IMA2008-065 Ballirano P, Bonaccorsi E, Merlino S The Canadian Mineralogist 36 (1998) 1285-1292 Carbonate groups in davyne: Structural and crystal-chemical considerations _database_code_amcsd 0005578 CELL PARAMETERS: 12.6916 12.6916 5.3333 90.000 90.000 120.000 SPACE GROUP: P6_3 X-RAY WAVELENGTH: 1.541838 Cell Volume: 743.977 Density (g/cm3): 2.447 MAX. ABS. INTENSITY / VOLUME**2: 8.141172349 RIR: 1.083 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 8.04 11.09 10.9912 1 0 0 6 13.96 9.38 6.3458 1 1 0 6 18.49 94.74 4.7983 1 0 1 6 21.39 1.84 4.1543 2 1 0 6 21.77 1.04 4.0828 1 1 1 6 23.24 1.50 3.8273 2 0 1 6 24.29 100.00 3.6637 3 0 0 6 27.21 44.00 3.2774 1 2 1 6 27.21 45.60 3.2774 2 1 1 6 28.12 1.12 3.1729 2 2 0 6 29.30 4.51 3.0484 1 3 0 6 29.30 2.70 3.0484 3 1 0 6 29.58 8.52 3.0198 3 0 1 6 32.59 17.39 2.7478 4 0 0 6 33.61 41.85 2.6667 0 0 2 1 33.87 16.94 2.6466 1 3 1 6 33.87 9.60 2.6466 3 1 1 6 34.61 6.12 2.5915 1 0 2 6 36.55 3.79 2.4584 1 1 2 6 36.79 37.81 2.4427 4 0 1 6 37.50 4.15 2.3985 1 4 0 6 37.50 2.48 2.3985 4 1 0 6 39.53 1.28 2.2796 2 3 1 6 39.53 1.21 2.2796 3 2 1 6 41.06 3.23 2.1982 5 0 0 6 41.27 1.42 2.1875 4 1 1 6 41.90 2.67 2.1560 3 0 2 6 42.75 37.83 2.1153 3 3 0 6 44.38 7.96 2.0414 2 2 2 6 44.58 3.67 2.0324 5 0 1 6 45.18 2.87 2.0071 1 3 2 6 45.18 5.00 2.0071 3 1 2 6 47.51 15.14 1.9137 4 0 2 6 49.77 1.02 1.8322 2 3 2 6 49.77 1.14 1.8322 3 2 2 6 50.51 1.95 1.8069 4 3 0 6 51.23 13.00 1.7833 1 4 2 6 51.23 10.41 1.7833 4 1 2 6 51.96 1.76 1.7600 2 5 0 6 52.12 4.84 1.7550 1 0 3 6 52.84 1.35 1.7325 6 0 1 6 53.55 3.81 1.7114 3 4 1 6 53.55 6.43 1.7114 4 3 1 6 55.45 2.55 1.6572 3 3 2 6 56.29 3.08 1.6344 1 2 3 6 56.29 3.07 1.6344 2 1 3 6 57.65 1.90 1.5990 6 1 1 6 58.15 5.75 1.5864 4 4 0 6 58.81 1.48 1.5702 5 3 0 6 60.26 3.19 1.5357 1 3 3 6 60.26 1.93 1.5357 3 1 3 6 61.40 4.60 1.5099 6 0 2 6 61.57 1.07 1.5063 3 5 1 6 61.57 2.85 1.5063 5 3 1 6 61.57 6.06 1.5063 7 0 1 6 62.04 2.20 1.4959 3 4 2 6 62.04 2.48 1.4959 4 3 2 6 62.19 7.07 1.4926 4 0 3 6 63.48 1.85 1.4655 6 2 1 6 63.48 1.93 1.4655 2 6 1 6 63.95 3.89 1.4558 1 7 0 6 63.95 1.49 1.4558 7 1 0 6 68.27 1.43 1.3739 8 0 0 6 68.86 11.87 1.3634 4 4 2 6 69.47 1.14 1.3530 7 0 2 6 70.65 4.97 1.3333 0 0 4 1 70.82 10.46 1.3305 8 0 1 6 72.43 1.45 1.3048 1 1 4 6 74.22 7.83 1.2778 1 7 2 6 74.22 3.95 1.2778 7 1 2 6 74.94 1.39 1.2673 3 4 3 6 74.94 2.43 1.2673 4 3 3 6 75.95 2.96 1.2529 3 0 4 6 76.12 2.09 1.2506 1 8 1 6 77.70 2.75 1.2289 3 6 2 6 77.70 2.13 1.2289 6 3 2 6 78.29 2.51 1.2212 9 0 0 6 79.98 1.52 1.1996 4 0 4 6 81.85 2.11 1.1769 7 0 3 6 81.85 1.02 1.1769 5 3 3 6 86.23 1.75 1.1279 3 3 4 6 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.