt3—Al3—Pt2116.27 (16)
Al4iii—Ce—Cev90.0Pt3x—Al3—Pt2103.59 (11)
Al1iv—Ce—Cev90.0Pt3xi—Al3—Pt2103.59 (11)
Al2—Ce—Cev90.0Pt3—Al3—Al2xiii156.55 (19)
Al5—Ce—Cevi90.0Pt3x—Al3—Al2xiii57.97 (8)
Pt1i—Ce—Cevi50.302 (12)Pt3xi—Al3—Al2xiii57.97 (8)
Pt1ii—Ce—Cevi129.698 (12)Pt2—Al3—Al2xiii87.18 (15)
Pt2ii—Ce—Cevi129.499 (12)Pt3—Al3—Al2xi57.12 (10)
Pt2i—Ce—Cevi50.501 (12)Pt3x—Al3—Al2xi125.36 (17)
Pt3ii—Ce—Cevi129.296 (12)Pt3xi—Al3—Al2xi55.45 (8)
Pt3i—Ce—Cevi50.704 (12)Pt2—Al3—Al2xi129.93 (10)
Al2i—Ce—Cevi51.04 (5)Al2xiii—Al3—Al2xi108.65 (14)
Al2ii—Ce—Cevi128.96 (5)Pt3—Al3—Al2x57.12 (10)
Al3ii—Ce—Cevi128.06 (4)Pt3x—Al3—Al2x55.45 (8)
Al3i—Ce—Cevi51.94 (4)Pt3xi—Al3—Al2x125.36 (17)
Al3iii—Ce—Cevi90.0Pt2—Al3—Al2x129.93 (10)
Al1i—Ce—Cevi52.97 (4)Al2xiii—Al3—Al2x108.65 (14)
Al1ii—Ce—Cevi127.03 (4)Al2xi—Al3—Al2x90.54 (16)
Al4iii—Ce—Cevi90.0Pt3—Al3—Cexi65.83 (8)
Al1iv—Ce—Cevi90.0Pt3x—Al3—Cexi163.14 (12)
Al2—Ce—Cevi90.0Pt3xi—Al3—Cexi87.87 (4)
Cev—Ce—Cevi180.00 (4)Pt2—Al3—Cexi65.04 (8)
Al5vii—Pt1—Al199.44 (14)Al2xiii—Al3—Cexi130.03 (10)
Al5vii—Pt1—Al2134.94 (13)Al2xi—Al3—Cexi68.96 (9)
Al1—Pt1—Al2125.63 (14)Al2x—Al3—Cexi121.12 (15)
Al5vii—Pt1—Al1viii66.12 (10)Pt3—Al3—Cex65.83 (8)
Al1—Pt1—Al1viii65.91 (11)Pt3x—Al3—Cex87.87 (4)
Al2—Pt1—Al1viii128.80 (7)Pt3xi—Al3—Cex163.14 (12)
Al5vii—Pt1—Al1ix66.12 (9)Pt2—Al3—Cex65.04 (8)
Al1—Pt1—Al1ix65.91 (11)Al2xiii—Al3—Cex130.03 (10)
Al2—Pt1—Al1ix128.80 (7)Al2xi—Al3—Cex121.12 (15)
Al1viii—Pt1—Al1ix102.07 (14)Al2x—Al3—Cex68.96 (9)
Al5vii—Pt1—Al4i85.20 (10)Cexi—Al3—Cex76.11 (9)
Al1—Pt1—Al4i129.02 (7)Pt3—Al3—Cexiii87.59 (11)
Al2—Pt1—Al4i67.49 (10)Pt3x—Al3—Cexiii64.25 (8)
Al1viii—Pt1—Al4i150.50 (13)Pt3xi—Al3—Cexiii64.25 (8)
Al1ix—Pt1—Al4i70.28 (10)Pt2—Al3—Cexiii156.14 (16)
Al5vii—Pt1—Al4ii85.20 (10)Al2xiii—Al3—Cexiii68.96 (12)
Al1—Pt1—Al4ii129.02 (7)Al2xi—Al3—Cexiii61.95 (10)
Al2—Pt1—Al4ii67.49 (10)Al2x—Al3—Cexiii61.95 (10)
Al1viii—Pt1—Al4ii70.28 (10)Cexi—Al3—Cexiii130.91 (8)
Al1ix—Pt1—Al4ii150.50 (13)Cex—Al3—Cexiii130.91 (8)
Al4i—Pt1—Al4ii101.91 (14)Pt3—Al4—Pt1x112.91 (11)
Al5vii—Pt1—Pt2iii53.27 (9)Pt3—Al4—Pt1xi112.91 (11)
Al1—Pt1—Pt2iii152.70 (10)Pt1x—Al4—Pt1xi101.91 (14)
Al2—Pt1—Pt2iii81.67 (9)Pt3—Al4—Pt2i102.00 (11)
Al1viii—Pt1—Pt2iii98.24 (9)Pt1x—Al4—Pt2i144.58 (16)
Al1ix—Pt1—Pt2iii98.24 (9)Pt1xi—Al4—Pt2i68.14 (4)
Al4i—Pt1—Pt2iii56.60 (8)Pt3—Al4—Pt2ii102.00 (11)
Al4ii—Pt1—Pt2iii56.60 (8)Pt1x—Al4—Pt2ii68.14 (4)
Al5vii—Pt1—Cex138.18 (3)Pt1xi—Al4—Pt2ii144.58 (16)
Al1—Pt1—Cex71.88 (7)Pt2i—Al4—Pt2ii99.70 (13)
Al2—Pt1—Cex66.99 (7)Pt3—Al4—Al5133.61 (18)
Al1viii—Pt1—Cex73.32 (8)Pt1x—Al4—Al595.16 (12)
Al1ix—Pt1—Cex134.93 (9)Pt1xi—Al4—Al595.16 (12)
Al4i—Pt1—Cex132.68 (9)Pt2i—Al4—Al554.17 (7)
Al4ii—Pt1—Cex71.69 (8)Pt2ii—Al4—Al554.17 (7)
Pt2iii—Pt1—Cex126.808 (18)Pt3—Al4—Al2x56.76 (10)
Al5vii—Pt1—Cexi138.18 (3)Pt1x—Al4—Al2x56.16 (8)
Al1—Pt1—Cexi71.88 (7)Pt1xi—Al4—Al2x122.02 (16)
Al2—Pt1—Cexi66.99 (7)Pt2i—Al4—Al2x158.19 (18)
Al1viii—Pt1—Cexi134.93 (9)Pt2ii—Al4—Al2x81.87 (7)
Al1ix—Pt1—Cexi73.32 (8)Al5—Al4—Al2x135.21 (8)
Al4i—Pt1—Cexi71.69 (8)Pt3—Al4—Al2xi56.76 (10)
Al4ii—Pt1—Cexi132.68 (9)Pt1x—Al4—Al2xi122.02 (16)
Pt2iii—Pt1—Cexi126.808 (18)Pt1xi—Al4—Al2xi56.16 (8)
Cex—Pt1—Cexi79.40 (2)Pt2i—Al4—Al2xi81.87 (7)
Al5xii—Pt2—Al5x66.12 (10)Pt2ii—Al4—Al2xi158.19 (18)
Al5xii—Pt2—Al5xi66.12 (10)Al5—Al4—Al2xi135.21 (8)
Al5x—Pt2—Al5xi111.34 (15)Al2x—Al4—Al2xi88.83 (16)
Al5xii—Pt2—Al3146.25 (13)Pt3—Al4—Cexiii86.69 (11)
Al5x—Pt2—Al3123.69 (8)Pt1x—Al4—Cexiii61.84 (8)
Al5xi—Pt2—Al3123.69 (8)Pt1xi—Al4—Cexiii61.84 (8)
Al5xii—Pt2—Al186.94 (13)Pt2i—Al4—Cexiii128.41 (7)
Al5x—Pt2—Al165.56 (9)Pt2ii—Al4—Cexiii128.41 (7)
Al5xi—Pt2—Al165.56 (9)Al5—Al4—Cexiii139.69 (16)
Al3—Pt2—Al1126.81 (13)Al2x—Al4—Cexiii60.74 (10)
Al5xii—Pt2—Al4x83.48 (10)Al2xi—Al4—Cexiii60.74 (10)
Al5x—Pt2—Al4x64.67 (11)Pt1iv—Al5—Pt2xiv74.76 (11)
Al5xi—Pt2—Al4x146.56 (12)Pt1iv—Al5—Pt2ii119.03 (9)
Al3—Pt2—Al4x75.03 (10)Pt2xiv—Al5—Pt2ii113.88 (10)
Al1—Pt2—Al4x128.89 (7)Pt1iv—Al5—Pt2i119.03 (9)
Al5xii—Pt2—Al4xi83.48 (10)Pt2xiv—Al5—Pt2i113.88 (10)
Al5x—Pt2—Al4xi146.56 (12)Pt2ii—Al5—Pt2i111.34 (15)
Al5xi—Pt2—Al4xi64.67 (11)Pt1iv—Al5—Al5xv101.81 (18)
Al3—Pt2—Al4xi75.03 (10)Pt2xiv—Al5—Al5xv57.04 (14)
Al1—Pt2—Al4xi128.89 (7)Pt2ii—Al5—Al5xv56.83 (8)
Al4x—Pt2—Al4xi99.70 (13)Pt2i—Al5—Al5xv134.8 (2)
Al5xii—Pt2—Pt1xiii51.98 (9)Pt1iv—Al5—Al5xvi101.81 (18)
Al5x—Pt2—Pt1xiii93.44 (9)Pt2xiv—Al5—Al5xvi57.04 (14)
Al5xi—Pt2—Pt1xiii93.44 (9)Pt2ii—Al5—Al5xvi134.8 (2)
Al3—Pt2—Pt1xiii94.27 (9)Pt2i—Al5—Al5xvi56.83 (8)
Al1—Pt2—Pt1xiii138.92 (9)Al5xv—Al5—Al5xvi98.5 (3)
Al4x—Pt2—Pt1xiii55.25 (7)Pt1iv—Al5—Al1i60.45 (11)
Al4xi—Pt2—Pt1xiii55.25 (7)Pt2xiv—Al5—Al1i108.18 (14)
Al5xii—Pt2—Cexi132.45 (5)Pt2ii—Al5—Al1i135.95 (18)
Al5x—Pt2—Cexi130.66 (9)Pt2i—Al5—Al1i59.80 (9)
Al5xi—Pt2—Cexi66.49 (9)Al5xv—Al5—Al1i160.9 (3)
Al3—Pt2—Cexi69.31 (7)Al5xvi—Al5—Al1i79.86 (10)
Al1—Pt2—Cexi70.28 (7)Pt1iv—Al5—Al1ii60.45 (11)
Al4x—Pt2—Cexi143.15 (9)Pt2xiv—Al5—Al1ii108.18 (14)
Al4xi—Pt2—Cexi80.09 (8)Pt2ii—Al5—Al1ii59.80 (9)
Pt1xiii—Pt2—Cexi135.266 (15)Pt2i—Al5—Al1ii135.95 (18)
Al5xii—Pt2—Cex132.45 (5)Al5xv—Al5—Al1ii79.86 (10)
Al5x—Pt2—Cex66.49 (9)Al5xvi—Al5—Al1ii160.9 (3)
Al5xi—Pt2—Cex130.66 (9)Al1i—Al5—Al1ii95.42 (17)
Al3—Pt2—Cex69.31 (7)Pt1iv—Al5—Al4179.42 (19)
Al1—Pt2—Cex70.28 (7)Pt2xiv—Al5—Al4104.66 (16)
Al4x—Pt2—Cex80.09 (8)Pt2ii—Al5—Al461.16 (9)
Al4xi—Pt2—Cex143.15 (9)Pt2i—Al5—Al461.16 (9)
Pt1xiii—Pt2—Cex135.266 (15)Al5xv—Al5—Al477.82 (17)
Cexi—Pt2—Cex79.00 (2)Al5xvi—Al5—Al477.82 (17)
Al4—Pt3—Al3112.12 (14)Al1i—Al5—Al4119.86 (14)
Al4—Pt3—Al3i79.12 (11)Al1ii—Al5—Al4119.86 (14)
Al3—Pt3—Al3i126.17 (7)Pt1iv—Al5—Ce101.10 (13)
Al4—Pt3—Al3ii79.12 (11)Pt2xiv—Al5—Ce175.85 (16)
Al3—Pt3—Al3ii126.17 (7)Pt2ii—Al5—Ce67.95 (9)
Al3i—Pt3—Al3ii107.50 (15)Pt2i—Al5—Ce67.95 (9)
Al4—Pt3—Al2124.36 (13)Al5xv—Al5—Ce124.65 (15)
Al3—Pt3—Al2123.52 (13)Al5xvi—Al5—Ce124.65 (15)
Al3i—Pt3—Al269.14 (10)Al1i—Al5—Ce69.25 (12)
Al3ii—Pt3—Al269.14 (10)Al1ii—Al5—Ce69.25 (12)
Al4—Pt3—Al2x70.87 (10)Al4—Al5—Ce79.49 (13)
Symmetry codes: (i) x+1/2, y+1, z+1/2; (ii) x+1/2, y, z+1/2; (iii) x, y, z+1; (iv) x+1/2, y, z+3/2; (v) x, y1, z; (vi) x, y+1, z; (vii) x1/2, y, z+3/2; (viii) x, y, z+1; (ix) x, y+1, z+1; (x) x+1/2, y, z1/2; (xi) x+1/2, y+1, z1/2; (xii) x1/2, y, z+1/2; (xiii) x, y, z1; (xiv) x+1/2, y, z+1/2; (xv) x+1, y, z+1; (xvi) x+1, y+1, z+1.
 

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