Hammarite
Horiuchi H, Wuensch B J
The Canadian Mineralogist 14 (1976) 536-539
The ordering scheme for metal atoms in the crystal structure
of hammarite, Cu2Pb2Bi4S9
_database_code_amcsd 0005129
CELL PARAMETERS: 33.7726 11.5857 4.0100 90.000 90.000 90.000
SPACE GROUP: Pbnm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 1569.030
Density (g/cm3): 7.052
MAX. ABS. INTENSITY / VOLUME**2: 74.24754677
RIR: 3.428
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
5.23 3.73 16.8863 2 0 0 2
10.96 3.26 8.0738 3 1 0 4
15.30 4.69 5.7929 0 2 0 2
16.18 2.95 5.4794 2 2 0 4
17.22 17.29 5.1509 3 2 0 4
17.52 1.04 5.0629 6 1 0 4
21.04 4.29 4.2216 8 0 0 2
22.02 59.21 4.0369 6 2 0 4
22.41 2.44 3.9665 8 1 0 4
23.55 23.76 3.7775 3 0 1 4
23.63 1.19 3.7647 2 3 0 4
24.37 100.00 3.6529 3 3 0 4
24.79 52.06 3.5914 3 1 1 8
24.94 88.53 3.5699 9 1 0 4
26.39 4.02 3.3773 10 0 0 2
26.98 2.16 3.3049 5 1 1 8
27.04 17.96 3.2971 0 2 1 4
27.17 3.86 3.2815 1 2 1 8
28.02 8.34 3.1844 6 3 0 4
28.20 75.42 3.1642 3 2 1 8
28.34 3.72 3.1495 9 2 0 4
28.39 84.92 3.1435 6 1 1 8
29.07 1.55 3.0712 4 2 1 8
29.63 1.11 3.0150 7 3 0 4
29.98 3.13 2.9801 7 1 1 8
30.87 7.94 2.8964 0 4 0 2
31.33 1.04 2.8547 2 4 0 4
31.44 99.94 2.8450 6 2 1 8
31.80 7.60 2.8144 12 0 0 2
31.90 1.77 2.8051 3 4 0 4
32.68 16.39 2.7399 9 0 1 4
32.75 4.73 2.7348 12 1 0 4
33.61 52.83 2.6664 9 1 1 8
34.52 1.30 2.5985 8 2 1 8
34.84 53.93 2.5755 6 4 0 4
35.30 1.09 2.5423 10 3 0 4
35.46 18.08 2.5314 12 2 0 4
36.01 24.32 2.4938 6 3 1 8
36.17 1.18 2.4833 7 4 0 4
36.27 3.59 2.4769 9 2 1 8
38.15 1.49 2.3592 10 2 1 8
38.34 34.96 2.3480 0 4 1 4
38.43 2.73 2.3423 1 4 1 8
39.19 22.62 2.2985 3 4 1 8
39.29 3.53 2.2929 9 4 0 4
39.62 1.51 2.2745 12 3 0 4
39.71 1.49 2.2696 3 5 0 4
39.90 28.93 2.2594 12 1 1 8
40.13 3.04 2.2469 11 2 1 8
40.36 13.29 2.2346 9 3 1 8
40.83 3.45 2.2102 15 1 0 4
41.68 11.86 2.1670 6 4 1 8
41.91 2.60 2.1556 13 3 0 4
42.17 1.34 2.1427 13 1 1 8
42.17 8.85 2.1427 6 5 0 4
42.22 20.36 2.1406 12 2 1 8
43.11 2.83 2.0986 15 2 0 4
43.92 1.17 2.0614 11 3 1 8
44.39 1.91 2.0406 13 2 1 8
44.91 2.79 2.0185 12 4 0 4
45.23 43.24 2.0050 0 0 2 2
45.87 31.81 1.9784 12 3 1 8
45.95 8.76 1.9752 3 5 1 8
46.04 13.53 1.9716 9 5 0 4
46.24 11.54 1.9632 15 0 1 4
46.70 29.76 1.9451 15 3 0 4
46.94 3.69 1.9356 15 1 1 8
47.06 9.47 1.9310 0 6 0 2
47.14 1.13 1.9279 10 4 1 8
47.79 1.98 1.9032 3 6 0 4
48.15 9.69 1.8898 6 5 1 8
48.52 12.01 1.8763 18 0 0 2
48.74 1.91 1.8684 3 2 2 8
49.93 3.95 1.8265 6 6 0 4
50.05 1.20 1.8225 14 3 1 8
50.63 3.40 1.8029 12 4 1 8
50.85 10.79 1.7957 6 2 2 8
51.06 2.00 1.7889 12 5 0 4
51.18 1.20 1.7850 18 2 0 4
51.32 1.58 1.7801 17 0 1 4
51.40 1.63 1.7777 16 2 1 8
51.40 1.55 1.7776 15 4 0 4
51.66 10.80 1.7693 9 5 1 8
51.97 1.33 1.7595 17 1 1 8
52.03 21.61 1.7576 3 3 2 8
52.05 1.80 1.7569 19 1 0 4
52.27 6.51 1.7501 15 3 1 8
52.33 20.45 1.7482 9 1 2 8
52.61 10.80 1.7398 0 6 1 4
53.28 6.61 1.7193 3 6 1 8
53.36 1.58 1.7170 9 6 0 4
54.05 1.94 1.6967 6 3 2 8
54.58 3.37 1.6814 18 1 1 8
54.65 1.11 1.6795 11 5 1 8
54.95 1.25 1.6710 20 1 0 4
55.27 3.93 1.6622 6 6 1 8
55.76 2.58 1.6486 0 4 2 4
56.31 4.26 1.6337 12 5 1 8
56.34 2.43 1.6330 12 0 2 4
56.95 1.76 1.6170 12 1 2 8
57.25 1.22 1.6093 19 1 1 8
57.89 1.36 1.5929 21 1 0 4
57.92 1.76 1.5922 12 6 0 4
58.09 1.29 1.5879 6 7 0 4
58.32 19.63 1.5821 6 4 2 8
58.47 2.90 1.5784 9 6 1 8
58.62 2.21 1.5747 18 4 0 4
58.75 6.72 1.5717 12 2 2 8
59.67 2.88 1.5496 21 2 0 4
61.13 11.09 1.5160 3 7 1 8
61.20 5.55 1.5143 9 7 0 4
61.43 1.53 1.5093 9 4 2 8
62.55 1.67 1.4850 15 1 2 8
62.76 5.10 1.4804 21 1 1 8
62.96 1.83 1.4763 6 7 1 8
63.35 1.16 1.4681 13 3 2 8
63.46 7.44 1.4658 18 4 1 8
63.47 1.11 1.4657 15 6 0 4
63.55 4.32 1.4640 6 5 2 8
63.83 1.29 1.4582 18 5 0 4
64.03 1.45 1.4542 16 5 1 8
64.25 1.33 1.4497 15 2 2 8
64.46 9.59 1.4454 21 2 1 8
64.56 1.16 1.4435 20 3 1 8
64.92 2.21 1.4364 3 8 0 4
65.42 2.91 1.4267 12 7 0 4
65.63 1.43 1.4225 12 4 2 8
66.51 7.36 1.4058 9 5 2 8
66.69 2.13 1.4025 6 8 0 4
67.04 16.34 1.3961 15 3 2 8
67.24 1.26 1.3923 21 3 1 8
67.32 5.21 1.3908 0 6 2 4
67.90 1.15 1.3803 3 6 2 8
68.11 3.57 1.3767 15 6 1 8
68.47 1.72 1.3704 18 5 1 8
68.49 6.95 1.3700 18 0 2 4
68.63 1.69 1.3674 24 2 0 4
69.63 2.28 1.3502 6 6 2 8
69.91 3.22 1.3456 18 6 0 4
69.99 1.08 1.3441 12 7 1 8
70.00 1.01 1.3440 22 3 1 8
70.56 1.30 1.3348 12 5 2 8
70.82 1.51 1.3304 19 5 1 8
71.05 7.13 1.3268 21 4 1 8
71.23 5.30 1.3239 6 8 1 8
71.38 1.15 1.3214 19 1 2 8
71.52 1.62 1.3192 24 1 1 8
71.55 1.81 1.3187 3 1 3 8
72.17 1.05 1.3088 17 6 1 8
72.48 1.04 1.3041 9 6 2 8
73.15 3.69 1.2938 3 2 3 8
73.24 3.89 1.2924 6 1 3 8
74.14 2.18 1.2790 3 9 0 4
74.36 1.01 1.2757 18 6 1 8
74.82 5.27 1.2689 6 2 3 8
75.05 1.84 1.2657 24 4 0 4
75.07 9.95 1.2654 15 7 1 8
75.81 1.37 1.2549 6 9 0 4
76.03 3.18 1.2518 9 1 3 8
76.38 1.21 1.2469 12 6 2 8
76.62 1.61 1.2436 27 1 0 4
77.00 1.69 1.2384 18 4 2 8
77.44 1.81 1.2325 6 3 3 8
77.92 2.16 1.2261 21 2 2 8
77.92 2.88 1.2261 12 8 1 8
78.87 2.79 1.2137 0 4 3 4
79.28 4.31 1.2084 9 7 2 8
79.42 1.94 1.2067 3 4 3 8
79.87 2.68 1.2009 12 1 3 8
80.18 1.25 1.1971 9 3 3 8
80.42 2.11 1.1941 27 0 1 4
81.05 1.06 1.1864 6 4 3 8
81.42 1.92 1.1820 12 2 3 8
81.65 1.02 1.1793 18 5 2 8
82.38 1.71 1.1707 12 9 0 4
82.48 1.28 1.1695 27 2 1 8
82.63 1.85 1.1677 3 8 2 8
82.85 1.88 1.1651 9 9 1 8
83.09 2.49 1.1624 12 7 2 8
83.98 3.71 1.1524 12 3 3 8
84.25 1.37 1.1494 15 0 3 4
84.26 1.84 1.1493 6 8 2 8
85.65 1.28 1.1341 6 5 3 8
86.06 1.49 1.1297 24 2 2 8
86.63 1.18 1.1237 12 9 1 8
87.26 2.95 1.1173 18 6 2 8
87.68 4.05 1.1130 0 10 1 4
88.34 1.50 1.1064 9 5 3 8
88.82 1.05 1.1016 15 3 3 8
89.09 1.76 1.0990 0 6 3 4
89.60 2.23 1.0941 24 6 1 8
89.62 1.10 1.0938 3 6 3 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.