Ferroselite Kjekshus A, Rakke T, Andresen A Acta Chemica Scandinavica A28 (1974) 996-1000 Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Locality: synthetic _database_code_amcsd 0011936 CELL PARAMETERS: 4.8002 5.7823 3.5834 90.000 90.000 90.000 SPACE GROUP: Pnnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 99.462 Density (g/cm3): 7.137 MAX. ABS. INTENSITY / VOLUME**2: 89.55996414 RIR: 4.086 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 24.10 12.50 3.6934 1 1 0 4 29.32 15.78 3.0459 0 1 1 4 30.93 6.73 2.8911 0 2 0 2 31.15 50.00 2.8715 1 0 1 4 34.89 100.00 2.5719 1 1 1 8 36.27 83.89 2.4766 1 2 0 4 37.47 11.05 2.4001 2 0 0 2 40.70 6.87 2.2167 2 1 0 4 44.47 11.97 2.0374 1 2 1 8 48.28 71.21 1.8852 2 1 1 8 49.35 6.08 1.8467 2 2 0 4 50.97 29.26 1.7917 0 0 2 2 51.06 9.13 1.7886 1 3 0 4 54.02 33.32 1.6975 0 3 1 4 56.02 9.49 1.6415 2 2 1 8 57.14 1.67 1.6120 1 1 2 8 57.60 16.48 1.6003 1 3 1 8 59.99 11.78 1.5421 3 1 0 4 60.82 1.49 1.5230 0 2 2 4 61.73 1.42 1.5028 2 3 0 4 63.69 1.37 1.4610 3 0 1 4 64.15 28.27 1.4517 1 2 2 8 64.46 3.08 1.4456 0 4 0 2 64.95 4.30 1.4358 2 0 2 4 65.95 8.47 1.4165 3 1 1 8 66.83 7.61 1.4000 3 2 0 4 67.18 2.80 1.3934 2 1 2 8 67.60 2.98 1.3859 2 3 1 8 72.48 2.90 1.3040 3 2 1 8 73.67 2.96 1.2859 2 2 2 8 75.04 4.82 1.2658 1 3 2 8 77.01 12.51 1.2383 2 4 0 4 79.94 3.22 1.2000 4 0 0 2 82.01 2.42 1.1750 4 1 0 4 82.54 8.23 1.1688 3 1 2 8 82.92 3.24 1.1643 3 3 1 8 83.38 2.11 1.1591 1 0 3 4 84.06 1.09 1.1514 2 3 2 8 85.43 6.33 1.1365 1 1 3 8 86.51 2.71 1.1251 0 4 2 4 86.58 1.31 1.1243 1 5 0 4 88.67 6.68 1.1031 3 2 2 8 88.93 4.79 1.1006 0 5 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.