Barberiite Caron A P, Ragle J L Acta Crystallographica B27 (1971) 1102-1107 Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4 Locality: synthetic _database_code_amcsd 0019268 CELL PARAMETERS: 9.0770 5.6790 7.2790 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 375.220 Density (g/cm3): 1.856 MAX. ABS. INTENSITY / VOLUME**2: 2.511756226 RIR: 0.441 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.60 28.45 5.6786 1 0 1 4 19.56 23.24 4.5385 2 0 0 2 19.83 94.14 4.4775 0 1 1 4 23.09 48.41 3.8512 2 0 1 4 24.46 46.80 3.6395 0 0 2 2 25.12 89.52 3.5454 2 1 0 4 26.38 9.26 3.3781 1 0 2 4 27.99 100.00 3.1874 2 1 1 8 30.80 72.04 2.9033 1 1 2 8 31.51 23.82 2.8395 0 2 0 2 31.51 22.18 2.8393 2 0 2 4 32.03 2.55 2.7939 3 0 1 4 35.34 55.25 2.5397 1 2 1 8 35.34 5.63 2.5396 2 1 2 8 35.82 11.42 2.5069 3 1 1 8 37.36 14.20 2.4072 2 2 0 4 38.40 12.97 2.3440 1 0 3 4 38.70 39.72 2.3267 3 0 2 4 39.43 39.31 2.2855 2 2 1 8 39.72 7.33 2.2692 4 0 0 2 40.28 12.85 2.2387 0 2 2 4 40.43 8.47 2.2312 0 1 3 4 41.55 23.29 2.1736 1 2 2 8 41.68 23.43 2.1667 1 1 3 8 41.69 23.63 2.1664 4 0 1 4 41.96 14.94 2.1530 3 1 2 8 42.24 5.28 2.1397 2 0 3 4 42.92 12.54 2.1072 4 1 0 4 44.77 1.78 2.0241 4 1 1 8 45.16 2.23 2.0078 2 2 2 8 45.29 1.12 2.0023 2 1 3 8 48.07 3.42 1.8929 3 0 3 4 49.77 2.15 1.8321 0 3 1 4 50.02 7.36 1.8236 4 1 2 8 50.49 11.67 1.8077 1 2 3 8 50.84 1.11 1.7958 1 3 1 8 51.20 1.91 1.7842 1 0 4 4 53.18 6.50 1.7224 4 2 1 8 53.63 2.07 1.7089 2 2 3 8 53.86 1.64 1.7022 1 1 4 8 54.55 3.20 1.6824 5 1 1 8 55.44 11.81 1.6574 4 0 3 4 55.66 18.17 1.6514 1 3 2 8 56.66 5.88 1.6245 5 0 2 4 57.86 1.34 1.5937 4 2 2 8 58.61 2.36 1.5750 2 3 2 8 58.61 4.39 1.5750 3 2 3 8 59.25 2.23 1.5594 3 0 4 4 60.42 2.26 1.5321 0 2 4 4 62.20 4.71 1.4925 0 3 3 4 64.06 8.53 1.4536 4 3 0 4 64.87 3.55 1.4374 1 0 5 4 65.08 3.11 1.4332 6 1 1 8 65.18 1.06 1.4314 4 2 3 8 65.78 3.75 1.4197 0 4 0 2 66.99 2.17 1.3970 6 0 2 4 68.08 1.80 1.3773 4 1 4 8 68.67 4.28 1.3669 3 2 4 8 69.84 1.36 1.3467 2 1 5 8 70.33 2.60 1.3385 3 3 3 8 70.54 1.62 1.3352 6 2 0 4 72.85 1.48 1.2984 1 3 4 8 73.14 3.35 1.2939 5 2 3 8 82.36 1.75 1.1709 5 2 4 8 85.60 1.20 1.1346 8 0 0 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.