Hoelite Murty B V R Zeitschrift fur Kristallographie 113 (1960) 445-465 Refinement of the structure of anthraquinone _database_code_amcsd 0010586 CELL PARAMETERS: 15.8100 3.9420 7.8650 90.000 102.720 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 478.141 Density (g/cm3): 1.446 MAX. ABS. INTENSITY / VOLUME**2: 4.100017275 RIR: 0.923 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.48 64.79 7.7110 2 0 0 2 11.53 40.24 7.6720 0 0 1 2 14.38 52.88 6.1588 -2 0 1 2 18.02 1.19 4.9235 2 0 1 2 23.07 13.16 3.8555 4 0 0 2 23.19 10.99 3.8360 0 0 2 2 23.29 21.46 3.8192 1 1 0 4 23.43 5.18 3.7966 -4 0 1 2 23.52 6.03 3.7826 -2 0 2 2 25.38 63.86 3.5099 2 1 0 4 25.40 44.65 3.5062 0 1 1 4 26.63 100.00 3.3470 1 1 1 4 28.10 1.96 3.1758 4 0 1 2 28.17 2.71 3.1676 2 0 2 2 28.53 16.23 3.1282 3 1 0 4 29.00 3.60 3.0794 -4 0 2 2 29.02 8.98 3.0772 2 1 1 4 29.35 6.38 3.0427 -3 1 1 4 32.32 3.43 2.7698 3 1 1 4 32.48 2.19 2.7563 4 1 0 4 34.02 2.63 2.6356 1 1 2 4 34.27 2.46 2.6169 -6 0 1 2 34.43 2.64 2.6047 -2 0 3 2 36.50 1.25 2.4618 4 0 2 2 37.01 8.04 2.4292 5 1 0 4 39.34 6.08 2.2900 6 0 1 2 39.49 6.43 2.2818 2 0 3 2 40.36 1.17 2.2349 -5 1 2 4 40.87 4.34 2.2083 5 1 1 4 41.41 2.09 2.1806 -1 1 3 4 41.96 1.70 2.1531 6 1 0 4 42.12 3.37 2.1454 0 1 3 4 43.66 5.29 2.0733 1 1 3 4 44.11 4.86 2.0529 -6 0 3 2 44.28 1.87 2.0455 -6 1 2 4 44.37 3.05 2.0418 -4 1 3 4 47.26 1.06 1.9232 7 1 0 4 47.40 1.23 1.9180 0 0 4 2 47.66 2.10 1.9082 5 1 2 4 49.83 5.69 1.8298 2 2 1 4 51.35 3.15 1.7793 8 0 1 2 51.57 2.42 1.7721 2 0 4 2 52.01 6.03 1.7584 3 2 1 4 52.12 1.02 1.7550 4 2 0 4 52.34 1.18 1.7479 -2 2 2 4 53.17 1.41 1.7226 1 2 2 4 54.82 2.94 1.6747 4 2 1 4 54.86 2.62 1.6735 2 2 2 4 55.31 1.58 1.6609 5 2 0 4 55.67 1.84 1.6510 -5 1 4 4 59.85 1.77 1.5454 3 1 4 4 72.59 1.46 1.3024 -4 0 6 2 75.36 1.82 1.2612 6 2 3 4 76.61 1.84 1.2438 7 1 4 4 80.94 1.04 1.1878 5 2 4 4 82.10 1.21 1.1739 -7 1 6 4 86.00 1.08 1.1303 -13 1 3 4 86.36 1.79 1.1266 -14 0 2 2 86.47 1.47 1.1255 5 3 2 4 89.06 1.04 1.0993 -6 0 7 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.