Clinoatacamite Wills A S, Henry J Y Journal of Physics: Condensed Matter 20 (2008) 472206-8 On the crystal and magnetic ordering structures of clinoatacamite, gamma-Cu2(OD)3Cl, a proposed valence bond solid Locality: synthetic _database_code_amcsd 0017751 CELL PARAMETERS: 6.1518 6.8161 9.1054 90.000 99.839 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 376.180 Density (g/cm3): 3.770 MAX. ABS. INTENSITY / VOLUME**2: 31.83573627 RIR: 2.749 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 16.19 49.49 5.4752 -1 0 1 2 16.33 100.00 5.4273 0 1 1 4 19.02 24.58 4.6662 1 0 1 2 19.60 2.39 4.5294 1 1 0 4 19.79 1.21 4.4857 0 0 2 2 26.11 5.34 3.4125 -1 1 2 4 26.15 2.62 3.4080 0 2 0 2 29.77 2.14 3.0014 1 1 2 4 30.08 1.20 2.9707 1 2 0 4 30.91 21.55 2.8933 -1 2 1 4 31.00 12.65 2.8846 -1 0 3 2 32.31 41.97 2.7708 -2 1 1 4 32.33 1.10 2.7692 2 1 0 4 32.53 41.99 2.7521 1 2 1 4 32.70 36.87 2.7385 0 1 3 4 32.71 8.99 2.7376 -2 0 2 2 33.01 17.39 2.7137 0 2 2 4 38.59 17.27 2.3331 2 0 2 2 39.80 61.85 2.2647 2 2 0 4 40.21 29.42 2.2429 0 0 4 2 40.81 2.16 2.2113 -2 1 3 4 40.98 2.45 2.2025 0 3 1 4 40.99 1.68 2.2018 -1 2 3 4 44.24 4.30 2.0475 -3 0 1 2 44.77 9.41 2.0245 1 2 3 4 47.81 5.28 1.9026 3 0 1 2 48.14 9.76 1.8901 2 1 3 4 49.97 3.11 1.8251 -3 0 3 2 50.17 16.21 1.8183 -2 3 1 4 50.44 5.55 1.8091 0 3 3 4 50.52 8.95 1.8066 -1 0 5 2 52.11 1.26 1.7551 -3 2 1 4 52.37 1.74 1.7472 2 3 1 4 52.76 1.88 1.7352 0 1 5 4 53.72 26.33 1.7063 -2 2 4 4 53.80 12.86 1.7040 0 4 0 2 55.30 3.86 1.6613 3 2 1 4 55.87 1.66 1.6457 1 0 5 2 56.48 2.97 1.6293 -2 3 3 4 56.56 2.20 1.6270 -1 4 1 4 56.60 2.71 1.6262 -2 1 5 4 57.26 1.39 1.6089 -3 2 3 4 57.58 1.08 1.6006 1 4 1 4 57.76 1.14 1.5962 -1 2 5 4 61.16 3.15 1.5153 4 0 0 2 61.82 6.35 1.5007 2 2 4 4 61.84 5.11 1.5002 -4 1 1 4 61.89 1.23 1.4993 1 3 4 4 62.45 4.39 1.4872 2 3 3 4 62.69 5.26 1.4819 1 2 5 4 63.15 1.53 1.4723 -3 0 5 2 63.40 2.91 1.4671 -1 4 3 4 64.40 3.86 1.4467 -2 4 2 4 64.62 2.33 1.4423 -2 0 6 2 65.66 1.47 1.4219 4 1 1 4 66.03 1.41 1.4150 3 2 3 4 66.35 1.73 1.4088 2 1 5 4 67.62 6.84 1.3854 -4 2 2 4 68.00 1.03 1.3787 3 3 2 4 68.14 6.36 1.3761 2 4 2 4 68.53 7.05 1.3693 0 2 6 4 68.56 3.67 1.3688 -4 0 4 2 69.25 6.54 1.3568 0 4 4 4 69.55 1.70 1.3516 -3 2 5 4 69.77 1.66 1.3480 -2 3 5 4 69.78 1.85 1.3477 0 5 1 4 72.12 1.65 1.3098 -3 4 1 4 72.76 1.00 1.2997 -1 0 7 2 74.50 1.84 1.2736 -4 3 1 4 74.79 1.41 1.2693 3 4 1 4 74.86 6.28 1.2684 4 2 2 4 75.48 1.24 1.2596 0 1 7 4 75.56 3.03 1.2583 2 0 6 2 76.29 2.34 1.2481 -4 1 5 4 76.48 1.50 1.2455 -3 4 3 4 76.64 1.73 1.2434 -2 5 1 4 76.85 2.42 1.2404 0 5 3 4 76.91 2.37 1.2396 -1 4 5 4 76.94 1.61 1.2392 -2 1 7 4 82.01 1.08 1.1750 5 0 1 2 82.73 1.12 1.1665 4 0 4 2 82.81 1.94 1.1657 3 2 5 4 85.81 1.22 1.1324 4 4 0 4 86.10 1.18 1.1293 -5 2 3 4 86.95 1.19 1.1205 2 5 3 4 88.15 1.14 1.1083 -4 3 5 4 88.42 1.47 1.1056 -4 2 6 4 88.78 1.17 1.1020 -2 3 7 4 88.86 1.31 1.1012 0 6 2 4 88.90 1.52 1.1009 -2 4 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.