As2 Hg4 I3 Labbe P, Ledesert M, Raveau B, Rebbah A Zeitschrift fur Kristallographie 187 (1989) 117-123 Crystal structure of Hg4 As2 I3 _cod_database_code 1001415 _database_code_amcsd 0010984 CELL PARAMETERS: 12.9990 12.9990 12.9990 90.000 90.000 90.000 SPACE GROUP: Pa3 X-RAY WAVELENGTH: 1.541838 Cell Volume: 2196.493 Density (g/cm3): 8.060 MAX. ABS. INTENSITY / VOLUME**2: 141.4487032 RIR: 5.714 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.79 10.85 7.5050 1 1 1 8 13.62 3.91 6.4995 2 0 0 6 15.24 8.56 5.8133 2 1 0 12 16.71 18.71 5.3068 2 1 1 24 19.31 1.53 4.5958 2 2 0 12 20.50 2.72 4.3330 2 2 1 24 22.69 4.02 3.9193 3 1 1 24 23.71 75.52 3.7525 2 2 2 8 24.69 7.14 3.6053 3 0 2 12 25.64 3.01 3.4741 3 2 1 24 27.45 100.00 3.2497 4 0 0 6 28.31 13.76 3.1527 4 1 0 12 28.31 25.78 3.1527 3 2 2 24 29.15 76.41 3.0639 4 1 1 24 29.96 4.67 2.9822 3 3 1 24 30.76 13.93 2.9067 4 0 2 12 30.76 8.95 2.9067 4 2 0 12 31.54 1.76 2.8366 4 2 1 24 31.54 57.20 2.8366 4 1 2 24 34.50 2.45 2.5998 4 3 0 12 35.20 32.27 2.5493 4 3 1 24 35.20 11.09 2.5493 4 1 3 24 35.90 5.45 2.5017 5 1 1 24 37.25 10.81 2.4139 4 3 2 24 37.25 1.02 2.4139 4 2 3 24 37.91 6.34 2.3733 5 1 2 24 39.20 42.13 2.2979 4 4 0 12 39.84 7.06 2.2628 5 2 2 24 39.84 2.55 2.2628 4 4 1 24 40.46 16.23 2.2293 4 3 3 24 41.08 1.24 2.1972 5 1 3 24 41.69 5.10 2.1665 6 0 0 6 42.89 3.83 2.1087 6 1 1 24 42.89 16.27 2.1087 5 3 2 24 42.89 1.53 2.1087 5 2 3 24 44.64 5.26 2.0301 6 2 1 24 44.64 3.39 2.0301 6 1 2 24 44.64 5.07 2.0301 5 0 4 12 45.21 24.16 2.0058 5 4 1 24 46.33 34.68 1.9597 6 2 2 24 46.89 3.13 1.9378 6 3 0 12 46.89 3.86 1.9378 5 4 2 24 46.89 10.62 1.9378 5 2 4 24 47.44 4.73 1.9166 6 1 3 24 47.44 1.70 1.9166 6 3 1 24 48.52 3.36 1.8762 4 4 4 8 49.06 9.72 1.8570 6 3 2 24 49.59 13.62 1.8383 5 4 3 24 50.12 2.22 1.8202 7 1 1 24 51.16 6.07 1.7855 6 1 4 24 51.67 1.77 1.7689 5 5 2 24 52.69 1.02 1.7371 6 2 4 24 52.69 3.94 1.7371 6 4 2 24 53.20 6.70 1.7218 7 2 2 24 54.20 1.65 1.6923 5 5 3 24 54.20 4.56 1.6923 7 3 1 24 54.20 1.63 1.6923 7 1 3 24 55.19 3.39 1.6644 6 4 3 24 55.68 1.83 1.6509 6 1 5 24 55.68 1.08 1.6509 7 3 2 24 55.68 12.23 1.6509 6 5 1 24 57.13 3.50 1.6123 6 2 5 24 57.13 5.07 1.6123 6 5 2 24 57.61 2.59 1.6001 7 4 1 24 58.56 14.90 1.5764 8 0 2 12 58.56 2.30 1.5764 8 2 0 12 59.03 2.12 1.5649 8 2 1 24 59.03 7.03 1.5649 8 1 2 24 59.03 2.04 1.5649 7 2 4 24 59.50 1.74 1.5537 6 3 5 24 59.50 7.74 1.5537 6 5 3 24 60.89 1.71 1.5214 6 6 1 24 61.35 4.31 1.5111 8 3 1 24 61.35 1.42 1.5111 7 4 3 24 61.35 1.29 1.5111 7 3 4 24 62.26 2.04 1.4911 6 6 2 24 62.72 4.06 1.4814 8 3 2 24 62.72 1.29 1.4814 6 5 4 24 64.96 1.62 1.4355 8 3 3 24 65.41 1.44 1.4268 7 3 5 24 65.85 5.83 1.4183 8 4 2 24 65.85 1.83 1.4183 8 2 4 24 66.73 3.99 1.4017 9 1 2 24 68.04 2.36 1.3779 8 3 4 24 68.04 6.21 1.3779 7 2 6 24 68.48 1.96 1.3702 8 1 5 24 69.77 1.45 1.3479 8 2 5 24 69.77 1.57 1.3479 8 5 2 24 70.20 1.60 1.3407 9 3 2 24 71.48 4.06 1.3198 6 6 5 24 71.90 1.69 1.3131 8 3 5 24 71.90 2.51 1.3131 9 4 1 24 73.17 1.33 1.2934 10 1 0 12 73.59 1.19 1.2871 10 1 1 24 74.43 7.20 1.2747 8 2 6 24 75.26 1.62 1.2626 9 4 3 24 76.51 2.93 1.2451 10 3 0 12 76.93 1.71 1.2394 10 1 3 24 76.93 2.70 1.2394 7 6 5 24 78.16 1.20 1.2228 9 4 4 24 78.58 2.16 1.2175 8 7 1 24 80.22 2.56 1.1967 9 1 6 24 81.03 2.32 1.1866 10 2 4 24 81.03 1.10 1.1866 10 4 2 24 81.85 1.66 1.1769 9 5 4 24 81.85 1.59 1.1769 8 7 3 24 82.25 1.00 1.1721 11 1 1 24 83.07 2.75 1.1627 10 3 4 24 83.07 2.90 1.1627 10 4 3 24 83.47 4.95 1.1580 9 3 6 24 85.50 1.34 1.1357 9 1 7 24 85.50 1.25 1.1357 11 3 1 24 86.71 1.14 1.1229 9 7 2 24 86.71 1.32 1.1229 10 5 3 24 87.92 1.21 1.1106 11 0 4 12 89.53 1.04 1.0947 11 2 4 24 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.