Linarite Schofield P F, Wilson C C, Knight K S, Kirk C A The Canadian Mineralogist 47 (2009) 649-662 Proton location and hydrogen bonding in the hydrous lead copper sulfates linarite, PbCu(SO4)(OH)2, and caledonite, Pb5Cu2(SO4)3CO3(OH)6 Locality: Leadhills, Lanarkshire, Scotland _database_code_amcsd 0006293 CELL PARAMETERS: 9.6820 5.6460 4.6830 90.000 102.660 90.000 SPACE GROUP: P2_1/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 249.770 Density (g/cm3): 5.329 MAX. ABS. INTENSITY / VOLUME**2: 56.75977071 RIR: 3.468 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.36 25.64 9.4466 1 0 0 2 18.31 64.95 4.8464 1 1 0 4 18.79 2.45 4.7233 2 0 0 2 19.43 100.00 4.5691 0 0 1 2 19.64 1.52 4.5198 -1 0 1 2 23.41 1.41 3.7998 1 0 1 2 23.95 1.28 3.7161 -2 0 1 2 24.57 36.88 3.6228 2 1 0 4 25.24 93.35 3.5285 -1 1 1 4 28.31 72.19 3.1524 1 1 1 4 28.34 84.26 3.1489 3 0 0 2 28.76 69.98 3.1041 -2 1 1 4 30.04 1.35 2.9744 2 0 1 2 30.75 25.26 2.9076 -3 0 1 2 31.70 26.45 2.8230 0 2 0 2 32.56 1.82 2.7501 3 1 0 4 33.12 38.95 2.7048 1 2 0 4 34.07 43.40 2.6315 2 1 1 4 37.10 9.55 2.4232 2 2 0 4 37.45 8.56 2.4016 0 2 1 4 37.56 23.77 2.3944 -1 2 1 4 38.10 32.74 2.3622 3 0 1 2 38.46 3.60 2.3409 -1 0 2 2 38.90 3.30 2.3151 -4 0 1 2 39.44 18.56 2.2846 0 0 2 2 39.78 9.34 2.2661 1 2 1 4 40.11 22.93 2.2479 -2 2 1 4 41.44 3.87 2.1791 3 1 1 4 41.44 7.75 2.1787 4 1 0 4 41.77 25.56 2.1624 -1 1 2 4 42.19 17.26 2.1420 -4 1 1 4 42.70 1.95 2.1178 0 1 2 4 43.03 14.76 2.1020 3 2 0 4 43.12 11.74 2.0981 -2 1 2 4 43.55 17.81 2.0783 -3 0 2 2 44.23 7.02 2.0476 2 2 1 4 44.74 5.99 2.0254 -3 2 1 4 45.77 4.98 1.9823 1 1 2 4 49.03 1.22 1.8581 -4 0 2 2 49.38 7.46 1.8457 1 3 0 4 49.88 8.53 1.8282 4 1 1 4 50.37 3.35 1.8116 3 2 1 4 50.38 18.27 1.8114 4 2 0 4 50.66 11.61 1.8020 -1 2 2 4 50.70 11.30 1.8007 2 1 2 4 50.72 15.88 1.8000 -5 1 1 4 50.97 9.84 1.7917 5 1 0 4 51.02 13.42 1.7901 -4 2 1 4 51.46 5.76 1.7759 0 2 2 4 51.80 6.64 1.7650 -4 1 2 4 51.82 11.20 1.7642 -2 2 2 4 52.33 4.93 1.7483 2 3 0 4 52.68 9.73 1.7374 -1 3 1 4 54.15 12.17 1.6937 1 2 2 4 54.40 8.82 1.6865 1 3 1 4 54.55 7.59 1.6822 3 0 2 2 54.67 7.95 1.6790 -2 3 1 4 54.85 2.30 1.6737 -3 2 2 4 57.13 1.12 1.6122 3 1 2 4 57.59 4.53 1.6005 -6 0 1 2 57.82 6.49 1.5946 4 2 1 4 57.99 9.79 1.5904 2 3 1 4 58.49 4.48 1.5781 -5 1 2 4 58.56 5.16 1.5762 2 2 2 4 58.58 3.86 1.5757 -5 2 1 4 58.63 7.02 1.5744 6 0 0 2 58.81 4.38 1.5701 5 2 0 4 59.17 6.21 1.5614 5 1 1 4 59.56 5.91 1.5521 -4 2 2 4 60.82 5.38 1.5230 0 0 3 2 61.55 6.05 1.5066 -3 0 3 2 61.76 4.66 1.5021 -1 1 3 4 62.00 5.05 1.4968 -2 1 3 4 63.17 2.01 1.4718 4 3 0 4 63.42 5.04 1.4667 -1 3 2 4 63.73 3.39 1.4604 -4 3 1 4 64.05 6.95 1.4538 -6 0 2 2 64.43 3.55 1.4462 -2 3 2 4 64.48 3.12 1.4451 3 2 2 4 64.83 2.24 1.4381 4 1 2 4 65.74 2.22 1.4204 -5 2 2 4 66.21 8.05 1.4115 0 4 0 2 66.37 3.11 1.4084 1 1 3 4 66.47 1.06 1.4066 1 3 2 4 66.98 3.30 1.3972 6 0 1 2 67.54 3.71 1.3869 -4 1 3 4 68.20 3.75 1.3750 6 2 0 4 69.05 3.85 1.3602 -2 2 3 4 69.73 5.28 1.3486 0 4 1 4 69.75 3.43 1.3482 4 3 1 4 70.27 2.42 1.3396 -7 1 1 4 70.42 3.05 1.3371 2 3 2 4 70.44 5.35 1.3368 -5 3 1 4 70.65 2.45 1.3334 5 3 0 4 70.90 1.39 1.3292 -3 2 3 4 71.06 4.99 1.3266 2 1 3 4 71.33 2.57 1.3222 -4 3 2 4 71.73 3.42 1.3158 4 2 2 4 72.64 4.29 1.3016 -5 1 3 4 73.21 5.78 1.2929 1 2 3 4 73.23 1.90 1.2925 -6 2 2 4 73.53 7.84 1.2880 3 4 0 4 73.66 2.97 1.2860 5 1 2 4 74.33 1.30 1.2762 -4 2 3 4 74.76 3.66 1.2698 -3 4 1 4 74.99 1.79 1.2666 3 0 3 2 75.45 1.78 1.2600 -7 1 2 4 76.95 2.24 1.2390 -7 2 1 4 76.98 2.09 1.2387 -6 0 3 2 77.03 2.03 1.2379 -5 3 2 4 77.64 2.76 1.2298 5 3 1 4 78.57 4.43 1.2175 7 2 0 4 79.03 4.69 1.2117 3 4 1 4 79.25 1.36 1.2088 -5 2 3 4 79.88 4.19 1.2008 0 4 2 4 79.93 2.37 1.2002 -1 3 3 4 80.15 2.33 1.1975 -2 3 3 4 80.29 1.35 1.1957 7 1 1 4 81.38 3.21 1.1825 -8 1 1 4 81.49 2.10 1.1811 6 0 2 2 81.98 3.37 1.1753 -7 2 2 4 82.63 4.10 1.1677 -3 4 2 4 83.45 2.22 1.1583 -3 0 4 2 83.65 1.20 1.1561 6 1 2 4 83.67 1.75 1.1558 8 1 0 4 84.12 1.74 1.1508 1 3 3 4 84.55 1.22 1.1461 -2 1 4 4 84.89 1.98 1.1423 0 0 4 2 85.03 1.88 1.1408 -1 1 4 4 85.20 1.88 1.1390 -4 3 3 4 85.63 1.05 1.1343 -6 2 3 4 85.66 1.18 1.1340 -8 1 2 4 86.75 2.90 1.1226 7 2 1 4 87.07 1.36 1.1192 -7 1 3 4 87.75 1.27 1.1123 -7 3 1 4 88.18 1.44 1.1080 -4 1 4 4 88.49 2.27 1.1049 2 3 3 4 89.45 1.92 1.0955 -1 5 1 4 90.00 1.89 1.0903 -5 3 3 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.