CaHI Wyckoff R W G Crystal Structures 1 (1963) 294-296 Second edition. Interscience Publishers, New York, New York Note: tetragonal PbFCl structure _database_code_amcsd 0011846 CELL PARAMETERS: 4.0710 4.0710 8.9410 90.000 90.000 90.000 SPACE GROUP: P4/nmm X-RAY WAVELENGTH: 1.541838 Cell Volume: 148.180 Density (g/cm3): 3.765 MAX. ABS. INTENSITY / VOLUME**2: 94.50285940 RIR: 8.174 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.89 15.67 8.9410 0 0 1 2 19.86 29.34 4.4705 0 0 2 2 24.02 50.75 3.7050 1 0 1 8 29.68 100.00 3.0100 1 0 2 8 29.98 8.62 2.9803 0 0 3 2 31.07 62.14 2.8786 1 1 0 4 32.68 5.01 2.7401 1 1 1 8 37.15 23.20 2.4203 1 1 2 8 37.40 1.63 2.4048 1 0 3 8 40.35 2.14 2.2352 0 0 4 2 43.72 11.06 2.0705 1 1 3 8 44.51 21.64 2.0355 2 0 0 4 45.71 1.66 1.9847 2 0 1 8 46.34 30.80 1.9593 1 0 4 8 49.18 9.04 1.8525 2 0 2 8 51.08 1.41 1.7882 0 0 5 2 51.21 12.06 1.7840 2 1 1 16 51.78 3.99 1.7655 1 1 4 8 54.41 30.10 1.6861 2 1 2 16 54.60 5.88 1.6809 2 0 3 8 56.18 1.94 1.6372 1 0 5 8 61.00 3.29 1.5190 1 1 5 8 61.63 2.04 1.5050 2 0 4 8 62.31 3.11 1.4902 0 0 6 2 64.77 5.94 1.4393 2 2 0 4 66.20 18.06 1.4116 2 1 4 16 68.48 2.90 1.3701 2 2 2 8 70.04 2.01 1.3434 2 0 5 8 70.14 2.21 1.3416 3 0 1 8 71.26 7.64 1.3234 1 1 6 8 72.84 5.40 1.2985 3 0 2 8 73.00 2.32 1.2961 2 2 3 8 73.57 7.51 1.2874 3 1 0 8 74.35 1.65 1.2758 2 1 5 16 77.10 3.98 1.2371 3 1 2 16 78.48 2.33 1.2187 1 0 7 8 79.76 5.32 1.2024 2 0 6 8 81.43 3.28 1.1818 3 1 3 16 83.30 4.22 1.1600 3 0 4 8 86.88 1.05 1.1212 2 2 5 8 86.98 2.37 1.1202 3 2 1 16 87.43 1.30 1.1156 3 1 4 16 89.53 5.75 1.0947 3 2 2 16 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.