Linnaeite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R070252 Lundqvist D, Westgren A Zeitschrift fur Anorganische und Allgemeine Chemie 239 (1938) 85-88 Rontgenuntersuchung des systems Co-S CELL PARAMETERS: 9.3990 9.3990 9.3990 90.000 90.000 90.000 SPACE GROUP: Fd3m ATOM X Y Z OCCUPANCY ISO(B) Co 0.00000 0.00000 0.00000 1.000 0.700 Co 0.62500 0.62500 0.62500 1.000 0.700 S -0.13500 -0.13500 -0.13500 1.000 1.000 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 0.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 8 +/- 8 +/- 8 MAX. ABS. INTENSITY / VOLUME**2: 66.72888138 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 16.33 17.15 5.4265 1 1 1 26.83 31.06 3.3230 2 2 0 31.57 100.00 2.8339 3 1 1 38.31 47.60 2.3498 4 0 0 47.38 10.18 1.9186 4 2 2 50.45 3.94 1.8088 3 3 3 50.45 39.94 1.8088 5 1 1 55.29 75.55 1.6615 4 4 0 58.06 2.39 1.5887 5 3 1 62.50 3.40 1.4861 6 2 0 65.07 9.88 1.4333 5 3 3 69.26 7.58 1.3566 4 4 4 71.71 2.26 1.3161 5 5 1 75.73 4.93 1.2560 6 4 2 78.10 5.10 1.2236 7 3 1 78.10 8.28 1.2236 5 5 3 82.02 9.21 1.1749 8 0 0 88.21 1.36 1.1077 8 2 2 88.21 1.06 1.1077 6 6 0 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.