Aubertite Ginderow D, Cesbron F Acta Crystallographica B35 (1979) 2499-2502 Structure cristalline de l'aubertite, AlCuCl(SO4)2*14H2O Note: anisotropic displacement parameters obtained from ICSD _database_code_amcsd 0009692 CELL PARAMETERS: 6.2820 13.1920 6.2600 91.850 94.700 82.460 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 512.443 Density (g/cm3): 1.848 MAX. ABS. INTENSITY / VOLUME**2: 4.276704588 RIR: 0.754 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.54 33.02 6.5374 0 2 0 2 14.20 49.76 6.2375 0 0 1 2 14.27 4.08 6.2085 1 0 0 2 14.99 4.01 5.9118 1 1 0 2 15.61 2.23 5.6780 0 -1 1 2 15.88 54.93 5.5826 0 1 1 2 16.58 12.36 5.3473 -1 1 0 2 18.39 37.93 4.8235 1 2 0 2 19.36 9.43 4.5837 -1 0 1 2 19.45 4.27 4.5628 0 -2 1 2 19.80 100.00 4.4842 -1 -1 1 2 19.89 13.64 4.4645 0 2 1 2 20.38 39.03 4.3583 0 3 0 2 20.97 8.71 4.2373 1 0 1 2 20.97 41.52 4.2371 -1 2 0 2 21.24 8.42 4.1827 -1 1 1 2 21.57 25.35 4.1204 1 1 1 2 22.42 16.73 3.9663 -1 -2 1 2 22.53 39.30 3.9469 1 -1 1 2 23.38 15.29 3.8056 1 3 0 2 24.18 38.49 3.6810 1 2 1 2 24.66 22.57 3.6097 0 -3 1 2 24.94 27.54 3.5709 -1 2 1 2 25.18 12.12 3.5366 0 3 1 2 25.88 11.01 3.4424 1 -2 1 2 26.46 18.07 3.3685 -1 3 0 2 27.28 4.89 3.2687 0 4 0 2 28.28 2.78 3.1559 1 3 1 2 28.62 36.21 3.1187 0 0 2 2 28.69 1.55 3.1119 2 1 0 2 28.76 20.89 3.1043 2 0 0 2 29.19 36.64 3.0597 1 4 0 2 29.30 7.69 3.0487 0 -1 2 2 29.82 8.76 2.9963 -1 3 1 2 30.24 1.30 2.9559 2 2 0 2 30.44 6.37 2.9363 -2 1 0 2 30.60 1.20 2.9215 0 -4 1 2 31.06 5.31 2.8789 -1 0 2 2 31.16 1.93 2.8703 -2 0 1 2 31.17 7.36 2.8696 0 4 1 2 31.28 7.30 2.8600 -1 -1 2 2 31.51 1.72 2.8390 0 -2 2 2 32.56 5.88 2.7497 -1 4 0 2 32.80 20.01 2.7306 -2 1 1 2 33.14 2.29 2.7031 1 0 2 2 33.20 16.72 2.6984 2 3 0 2 33.37 16.45 2.6850 1 4 1 2 33.52 4.57 2.6736 -2 2 0 2 33.60 12.82 2.6670 1 1 2 2 34.12 8.27 2.6278 1 -1 2 2 34.29 5.10 2.6150 0 5 0 2 34.65 7.39 2.5885 2 -1 1 2 34.66 3.37 2.5878 2 2 1 2 35.01 11.34 2.5628 0 -3 2 2 35.46 3.90 2.5316 1 2 2 2 35.49 3.92 2.5296 1 5 0 2 35.75 5.44 2.5113 -2 2 1 2 35.91 3.49 2.5010 1 -4 1 2 35.99 6.42 2.4957 -1 -3 2 2 36.44 1.91 2.4657 1 -2 2 2 37.28 2.16 2.4117 2 4 0 2 37.59 1.76 2.3931 0 5 1 2 37.66 10.03 2.3887 -1 -5 1 2 38.99 3.79 2.3101 -2 -4 1 2 39.13 12.07 2.3020 1 5 1 2 39.14 1.06 2.3014 -2 -1 2 2 39.31 3.93 2.2918 -2 0 2 2 39.50 3.51 2.2814 0 -4 2 2 39.77 2.66 2.2663 -2 3 1 2 39.89 1.11 2.2597 1 -3 2 2 40.41 1.44 2.2323 0 4 2 2 40.72 8.74 2.2159 -2 1 2 2 41.44 10.37 2.1791 0 6 0 2 41.62 4.21 2.1698 -1 5 1 2 42.22 1.60 2.1407 2 5 0 2 42.47 1.38 2.1284 -2 -3 2 2 42.60 3.64 2.1224 1 4 2 2 42.68 2.96 2.1185 -2 4 0 2 43.26 1.92 2.0913 -2 2 2 2 43.71 1.36 2.0710 -2 -5 1 2 44.33 5.07 2.0434 0 6 1 2 44.63 2.85 2.0305 -2 4 1 2 44.65 6.29 2.0294 -3 -1 1 2 44.74 1.27 2.0257 0 -5 2 2 44.98 2.98 2.0154 -1 -1 3 2 45.06 2.82 2.0119 -3 0 1 2 45.37 1.12 1.9988 -3 -2 1 2 45.38 1.09 1.9984 1 6 1 2 45.76 3.94 1.9826 0 5 2 2 45.99 5.53 1.9735 2 -2 2 2 46.06 3.18 1.9706 3 3 0 2 46.20 8.13 1.9651 -1 -2 3 2 46.57 5.81 1.9501 -3 1 1 2 47.18 2.52 1.9264 -3 -3 1 2 47.57 7.10 1.9115 1 1 3 2 47.78 8.15 1.9036 -3 2 0 2 47.80 7.66 1.9028 2 6 0 2 47.85 3.72 1.9010 3 2 1 2 47.86 9.55 1.9006 1 -1 3 2 48.07 9.08 1.8927 0 -3 3 2 48.19 1.77 1.8882 -1 6 1 2 48.71 7.07 1.8692 3 -1 1 2 48.89 1.73 1.8629 -1 5 2 2 49.18 3.51 1.8528 2 -3 2 2 49.53 5.28 1.8405 2 4 2 2 50.57 5.13 1.8049 0 -6 2 2 50.68 10.30 1.8012 -1 -7 1 2 51.01 1.54 1.7903 -3 0 2 2 51.02 2.52 1.7900 -1 3 3 2 51.12 1.28 1.7868 2 6 1 2 51.16 6.95 1.7854 -2 4 2 2 51.48 4.93 1.7752 1 3 3 2 51.56 1.07 1.7726 -2 -2 3 2 52.04 2.82 1.7573 1 7 1 2 52.30 1.29 1.7493 1 -3 3 2 52.57 6.36 1.7410 -3 3 1 2 53.67 2.11 1.7077 -3 -5 1 2 54.48 2.38 1.6843 -2 6 0 2 54.80 4.35 1.6751 -2 -6 2 2 54.82 2.83 1.6745 -3 2 2 2 54.83 1.29 1.6743 -1 6 2 2 54.94 1.65 1.6714 3 1 2 2 55.14 3.73 1.6655 2 1 3 2 55.17 1.44 1.6647 1 -7 1 2 55.69 1.70 1.6506 3 2 2 2 55.72 2.26 1.6497 -1 -5 3 2 55.87 1.77 1.6455 1 -4 3 2 56.14 3.63 1.6383 3 5 1 2 56.24 1.33 1.6357 -2 5 2 2 56.91 1.14 1.6180 0 -7 2 2 57.03 1.11 1.6149 2 7 1 2 58.44 1.12 1.5793 3 -2 2 2 58.44 1.01 1.5792 3 -4 1 2 58.49 1.28 1.5779 2 6 2 2 59.07 2.04 1.5638 1 8 1 2 59.40 1.02 1.5560 4 2 0 2 59.56 1.37 1.5521 4 0 0 2 59.58 1.30 1.5518 -1 5 3 2 60.07 1.08 1.5402 -1 -1 4 2 60.19 3.15 1.5374 -3 -1 3 2 60.70 1.69 1.5257 4 3 0 2 60.76 2.47 1.5243 0 -2 4 2 61.56 1.14 1.5065 -2 -8 1 2 61.79 2.20 1.5013 -3 5 1 2 61.80 1.09 1.5013 -4 1 1 2 62.41 1.28 1.4879 -1 8 1 2 62.76 1.58 1.4804 -2 7 1 2 63.13 1.49 1.4728 -1 -8 2 2 63.25 1.72 1.4702 3 -5 1 2 64.08 1.06 1.4531 -2 -6 3 2 64.17 1.34 1.4514 1 2 4 2 64.76 1.30 1.4395 -2 0 4 2 65.25 1.79 1.4300 -2 -2 4 2 65.84 1.64 1.4185 -2 1 4 2 65.94 2.56 1.4167 -1 -7 3 2 66.51 1.21 1.4059 -4 3 0 2 67.18 1.42 1.3934 3 -1 3 2 67.84 1.36 1.3815 -4 -4 2 2 68.21 2.29 1.3749 -2 7 2 2 69.47 1.45 1.3531 4 -3 1 2 69.70 1.20 1.3492 4 6 0 2 69.76 1.62 1.3480 4 0 2 2 69.83 1.26 1.3470 1 -4 4 2 69.98 1.07 1.3443 1 -9 1 2 72.47 1.13 1.3042 3 7 2 2 73.12 1.03 1.2942 4 -2 2 2 73.97 1.12 1.2814 0 -6 4 2 74.06 2.58 1.2802 -2 4 4 2 75.95 1.33 1.2529 -3 -7 3 2 78.06 1.15 1.2242 3 8 2 2 79.45 1.29 1.2063 3 -5 3 2 80.22 2.05 1.1965 0 10 2 2 81.60 1.09 1.1798 -1 3 5 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.