Sanguite
Willett R D, Dwiggins C, Kruth R F, Rundle R E
Journal of Chemical Physics 38 (1963) 2429-2436
Crystal strucutres of KCuCl3 and NH4CuCl3
Locality: synthetic
_database_code_amcsd 0019972
CELL PARAMETERS: 4.0290 13.7850 8.7360 90.000 97.330 90.000
SPACE GROUP: P2_1/c
X-RAY WAVELENGTH: 1.541838
Cell Volume: 481.230
Density (g/cm3): 2.884
MAX. ABS. INTENSITY / VOLUME**2: 9.823998621
RIR: 1.109
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
12.06 72.99 7.3358 0 1 1 4
12.84 100.00 6.8925 0 2 0 2
16.43 45.97 5.3940 0 2 1 4
20.50 6.03 4.3323 0 0 2 2
21.50 19.41 4.1330 0 1 2 4
21.89 28.02 4.0595 0 3 1 4
24.18 71.82 3.6802 -1 1 1 4
24.27 7.60 3.6679 0 2 2 4
25.85 3.42 3.4462 0 4 0 2
26.53 11.83 3.3600 1 1 1 4
26.69 8.00 3.3403 -1 2 1 4
27.86 5.34 3.2023 0 4 1 4
28.31 18.66 3.1522 0 3 2 4
28.39 57.98 3.1440 -1 0 2 2
28.84 2.01 3.0955 1 2 1 4
29.13 77.33 3.0653 -1 1 2 4
29.63 1.26 3.0153 1 3 0 4
30.44 7.12 2.9369 -1 3 1 4
31.27 87.72 2.8605 -1 2 2 4
31.65 1.25 2.8268 0 1 3 4
32.36 4.91 2.7667 1 0 2 2
32.36 18.04 2.7663 1 3 1 4
33.02 46.56 2.7126 1 1 2 4
33.22 40.80 2.6970 0 4 2 4
33.64 24.89 2.6638 0 2 3 4
34.13 34.64 2.6272 0 5 1 4
34.36 5.72 2.6098 1 4 0 4
34.57 3.86 2.5948 -1 3 2 4
34.95 50.84 2.5676 1 2 2 4
35.07 4.38 2.5585 -1 4 1 4
36.57 3.91 2.4570 -1 1 3 4
37.96 5.93 2.3702 1 3 2 4
38.34 3.87 2.3476 -1 2 3 4
38.71 10.28 2.3260 0 5 2 4
38.77 6.62 2.3227 -1 4 2 4
39.21 2.35 2.2975 0 6 0 2
39.72 42.03 2.2693 1 5 0 4
40.63 23.31 2.2208 0 6 1 4
40.76 14.12 2.2136 0 4 3 4
41.36 8.33 2.1828 1 1 3 4
41.87 6.66 2.1575 1 4 2 4
41.88 1.32 2.1573 1 5 1 4
42.96 7.94 2.1051 1 2 3 4
43.81 12.80 2.0665 0 2 4 4
44.64 1.18 2.0297 0 6 2 4
44.82 23.17 2.0220 -1 4 3 4
44.99 7.70 2.0151 -1 0 4 2
45.39 39.46 1.9980 2 0 0 2
45.54 1.17 1.9918 1 6 0 4
45.89 3.28 1.9774 2 1 0 4
46.11 5.60 1.9687 -1 6 1 4
46.34 14.36 1.9594 0 3 4 4
46.98 4.32 1.9341 -1 2 4 4
47.24 1.77 1.9241 -2 2 1 4
47.34 7.13 1.9203 0 7 1 4
47.37 3.42 1.9190 2 2 0 4
47.48 6.46 1.9147 1 6 1 4
48.50 7.51 1.8771 2 1 1 4
48.95 19.89 1.8608 1 4 3 4
49.11 1.32 1.8550 -1 6 2 4
49.23 5.15 1.8507 -1 5 3 4
49.38 7.95 1.8455 -1 3 4 4
49.71 2.02 1.8340 0 4 4 4
49.92 3.58 1.8270 2 2 1 4
50.42 6.84 1.8101 1 0 4 2
50.94 14.30 1.7928 0 7 2 4
51.72 2.24 1.7675 1 6 2 4
51.75 10.27 1.7664 1 7 0 4
52.22 7.51 1.7517 2 3 1 4
52.25 5.35 1.7507 1 2 4 4
52.27 11.01 1.7503 -1 7 1 4
52.61 3.97 1.7396 -1 4 4 4
52.69 4.20 1.7371 -2 1 3 4
53.15 3.36 1.7231 0 8 0 2
53.30 2.68 1.7188 2 1 2 4
53.52 8.74 1.7120 1 7 1 4
53.82 10.62 1.7033 0 5 4 4
54.03 6.42 1.6971 -2 2 3 4
54.26 2.35 1.6907 -1 6 3 4
54.49 9.48 1.6841 1 3 4 4
54.61 7.59 1.6806 0 2 5 4
54.98 1.39 1.6702 -2 4 2 4
55.02 4.26 1.6689 -1 7 2 4
55.33 3.31 1.6603 2 4 1 4
56.56 2.72 1.6271 0 7 3 4
56.57 1.95 1.6269 -1 5 4 4
56.80 6.07 1.6209 2 3 2 4
56.80 4.09 1.6209 -2 5 1 4
57.44 1.58 1.6044 1 7 2 4
57.51 1.56 1.6025 1 4 4 4
58.79 3.69 1.5706 -1 8 1 4
58.83 3.25 1.5697 -2 5 2 4
58.85 6.31 1.5692 -1 3 5 4
59.17 1.49 1.5615 2 5 1 4
59.73 5.13 1.5482 0 4 5 4
59.75 5.37 1.5477 2 4 2 4
59.96 6.15 1.5428 1 8 1 4
60.40 9.04 1.5327 -2 2 4 4
61.18 3.67 1.5150 -1 6 4 4
61.26 2.34 1.5131 1 5 4 4
61.40 8.79 1.5101 -2 6 1 4
62.44 5.04 1.4874 -2 3 4 4
62.55 1.47 1.4849 1 2 5 4
63.20 1.52 1.4713 2 3 3 4
63.24 1.33 1.4705 1 7 3 4
63.40 1.77 1.4672 0 5 5 4
63.42 1.32 1.4668 2 5 2 4
63.66 2.21 1.4618 2 6 1 4
64.53 1.14 1.4441 0 0 6 2
64.53 1.07 1.4441 0 9 2 4
64.55 5.86 1.4436 1 3 5 4
65.34 1.54 1.4281 -1 5 5 4
65.67 2.06 1.4218 1 6 4 4
65.68 2.15 1.4216 -1 9 1 4
65.98 4.78 1.4159 2 4 3 4
66.11 8.85 1.4134 0 2 6 4
66.58 3.12 1.4045 -2 7 1 4
66.78 5.92 1.4009 1 9 1 4
67.75 1.19 1.3832 2 6 2 4
68.34 2.94 1.3725 -2 2 5 4
68.44 5.67 1.3708 -2 7 2 4
68.74 3.76 1.3656 -2 5 4 4
69.40 3.23 1.3542 -1 3 6 4
69.46 9.05 1.3532 0 9 3 4
70.47 4.90 1.3362 -3 1 1 4
71.18 1.28 1.3246 2 3 4 4
71.38 3.49 1.3214 -3 0 2 2
71.61 1.03 1.3178 -3 2 1 4
71.76 2.01 1.3154 -3 1 2 4
72.19 1.43 1.3085 -2 7 3 4
72.43 2.64 1.3049 2 8 0 4
72.70 1.56 1.3007 2 7 2 4
72.89 2.55 1.2978 -3 2 2 4
72.90 2.37 1.2975 -2 4 5 4
75.42 1.62 1.2604 -1 5 6 4
76.70 1.55 1.2424 3 4 0 4
77.15 2.08 1.2364 2 5 4 4
77.34 1.06 1.2338 1 10 2 4
77.41 1.83 1.2328 0 1 7 4
77.74 3.88 1.2285 -2 2 6 4
79.10 1.32 1.2108 3 2 2 4
79.46 1.01 1.2062 -1 6 6 4
80.00 2.47 1.1994 3 5 0 4
80.42 1.69 1.1941 -3 4 3 4
81.71 1.14 1.1785 1 11 1 4
83.04 2.25 1.1630 0 10 4 4
83.18 1.24 1.1614 2 4 5 4
83.63 1.00 1.1563 -1 4 7 4
83.68 1.83 1.1557 -3 5 3 4
83.93 3.45 1.1528 -2 9 3 4
84.22 2.99 1.1496 0 11 3 4
85.31 1.36 1.1378 -1 10 4 4
86.16 1.97 1.1286 -1 9 5 4
86.42 1.34 1.1260 2 5 5 4
86.86 1.33 1.1214 -1 5 7 4
87.64 1.12 1.1134 -3 6 3 4
88.05 1.00 1.1093 -3 7 1 4
89.27 1.37 1.0973 -3 7 2 4
89.46 1.06 1.0954 -3 3 5 4
89.50 1.88 1.0950 3 4 3 4
89.88 2.12 1.0914 2 2 6 4
89.97 2.42 1.0905 2 9 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.