B3 O5 Tl Touboul M, Betourne E, Nowogrocki G Journal of Solid State Chemistry 131 (1997) 370-373 Crystal structure of thallium triborate, Tl B3 O5 _cod_database_code 1004124 _database_code_amcsd 0013929 CELL PARAMETERS: 5.2099 8.2480 10.2060 90.000 90.000 90.000 SPACE GROUP: P2_12_12_1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 438.565 Density (g/cm3): 4.798 MAX. ABS. INTENSITY / VOLUME**2: 127.3815210 RIR: 8.645 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.80 47.84 6.4150 0 1 1 4 19.13 23.62 4.6403 1 0 1 4 20.47 1.25 4.3396 0 1 2 4 21.55 28.49 4.1240 0 2 0 2 21.98 1.73 4.0442 1 1 1 4 23.26 2.51 3.8236 0 2 1 4 24.42 6.05 3.6456 1 0 2 4 26.74 100.00 3.3344 1 1 2 4 27.59 5.42 3.2336 1 2 0 4 28.38 17.99 3.1450 0 1 3 4 28.97 38.01 3.0825 1 2 1 4 31.40 13.24 2.8485 1 0 3 4 32.79 1.67 2.7314 1 2 2 4 33.28 2.18 2.6924 1 1 3 4 33.76 10.53 2.6547 0 3 1 4 34.43 10.18 2.6049 2 0 0 2 35.17 10.49 2.5515 0 0 4 2 35.57 1.88 2.5240 2 0 1 4 36.16 1.02 2.4840 2 1 0 4 37.15 6.00 2.4204 0 3 2 4 37.25 16.74 2.4135 2 1 1 4 38.04 4.32 2.3653 1 3 1 4 38.41 19.97 2.3438 1 2 3 4 40.38 1.13 2.2335 2 1 2 4 40.87 1.14 2.2078 1 1 4 4 40.98 11.70 2.2024 2 2 0 4 41.12 18.23 2.1951 1 3 2 4 41.62 12.33 2.1698 0 2 4 4 41.97 4.13 2.1528 2 2 1 4 42.26 5.08 2.1383 0 3 3 4 43.91 5.76 2.0620 0 4 0 2 44.82 1.10 2.0221 2 2 2 4 44.84 2.52 2.0212 0 4 1 4 45.20 9.46 2.0061 2 1 3 4 45.27 2.29 2.0030 1 2 4 4 45.79 4.08 1.9814 0 1 5 4 45.87 1.81 1.9782 1 3 3 4 47.42 2.52 1.9173 1 4 0 4 47.86 5.83 1.9005 1 0 5 4 48.30 4.23 1.8843 1 4 1 4 48.99 6.67 1.8593 2 3 1 4 49.29 1.71 1.8488 2 2 3 4 50.04 6.89 1.8228 2 0 4 4 51.33 2.10 1.7798 2 1 4 4 51.54 2.37 1.7731 2 3 2 4 53.06 6.00 1.7261 1 2 5 4 53.53 2.46 1.7120 3 0 1 4 54.76 2.23 1.6763 3 1 1 4 54.97 3.35 1.6703 1 4 3 4 55.08 7.57 1.6672 2 2 4 4 55.61 4.18 1.6528 2 3 3 4 55.93 1.09 1.6440 3 0 2 4 56.12 1.51 1.6389 0 3 5 4 56.96 2.70 1.6168 2 4 0 4 57.13 8.66 1.6123 3 1 2 4 57.46 3.10 1.6038 0 4 4 4 57.73 1.83 1.5969 2 4 1 4 58.13 7.78 1.5868 1 1 6 4 58.36 2.39 1.5812 3 2 1 4 58.53 3.96 1.5771 2 1 5 4 58.83 2.32 1.5696 0 5 2 4 59.47 2.73 1.5543 1 5 1 4 59.79 1.06 1.5468 3 0 3 4 60.39 3.52 1.5328 1 4 4 4 60.64 1.75 1.5272 3 2 2 4 61.72 4.05 1.5029 1 5 2 4 63.73 1.99 1.4603 2 4 3 4 64.07 1.53 1.4533 3 3 1 4 64.32 1.78 1.4482 3 2 3 4 64.41 1.24 1.4465 0 3 6 4 64.95 2.80 1.4357 0 1 7 4 65.37 2.04 1.4275 1 5 3 4 66.24 3.77 1.4110 3 3 2 4 66.61 1.04 1.4041 1 0 7 4 66.96 2.67 1.3975 1 4 5 4 67.16 4.36 1.3938 1 3 6 4 67.52 1.92 1.3872 2 3 5 4 67.88 1.17 1.3808 2 5 1 4 68.73 2.71 1.3657 2 4 4 4 69.98 2.26 1.3444 2 5 2 4 70.90 1.49 1.3292 1 6 0 4 70.90 1.57 1.3291 1 2 7 4 71.30 1.37 1.3227 3 0 5 4 71.64 1.40 1.3172 3 4 1 4 73.42 1.38 1.2896 2 5 3 4 73.53 1.26 1.2881 0 3 7 4 74.31 1.23 1.2764 4 1 1 4 75.48 1.98 1.2595 3 2 5 4 75.63 2.34 1.2574 2 1 7 4 78.48 1.36 1.2188 0 2 8 4 79.37 1.70 1.2072 2 6 1 4 79.68 1.21 1.2034 4 1 3 4 79.77 2.11 1.2022 3 1 6 4 81.68 2.02 1.1788 1 6 4 4 82.91 1.32 1.1645 3 5 2 4 83.78 1.27 1.1546 2 3 7 4 84.30 1.43 1.1488 4 1 4 4 84.36 1.32 1.1481 0 7 2 4 84.58 1.00 1.1457 2 0 8 4 84.91 1.13 1.1420 1 7 1 4 87.31 1.64 1.1167 4 2 4 4 87.83 1.68 1.1115 3 3 6 4 88.59 2.50 1.1039 2 2 8 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.