Lollingite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R070592 Lutz H D, Jung M, Waschenbach G Zeitschrift fur Anorganische und Allgemeine Chemie 554 (1987) 87-91 Kristallstrukturen des lollingits FeAs2 und des pyrits RuTe2 Locality: synthetic CELL PARAMETERS: 5.2800 5.9730 2.8830 90.000 90.000 90.000 SPACE GROUP: Pnnm ATOM X Y Z OCCUPANCY ISO(B) Fe 0.00000 0.00000 0.00000 1.000 0.453 As 0.17600 0.36250 0.00000 1.000 0.500 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 4 +/- 5 +/- 2 MAX. ABS. INTENSITY / VOLUME**2: 81.76051801 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 22.47 3.67 3.9560 1 1 0 29.92 4.97 2.9865 0 2 0 33.96 3.08 2.6400 2 0 0 34.50 100.00 2.5995 1 2 0 34.55 9.04 2.5964 0 1 1 35.48 82.02 2.5304 1 0 1 37.24 38.37 2.4147 2 1 0 38.64 85.72 2.3299 1 1 1 45.88 12.33 1.9780 2 2 0 47.07 9.64 1.9306 1 2 1 48.89 26.22 1.8630 1 3 0 49.22 52.12 1.8511 2 1 1 54.34 33.39 1.6882 3 1 0 56.14 44.00 1.6383 0 3 1 56.41 36.39 1.6310 2 2 1 58.02 4.65 1.5896 2 3 0 59.04 10.93 1.5647 1 3 1 61.75 8.33 1.5022 3 0 1 62.16 3.65 1.4933 0 4 0 64.66 17.28 1.4415 0 0 2 64.89 1.40 1.4369 1 4 0 70.12 7.51 1.3420 3 2 1 71.55 3.13 1.3187 3 3 0 72.76 10.90 1.2997 2 4 0 73.47 6.57 1.2889 4 1 0 75.40 17.81 1.2606 1 2 2 77.05 7.95 1.2377 2 1 2 79.36 1.54 1.2073 4 2 0 81.18 1.13 1.1849 2 4 1 81.87 5.15 1.1767 4 1 1 82.85 2.36 1.1652 1 5 0 82.87 3.41 1.1650 2 2 2 85.10 8.66 1.1401 1 3 2 87.62 13.52 1.1136 4 2 1 88.62 3.91 1.1036 0 5 1 88.97 1.83 1.1002 4 3 0 89.37 14.01 1.0963 3 1 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.