Cesstibtantite Diffraction data computed using the structute from the paper listed below, along with the cell parameters refined from single crystal data of R061058 Ercit T S, Cerny P, Hawthorne F C Mineralogy and Petrology 48 (1993) 235-255 Cesstibtantite - a geologic introduction to the inverse pyrochlores Locality: Leshaia pegmatite, Kola Peninsula, Russia Sample: KO-1 CELL PARAMETERS: 10.5200 10.5200 10.5200 90.000 90.000 90.000 ALTERNATE SETTING FOR SPACE GROUP: Fd3m ATOM X Y Z OCCUPANCY ISO(B) Sb 0.51800 0.51800 0.45500 0.047 1.184 Na 0.51800 0.51800 0.45500 0.026 1.184 Pb 0.51800 0.51800 0.45500 0.002 1.184 Bi 0.51800 0.51800 0.45500 0.001 1.184 Ta 0.00000 0.00000 0.00000 0.940 1.595 Nb 0.00000 0.00000 0.00000 0.060 1.595 Oo 0.31400 0.12500 0.12500 0.948 1.784 OH 0.31400 0.12500 0.12500 0.026 1.784 F 0.31400 0.12500 0.12500 0.026 1.784 Cs 0.37500 0.37500 0.37500 0.310 4.579 OH 0.37500 0.37500 0.37500 0.345 4.579 F 0.37500 0.37500 0.37500 0.345 4.579 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 0.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 9 +/- 9 +/- 9 MAX. ABS. INTENSITY / VOLUME**2: 215.8347294 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 14.58 51.64 6.0737 1 1 1 23.92 1.36 3.7194 2 2 0 28.13 60.61 3.1719 3 1 1 29.41 100.00 3.0369 2 2 2 34.09 25.58 2.6300 4 0 0 37.26 6.11 2.4135 3 3 1 44.76 11.77 2.0246 5 1 1 44.76 10.87 2.0246 3 3 3 48.98 40.82 1.8597 4 4 0 51.38 10.62 1.7782 5 3 1 55.22 1.36 1.6634 6 2 0 57.44 7.96 1.6043 5 3 3 58.17 30.76 1.5859 6 2 2 61.02 6.88 1.5184 4 4 4 63.11 5.83 1.4731 5 5 1 63.11 2.98 1.4731 7 1 1 68.51 9.99 1.3696 7 3 1 68.51 3.26 1.3696 5 5 3 71.78 4.35 1.3150 8 0 0 73.72 1.63 1.2852 7 3 3 78.79 3.92 1.2147 7 5 1 79.41 8.97 1.2067 6 6 2 81.91 6.80 1.1762 8 4 0 83.77 2.19 1.1547 7 5 3 83.77 1.62 1.1547 9 1 1 88.70 3.85 1.1028 9 3 1 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.