Cobaltarthurite
Raudsepp M, Pani E
The Canadian Mineralogist 40 (2002) 733-737
The crystal structure of cobaltarthurite, CoFe2(AsO4)2(OH)2.4H2O:
A Rietveld refinement
_database_code_amcsd 0005772
CELL PARAMETERS: 10.2694 9.6790 5.5723 90.000 94.277 90.000
SPACE GROUP: P2_1/c
X-RAY WAVELENGTH: 1.541838
Cell Volume: 552.330
Density (g/cm3): 3.208
MAX. ABS. INTENSITY / VOLUME**2: 25.50777585
RIR: 2.589
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
8.63 100.00 10.2408 1 0 0 2
12.58 74.29 7.0343 1 1 0 4
17.32 3.55 5.1204 2 0 0 2
18.33 30.08 4.8395 0 2 0 2
18.41 15.07 4.8191 0 1 1 4
19.61 17.56 4.5261 2 1 0 4
19.85 2.10 4.4733 -1 1 1 4
20.30 3.07 4.3755 1 2 0 4
20.87 54.05 4.2557 1 1 1 4
25.32 5.66 3.5172 2 2 0 4
25.51 14.72 3.4922 -1 2 1 4
26.10 5.06 3.4136 3 0 0 2
26.20 6.20 3.4012 2 1 1 4
29.02 10.94 3.0772 1 3 0 4
29.35 20.73 3.0432 -2 2 1 4
30.77 29.65 2.9054 2 2 1 4
31.11 50.22 2.8746 -3 1 1 4
32.08 5.08 2.7901 0 3 1 4
32.09 8.05 2.7895 3 2 0 4
32.22 5.76 2.7784 0 0 2 2
32.76 2.01 2.7335 -1 0 2 2
32.81 14.17 2.7297 2 3 0 4
32.96 4.84 2.7179 -1 3 1 4
33.56 4.27 2.6705 0 1 2 4
33.61 3.10 2.6668 1 3 1 4
34.06 9.22 2.6323 1 0 2 2
34.08 13.79 2.6306 -1 1 2 4
35.05 1.39 2.5602 4 0 0 2
35.60 9.66 2.5222 -2 0 2 2
36.08 1.49 2.4895 -2 3 1 4
36.30 1.83 2.4751 4 1 0 4
36.93 14.42 2.4342 3 2 1 4
38.22 3.11 2.3549 1 4 0 4
38.75 1.27 2.3241 -4 1 1 4
39.15 3.97 2.3012 2 1 2 4
40.30 1.38 2.2381 -3 0 2 2
40.67 14.02 2.2185 0 4 1 4
40.97 10.86 2.2027 4 1 1 4
41.92 3.07 2.1550 1 4 1 4
42.11 2.21 2.1459 -4 2 1 4
42.48 5.61 2.1278 2 2 2 4
42.61 3.73 2.1217 3 3 1 4
42.96 6.89 2.1053 0 3 2 4
43.39 5.27 2.0856 -1 3 2 4
44.00 3.23 2.0581 -2 4 1 4
44.20 6.28 2.0492 4 2 1 4
44.22 2.39 2.0482 5 0 0 2
44.61 6.29 2.0314 -3 2 2 4
45.25 2.01 2.0038 5 1 0 4
45.97 3.45 1.9741 3 4 0 4
47.28 2.60 1.9226 -4 3 1 4
47.82 2.57 1.9021 1 5 0 4
49.57 1.18 1.8390 -3 3 2 4
49.67 1.86 1.8354 3 4 1 4
49.98 1.89 1.8247 0 4 2 4
49.99 4.07 1.8247 -5 2 1 4
51.28 1.33 1.7814 1 4 2 4
52.10 6.78 1.7553 -2 1 3 4
52.95 1.42 1.7292 5 3 0 4
53.07 1.13 1.7256 -1 2 3 4
53.65 3.95 1.7084 2 5 1 4
53.91 3.06 1.7006 4 2 2 4
54.18 4.16 1.6928 2 4 2 4
54.40 1.42 1.6865 1 2 3 4
54.47 2.59 1.6846 -5 1 2 4
54.49 3.92 1.6839 3 5 0 4
54.60 1.45 1.6809 6 1 0 4
54.77 6.18 1.6760 2 1 3 4
55.47 2.19 1.6566 -3 1 3 4
55.96 1.94 1.6431 -3 4 2 4
55.98 2.60 1.6427 -6 1 1 4
56.52 1.13 1.6282 -3 5 1 4
57.50 3.68 1.6029 -1 3 3 4
57.79 1.19 1.5953 3 5 1 4
57.89 4.60 1.5929 5 0 2 2
58.07 2.21 1.5883 -3 2 3 4
58.29 2.14 1.5828 4 3 2 4
58.76 1.63 1.5715 1 3 3 4
59.09 1.07 1.5633 5 4 0 4
59.25 2.15 1.5595 1 5 2 4
59.28 1.30 1.5588 3 1 3 4
59.69 1.53 1.5492 0 6 1 4
59.90 4.92 1.5441 4 5 0 4
60.14 3.93 1.5386 2 6 0 4
60.27 2.24 1.5356 -2 5 2 4
60.61 1.49 1.5277 -5 4 1 4
60.64 2.16 1.5271 1 6 1 4
61.26 1.16 1.5130 5 2 2 4
61.34 1.88 1.5114 -5 3 2 4
61.46 2.94 1.5087 6 3 0 4
61.61 3.49 1.5053 -4 5 1 4
61.62 5.07 1.5052 -6 0 2 2
61.79 1.23 1.5015 3 2 3 4
61.90 3.79 1.4990 2 5 2 4
62.64 1.93 1.4831 5 4 1 4
62.69 3.94 1.4820 -4 2 3 4
62.74 2.45 1.4809 -6 3 1 4
63.22 1.02 1.4708 4 5 1 4
63.35 2.08 1.4682 -1 4 3 4
63.54 4.55 1.4641 -3 5 2 4
63.60 2.41 1.4630 7 0 0 2
64.10 1.52 1.4527 4 4 2 4
64.41 1.11 1.4465 7 1 0 4
64.54 1.25 1.4439 1 4 3 4
64.92 1.18 1.4364 -2 4 3 4
66.16 1.48 1.4125 -5 1 3 4
66.38 3.14 1.4082 6 0 2 2
67.34 4.33 1.3905 -1 0 4 2
67.41 2.37 1.3893 -1 6 2 4
67.41 3.00 1.3892 4 2 3 4
68.20 1.29 1.3751 0 1 4 4
69.66 1.74 1.3498 1 1 4 4
70.46 1.70 1.3364 -1 2 4 4
70.47 2.11 1.3362 -7 0 2 2
70.64 3.73 1.3335 -1 7 1 4
71.89 1.97 1.3132 5 1 3 4
73.25 1.85 1.2923 2 7 1 4
74.42 1.85 1.2748 3 6 2 4
74.94 2.56 1.2673 5 6 0 4
76.45 1.26 1.2460 7 1 2 4
76.54 1.81 1.2447 -4 6 2 4
77.00 1.38 1.2384 -7 4 1 4
78.55 1.37 1.2178 8 1 1 4
81.80 1.55 1.1775 2 8 0 4
84.34 1.13 1.1483 -6 4 3 4
85.87 1.72 1.1318 -5 7 1 4
88.18 2.73 1.1080 0 7 3 4
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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.