Picotpaulite
Balic-Zunic T, Karanovic L, Poleti D
Acta Chimica Slovenica 55 (2008) 801-809
Crystal structure of picotpaulite, TlFe2S3, from Allchar, FYR Macedonia
Locality: Allchar, FYR Macedonia
_database_code_amcsd 0011971
CELL PARAMETERS: 9.0830 10.7540 5.4120 90.000 90.000 90.000
SPACE GROUP: Cmcm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 528.636
Density (g/cm3): 5.179
MAX. ABS. INTENSITY / VOLUME**2: 95.54098103
RIR: 6.006
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
12.76 1.07 6.9391 1 1 0 4
16.49 3.63 5.3770 0 2 0 2
19.55 18.65 4.5415 2 0 0 2
20.82 65.37 4.2675 1 1 1 8
23.32 28.29 3.8144 0 2 1 4
25.68 17.13 3.4695 2 2 0 4
26.74 62.51 3.3344 1 3 0 4
30.61 100.00 2.9209 2 2 1 8
30.68 18.30 2.9144 3 1 0 4
33.10 8.06 2.7060 0 0 2 2
33.33 2.53 2.6885 0 4 0 2
34.97 24.77 2.5660 3 1 1 8
35.61 22.08 2.5211 1 1 2 8
37.20 14.70 2.4172 0 2 2 4
37.35 9.58 2.4078 0 4 1 4
38.74 13.32 2.3246 2 0 2 4
38.93 5.38 2.3135 2 4 0 4
39.69 4.42 2.2708 4 0 0 2
42.36 1.36 2.1338 2 2 2 8
42.49 8.94 2.1273 2 4 1 8
43.05 4.93 2.1011 1 3 2 8
43.25 7.33 2.0919 4 2 0 4
45.76 1.51 1.9830 3 1 2 8
46.52 8.23 1.9520 1 5 1 8
46.54 8.98 1.9512 4 2 1 8
47.68 18.15 1.9072 0 4 2 4
50.95 5.12 1.7923 0 6 0 2
50.98 1.87 1.7912 5 1 0 4
52.01 15.87 1.7582 3 3 2 8
52.17 6.35 1.7534 3 5 0 4
52.40 3.77 1.7460 1 1 3 8
52.62 15.24 1.7394 4 0 2 4
52.77 9.72 1.7348 4 4 0 4
53.58 2.06 1.7103 0 2 3 4
53.92 2.11 1.7005 5 1 1 8
55.05 5.70 1.6680 3 5 1 8
55.08 2.40 1.6672 2 6 0 4
55.51 4.22 1.6555 1 5 2 8
55.64 4.20 1.6520 4 4 1 8
56.82 2.94 1.6204 5 3 0 4
57.59 10.60 1.6006 2 2 3 8
57.87 2.57 1.5933 2 6 1 8
60.34 3.23 1.5339 3 1 3 8
61.23 2.57 1.5138 6 0 0 2
61.95 1.39 1.4980 0 4 3 4
62.15 1.28 1.4936 5 1 2 8
63.81 3.01 1.4587 1 7 1 8
65.63 1.55 1.4226 2 4 3 8
65.79 4.70 1.4194 2 6 2 8
66.44 4.42 1.4071 6 2 1 8
67.36 3.23 1.3902 5 3 2 8
68.49 1.69 1.3700 3 7 0 4
68.69 1.58 1.3664 1 5 3 8
68.71 1.81 1.3662 4 2 3 8
69.47 2.98 1.3530 0 0 4 2
69.98 1.06 1.3443 5 5 1 8
70.97 1.07 1.3281 3 7 1 8
71.36 2.26 1.3218 1 7 2 8
72.44 1.14 1.3046 0 8 1 4
73.87 1.73 1.2830 6 2 2 8
75.63 1.39 1.2574 3 5 3 8
75.88 1.06 1.2539 2 8 1 8
75.89 2.83 1.2537 1 3 4 8
75.93 1.44 1.2532 7 1 1 8
76.13 1.06 1.2504 4 4 3 8
76.28 3.36 1.2483 4 6 2 8
77.83 1.16 1.2272 3 1 4 8
78.37 1.25 1.2201 7 3 0 4
81.11 1.83 1.1857 6 4 2 8
81.19 1.32 1.1847 1 9 0 4
83.61 1.25 1.1565 6 6 0 4
84.51 1.37 1.1464 5 7 1 8
85.70 1.52 1.1336 6 2 3 8
85.92 1.01 1.1312 4 8 1 8
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.