Pararammelsbergite
Stassen W N, Heyding R D
Canadian Journal of Chemistry 46 (1968) 2159-2163
Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2
Locality: synthetic
_database_code_amcsd 0012153
CELL PARAMETERS: 5.7700 5.8380 11.4190 90.000 90.000 90.000
SPACE GROUP: Pbca
X-RAY WAVELENGTH: 1.541838
Cell Volume: 384.652
Density (g/cm3): 7.201
MAX. ABS. INTENSITY / VOLUME**2: 47.22645738
RIR: 2.135
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
15.52 2.49 5.7095 0 0 2 2
23.03 8.57 3.8620 1 1 1 8
26.75 1.81 3.3323 1 1 2 8
30.63 8.21 2.9190 0 2 0 2
31.00 17.07 2.8850 2 0 0 2
31.33 40.25 2.8547 0 0 4 2
31.64 39.46 2.8281 0 2 1 4
32.07 19.64 2.7907 1 1 3 8
34.51 44.03 2.5990 0 2 2 4
34.68 30.48 2.5864 2 1 0 4
34.84 1.91 2.5749 2 0 2 4
35.07 100.00 2.5587 1 0 4 4
35.35 41.88 2.5394 1 2 1 8
35.59 78.72 2.5225 2 1 1 8
37.97 46.34 2.3697 1 2 2 8
38.20 46.35 2.3560 2 1 2 8
38.41 23.23 2.3435 1 1 4 8
38.88 6.32 2.3163 0 2 3 4
42.03 6.90 2.1496 1 2 3 8
44.14 3.37 2.0519 2 2 0 4
44.39 6.02 2.0409 0 2 4 4
44.66 13.47 2.0292 2 0 4 4
44.88 12.68 2.0196 2 2 1 8
45.45 32.74 1.9956 1 1 5 8
47.43 3.12 1.9167 2 1 4 8
50.04 2.93 1.8227 3 0 2 4
50.11 47.48 1.8204 1 3 1 8
50.53 5.80 1.8062 2 2 3 8
50.60 1.68 1.8038 3 1 1 8
50.76 32.49 1.7987 0 2 5 4
52.12 3.73 1.7547 1 3 2 8
52.60 57.13 1.7399 3 1 2 8
53.04 34.04 1.7265 1 1 6 8
55.12 4.74 1.6662 2 2 4 8
55.36 17.89 1.6595 1 3 3 8
55.82 21.43 1.6469 3 1 3 8
57.09 19.86 1.6133 2 3 0 4
57.71 1.58 1.5974 2 3 1 8
57.80 18.69 1.5951 3 0 4 4
57.84 13.00 1.5942 0 2 6 4
57.99 9.16 1.5904 3 2 1 8
58.06 1.75 1.5886 2 0 6 4
59.55 1.07 1.5525 2 3 2 8
59.70 16.75 1.5489 1 3 4 8
59.82 6.17 1.5460 3 2 2 8
60.14 2.57 1.5387 3 1 4 8
60.22 7.55 1.5367 1 2 6 8
60.39 17.86 1.5329 2 1 6 8
60.67 4.22 1.5263 2 2 5 8
62.53 12.07 1.4854 2 3 3 8
62.80 4.37 1.4797 3 2 3 8
64.35 3.72 1.4477 0 4 1 4
64.61 5.68 1.4425 4 0 0 2
65.01 1.68 1.4347 1 3 5 8
65.38 4.98 1.4274 0 0 8 2
65.42 4.16 1.4265 3 1 5 8
66.60 2.63 1.4042 1 4 1 8
67.61 1.39 1.3856 1 0 8 4
67.78 2.70 1.3825 1 2 7 8
67.94 11.96 1.3798 2 1 7 8
69.16 1.23 1.3582 3 3 1 8
69.76 2.46 1.3482 1 1 8 8
71.08 6.11 1.3263 1 4 3 8
71.61 13.91 1.3177 2 3 5 8
73.14 3.15 1.2939 2 4 1 8
73.19 1.01 1.2932 4 2 0 4
73.58 1.70 1.2873 3 3 3 8
74.11 2.59 1.2794 2 0 8 4
75.36 9.38 1.2613 4 2 2 8
76.18 1.44 1.2497 2 1 8 8
77.35 6.90 1.2336 3 3 4 8
77.46 2.24 1.2322 2 4 3 8
77.64 3.62 1.2298 0 4 5 4
77.82 3.77 1.2274 3 2 6 8
78.04 9.03 1.2245 4 2 3 8
78.63 1.78 1.2168 3 1 7 8
79.72 7.70 1.2028 1 4 5 8
82.28 1.69 1.1718 2 2 8 8
82.99 1.04 1.1636 0 2 9 4
85.04 2.28 1.1406 1 2 9 8
85.18 6.49 1.1391 2 1 9 8
85.22 5.93 1.1387 1 5 1 8
85.91 1.59 1.1313 2 4 5 8
85.93 1.15 1.1311 5 0 2 4
86.79 5.05 1.1221 1 5 2 8
87.79 2.06 1.1119 3 4 3 8
87.93 6.20 1.1105 5 1 2 8
88.98 9.62 1.1001 1 1 10 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.