Goldfieldite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R110023 Pohl D, Liessmann W, Okrugin V M Neues Jahrbuch fur Mineralogie, Monatshefte 1996 (1996) 1-8 Rietveld analysis of selenium-bearing goldfieldites Locality: Ozernoya deposit, Kamchatka, Russia _database_code_amcsd 0014878 CELL PARAMETERS: 10.2520 10.2520 10.2520 90.000 90.000 90.000 SPACE GROUP: I-43m ATOM X Y Z OCCUPANCY ISO(B) Cu 0.25000 0.50000 0.00000 0.850 0.700 Cu 0.20900 0.00000 0.00000 0.983 0.700 Te 0.26280 0.26280 0.26280 0.625 1.000 Sb 0.26280 0.26280 0.26280 0.250 1.000 As 0.26280 0.26280 0.26280 0.125 0.600 S 0.12000 0.12000 0.36000 0.940 1.000 Se 0.12000 0.12000 0.36000 0.060 0.600 S 0.00000 0.00000 0.00000 0.700 1.000 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 9 +/- 9 +/- 9 MAX. ABS. INTENSITY / VOLUME**2: 130.5677987 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 12.21 2.56 7.2493 1 1 0 17.30 6.17 5.1260 2 0 0 21.23 2.37 4.1854 2 1 1 24.56 11.41 3.6246 2 2 0 30.20 100.00 2.9595 2 2 2 32.68 5.54 2.7400 3 2 1 35.01 18.85 2.5630 4 0 0 37.21 5.30 2.4164 4 1 1 37.21 2.82 2.4164 3 3 0 39.30 3.67 2.2924 4 2 0 41.31 4.04 2.1857 3 3 2 43.23 2.03 2.0927 4 2 2 45.09 3.66 2.0106 5 1 0 45.09 5.20 2.0106 4 3 1 48.64 6.32 1.8718 5 2 1 50.35 46.20 1.8123 4 4 0 52.01 1.62 1.7582 4 3 3 53.64 2.42 1.7087 4 4 2 55.23 5.13 1.6631 6 1 1 56.80 3.23 1.6210 6 2 0 58.33 1.36 1.5819 5 4 1 59.84 26.15 1.5455 6 2 2 62.80 2.54 1.4797 4 4 4 64.24 1.45 1.4499 5 5 0 64.24 1.14 1.4499 5 4 3 68.49 1.67 1.3700 6 4 2 72.61 1.46 1.3020 6 5 1 72.61 1.52 1.3020 7 3 2 73.97 5.00 1.2815 8 0 0 75.31 1.17 1.2619 5 5 4 77.97 2.93 1.2253 6 5 3 80.61 1.66 1.1918 7 4 3 80.61 2.51 1.1918 8 3 1 81.92 6.70 1.1760 6 6 2 84.53 1.96 1.1462 8 4 0 85.83 1.59 1.1321 8 3 3 87.13 1.42 1.1186 8 4 2 88.43 1.59 1.1055 6 5 5 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.