Ba F5.5 H1.5 Nb O1.5 Crosnier-Lopez M, Duroy H, Fourquet J European Journal of Solid State and Inorganic Chemistry 30 (1993) 549-556 BaNbF7-x(OH)x: preparation and crystal structure _cod_database_code 1000342 _database_code_amcsd 0012578 CELL PARAMETERS: 9.9259 9.9259 9.9259 90.000 90.000 90.000 SPACE GROUP: Pa3 X-RAY WAVELENGTH: 1.541838 Cell Volume: 977.934 Density (g/cm3): 4.872 MAX. ABS. INTENSITY / VOLUME**2: 166.2174003 RIR: 11.108 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 20.00 5.46 4.4390 2 1 0 12 25.38 100.00 3.5093 2 2 0 12 26.95 4.81 3.3086 2 2 1 24 31.22 1.95 2.8654 2 2 2 8 33.79 1.36 2.6528 3 1 2 24 36.20 15.09 2.4815 4 0 0 6 40.65 2.16 2.2195 4 0 2 12 40.65 9.22 2.2195 4 2 0 12 41.70 6.08 2.1660 4 2 1 24 41.70 1.43 2.1660 4 1 2 24 44.73 43.84 2.0261 4 2 2 24 45.70 2.64 1.9852 4 3 0 12 46.66 1.21 1.9466 4 3 1 24 49.45 3.73 1.8432 4 3 2 24 52.13 8.57 1.7547 4 4 0 12 53.00 1.25 1.7279 4 4 1 24 55.55 1.24 1.6543 4 4 2 24 56.38 1.16 1.6318 6 1 0 12 58.84 7.04 1.5694 6 0 2 12 58.84 4.99 1.5694 6 2 0 12 59.64 2.67 1.5502 6 1 2 24 60.44 1.69 1.5316 5 1 4 24 62.02 2.59 1.4964 6 2 2 24 62.80 1.16 1.4797 5 2 4 24 65.11 3.54 1.4327 4 4 4 8 65.87 1.34 1.4180 6 3 2 24 68.12 1.29 1.3765 6 4 0 12 71.07 7.60 1.3264 6 2 4 24 71.07 4.95 1.3264 6 4 2 24 76.83 1.30 1.2407 8 0 0 6 79.65 1.27 1.2037 8 0 2 12 79.65 1.71 1.2037 6 4 4 24 80.35 1.16 1.1949 8 1 2 24 82.45 2.65 1.1698 8 2 2 24 82.45 2.16 1.1698 6 6 0 12 85.23 1.28 1.1386 6 6 2 24 88.00 1.73 1.1097 8 4 0 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.