Paceite Klop E A, Duisenberg A J M, Spek A L Acta Crystallographica C39 (1983) 1342-1344 Reinvestigation of the structure of calcium copper acetate hexahydrate, CaCu(C2H3O2)4*6H2O _database_code_amcsd 0009984 CELL PARAMETERS: 11.1520 11.1520 16.2400 90.000 90.000 90.000 SPACE GROUP: I4/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 2019.722 Density (g/cm3): 1.473 MAX. ABS. INTENSITY / VOLUME**2: 15.20010479 RIR: 3.361 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.62 2.53 9.1931 1 0 1 8 10.90 18.89 8.1200 0 0 2 2 11.22 100.00 7.8857 1 1 0 4 15.66 3.24 5.6570 1 1 2 8 15.89 20.28 5.5760 2 0 0 4 18.61 2.57 4.7676 1 2 1 8 24.27 17.51 3.6679 1 2 3 8 24.66 24.37 3.6097 1 1 4 8 25.25 26.57 3.5266 1 3 0 4 27.17 9.37 3.2821 2 0 4 8 27.58 1.24 3.2347 1 3 2 8 29.40 6.93 3.0384 2 3 1 8 31.63 6.29 2.8285 2 2 4 8 33.36 7.51 2.6856 2 3 3 8 33.66 2.22 2.6624 3 1 4 8 34.11 1.62 2.6286 3 3 0 4 35.05 2.88 2.5601 1 1 6 8 36.02 4.59 2.4937 2 4 0 4 36.92 1.38 2.4350 2 0 6 8 39.20 3.97 2.2983 4 0 4 8 40.90 2.54 2.2065 3 3 4 8 41.28 3.51 2.1871 1 5 0 4 42.55 8.30 2.1249 2 4 4 8 44.64 2.83 2.0300 0 0 8 2 46.18 2.88 1.9659 1 1 8 8 47.20 3.65 1.9255 5 1 4 8 47.20 3.09 1.9255 1 5 4 8 47.54 4.05 1.9126 3 5 0 4 47.68 2.19 1.9075 2 0 8 8 49.01 1.04 1.8587 6 0 0 4 51.53 2.01 1.7734 4 4 4 8 51.85 2.21 1.7633 2 6 0 4 51.85 1.17 1.7633 6 2 0 4 51.98 2.18 1.7593 1 3 8 8 52.92 1.04 1.7302 3 5 4 8 52.92 2.27 1.7302 5 3 4 8 56.93 1.33 1.6173 6 2 4 8 67.26 1.03 1.3920 3 5 8 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.