Mo2 O13 P3 Tl Costentin G, Borel M, Grandin A, Leclaire A, Raveau B Acta Crystallographica C47 (1991) 1136-1138 Stucture of beta-TlMo2P3O13 _cod_database_code 1001463 _database_code_amcsd 0010255 CELL PARAMETERS: 9.7536 19.0640 6.3945 90.000 107.099 90.000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1136.454 Density (g/cm3): 4.074 MAX. ABS. INTENSITY / VOLUME**2: 23.11552118 RIR: 1.847 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.28 7.18 9.5320 0 2 0 2 9.49 32.04 9.3225 1 0 0 2 10.56 1.96 8.3748 1 1 0 4 15.22 1.92 5.8201 0 1 1 4 15.53 41.44 5.7066 -1 1 1 4 16.89 13.05 5.2508 1 3 0 4 17.51 8.56 5.0662 -1 2 1 4 18.62 33.17 4.7660 0 4 0 2 19.04 17.59 4.6612 2 0 0 2 19.61 10.16 4.5279 2 1 0 4 20.12 3.62 4.4130 1 1 1 4 20.16 5.87 4.4051 0 3 1 4 20.39 12.92 4.3553 -1 3 1 4 20.81 8.79 4.2677 -2 1 1 4 20.93 29.96 4.2436 1 4 0 4 21.70 17.82 4.0960 1 2 1 4 22.34 24.88 3.9790 -2 2 1 4 23.67 8.15 3.7585 2 3 0 4 23.87 4.44 3.7273 -1 4 1 4 24.10 100.00 3.6920 1 3 1 4 24.69 45.68 3.6057 -2 3 1 4 27.14 5.27 3.2858 1 4 1 4 27.57 8.39 3.2349 0 5 1 4 27.66 25.02 3.2245 -2 4 1 4 27.67 12.37 3.2243 2 1 1 4 27.75 5.91 3.2151 -1 5 1 4 28.08 37.06 3.1773 0 6 0 2 28.32 94.73 3.1513 -1 1 2 4 28.52 28.98 3.1293 -3 1 1 4 28.73 51.42 3.1075 3 0 0 2 28.85 28.64 3.0943 2 2 1 4 29.22 3.46 3.0559 0 0 2 2 29.48 6.98 3.0296 -1 2 2 4 29.71 20.89 3.0075 1 6 0 4 30.25 4.07 2.9545 3 2 0 4 30.28 1.72 2.9512 2 5 0 4 30.63 1.09 2.9187 1 5 1 4 30.72 3.98 2.9100 0 2 2 4 30.74 13.10 2.9086 2 3 1 4 31.10 15.98 2.8755 -2 5 1 4 31.33 10.50 2.8547 -1 3 2 4 31.35 12.75 2.8533 -2 2 2 4 31.52 9.92 2.8383 -3 3 1 4 31.74 1.35 2.8191 0 6 1 4 32.51 2.04 2.7540 0 3 2 4 33.11 2.51 2.7058 -2 3 2 4 33.22 8.82 2.6972 2 4 1 4 33.44 3.03 2.6800 1 0 2 2 33.77 5.28 2.6540 -1 4 2 4 34.15 14.96 2.6254 2 6 0 4 34.30 19.88 2.6142 1 7 0 4 34.46 7.95 2.6024 1 6 1 4 34.77 7.68 2.5800 1 2 2 4 34.88 7.20 2.5725 0 4 2 4 34.89 2.14 2.5716 -2 6 1 4 34.92 1.23 2.5695 -3 1 2 4 35.44 2.81 2.5331 -2 4 2 4 35.89 1.40 2.5022 -3 2 2 4 36.11 7.12 2.4876 0 7 1 4 36.18 2.18 2.4828 2 5 1 4 36.24 7.47 2.4786 -1 7 1 4 36.38 1.40 2.4694 1 3 2 4 36.70 11.90 2.4490 -1 5 2 4 36.86 4.17 2.4386 -3 5 1 4 37.33 1.26 2.4088 -4 1 1 4 37.33 3.63 2.4088 3 5 0 4 37.46 1.13 2.4009 -3 3 2 4 37.75 5.84 2.3830 0 8 0 2 38.25 1.77 2.3531 -4 2 1 4 38.28 1.65 2.3515 2 7 0 4 38.54 3.73 2.3360 1 4 2 4 38.63 3.70 2.3306 4 0 0 2 38.84 4.83 2.3184 3 3 1 4 38.93 4.56 2.3134 4 1 0 4 39.56 2.90 2.2778 -3 4 2 4 39.74 1.44 2.2683 -4 3 1 4 39.74 1.53 2.2681 2 0 2 2 39.82 2.46 2.2639 4 2 0 4 40.02 1.73 2.2530 -1 6 2 4 40.03 6.79 2.2522 2 1 2 4 40.61 20.07 2.2216 3 6 0 4 40.76 1.11 2.2137 -1 8 1 4 40.90 3.60 2.2065 2 2 2 4 40.98 10.34 2.2025 0 6 2 4 41.52 3.95 2.1751 -4 1 2 4 42.14 2.02 2.1442 -3 5 2 4 42.36 1.01 2.1338 -4 2 2 4 42.61 1.19 2.1218 2 8 0 4 42.82 2.47 2.1118 -1 1 3 4 43.18 6.13 2.0953 -2 1 3 4 43.21 17.90 2.0937 4 4 0 4 43.22 11.24 2.0931 -2 8 1 4 43.22 2.23 2.0931 2 7 1 4 43.40 2.55 2.0848 3 5 1 4 43.67 1.91 2.0727 -1 7 2 4 43.81 5.26 2.0664 -3 7 1 4 44.22 1.15 2.0482 -4 5 1 4 44.22 4.45 2.0482 3 7 0 4 44.56 1.37 2.0332 0 7 2 4 44.74 10.68 2.0257 0 1 3 4 44.98 2.70 2.0152 -1 3 3 4 45.13 1.76 2.0090 -3 6 2 4 45.42 7.65 1.9967 -1 9 1 4 45.53 6.26 1.9923 0 2 3 4 45.60 2.56 1.9895 -4 4 2 4 45.62 7.05 1.9885 4 5 0 4 45.76 6.12 1.9828 -3 1 3 4 45.81 1.45 1.9807 4 1 1 4 46.54 1.35 1.9514 -3 2 3 4 46.59 4.33 1.9493 2 5 2 4 46.81 1.04 1.9407 -1 4 3 4 46.83 1.37 1.9400 0 3 3 4 47.19 1.70 1.9262 2 8 1 4 47.37 12.29 1.9193 1 9 1 4 47.47 3.17 1.9154 3 0 2 2 47.60 2.67 1.9103 -1 8 2 4 47.72 2.73 1.9058 3 1 2 4 47.82 3.84 1.9022 -3 3 3 4 47.87 6.54 1.9003 4 3 1 4 47.91 1.36 1.8986 -4 5 2 4 48.12 3.08 1.8910 3 8 0 4 48.60 5.45 1.8733 0 4 3 4 48.85 1.03 1.8645 5 0 0 2 48.87 7.80 1.8636 -2 8 2 4 49.08 4.13 1.8561 -1 5 3 4 49.37 3.56 1.8460 2 6 2 4 49.44 3.04 1.8434 -5 1 2 4 50.12 3.25 1.8199 0 10 1 4 50.18 1.77 1.8181 -5 2 2 4 50.34 1.24 1.8125 -4 7 1 4 50.56 3.01 1.8052 -5 4 1 4 50.68 8.88 1.8014 1 3 3 4 51.03 7.20 1.7897 -4 2 3 4 51.30 3.03 1.7808 1 8 2 4 51.39 1.41 1.7781 -5 3 2 4 51.39 7.67 1.7780 2 9 1 4 51.62 2.19 1.7707 4 7 0 4 51.74 1.92 1.7667 -3 5 3 4 51.78 1.50 1.7655 -1 9 2 4 52.35 1.20 1.7476 1 4 3 4 52.51 1.71 1.7429 2 7 2 4 52.71 4.16 1.7365 -5 5 1 4 53.05 2.17 1.7263 -5 4 2 4 53.54 1.95 1.7116 3 5 2 4 53.80 3.91 1.7039 1 11 0 4 53.87 3.31 1.7020 -4 4 3 4 54.32 2.84 1.6887 -3 6 3 4 54.41 1.13 1.6864 2 1 3 4 55.08 2.77 1.6674 0 11 1 4 55.09 2.92 1.6669 2 2 3 4 55.13 3.09 1.6659 -5 5 2 4 55.83 1.71 1.6467 5 1 1 4 55.93 1.44 1.6440 -4 5 3 4 56.06 6.08 1.6404 3 6 2 4 56.18 1.45 1.6372 -1 10 2 4 56.23 1.88 1.6359 2 3 3 4 56.30 2.60 1.6340 -3 10 1 4 56.40 7.58 1.6313 0 7 3 4 56.47 1.73 1.6297 -5 1 3 4 56.51 9.81 1.6286 5 2 1 4 56.87 2.34 1.6190 1 11 1 4 56.90 5.06 1.6183 -6 1 1 4 57.13 3.00 1.6122 -4 8 2 4 57.13 1.50 1.6122 4 2 2 4 57.16 2.66 1.6115 -2 11 1 4 57.27 8.08 1.6087 -3 7 3 4 57.31 4.50 1.6075 -2 10 2 4 57.62 1.04 1.5996 5 3 1 4 57.70 6.65 1.5976 -2 0 4 2 58.06 2.14 1.5887 0 12 0 2 58.59 2.04 1.5756 -2 2 4 4 58.67 5.11 1.5736 -6 3 1 4 58.92 1.46 1.5675 4 9 0 4 58.98 5.33 1.5661 1 12 0 4 59.00 1.26 1.5655 -3 0 4 2 59.12 1.63 1.5626 -1 2 4 4 59.16 2.20 1.5616 5 4 1 4 59.51 2.50 1.5535 1 10 2 4 59.71 3.35 1.5485 0 8 3 4 59.77 1.31 1.5473 2 5 3 4 60.36 1.16 1.5335 6 2 0 4 60.91 1.37 1.5209 -3 11 1 4 61.19 7.08 1.5148 -2 4 4 4 61.24 4.13 1.5136 3 11 0 4 61.43 2.35 1.5094 -5 8 1 4 61.46 2.22 1.5087 0 2 4 4 61.52 1.86 1.5073 3 1 3 4 61.68 2.25 1.5037 2 12 0 4 62.16 1.37 1.4934 -2 12 1 4 62.92 1.05 1.4771 -4 2 4 4 62.99 1.69 1.4756 4 10 0 4 63.34 1.33 1.4684 5 8 0 4 63.44 1.41 1.4663 5 6 1 4 64.19 5.46 1.4509 4 9 1 4 64.67 2.03 1.4413 3 4 3 4 64.85 1.09 1.4377 -4 10 2 4 65.45 2.20 1.4260 0 13 1 4 65.48 1.62 1.4255 1 2 4 4 65.63 1.21 1.4225 3 11 1 4 66.05 2.35 1.4145 3 12 0 4 66.08 1.69 1.4140 -2 10 3 4 66.13 1.11 1.4130 5 7 1 4 66.31 2.35 1.4096 0 12 2 4 66.53 1.19 1.4054 1 9 3 4 67.10 2.45 1.3950 -6 7 1 4 67.14 1.09 1.3943 -5 9 2 4 67.93 3.74 1.3799 1 4 4 4 68.53 1.49 1.3693 -1 7 4 4 68.88 1.19 1.3631 -6 5 3 4 69.17 1.15 1.3582 5 8 1 4 69.22 1.63 1.3572 -3 7 4 4 69.37 1.17 1.3547 -3 12 2 4 69.73 1.45 1.3486 4 8 2 4 69.86 1.20 1.3464 4 1 3 4 70.06 1.79 1.3430 -1 11 3 4 70.24 1.34 1.3400 2 0 4 2 70.36 2.51 1.3380 1 10 3 4 70.78 2.02 1.3311 -3 13 1 4 70.90 1.66 1.3291 0 14 1 4 70.95 1.61 1.3284 -5 10 2 4 71.45 6.96 1.3203 4 3 3 4 71.52 1.85 1.3192 -1 8 4 4 71.53 1.49 1.3190 7 2 0 4 72.66 4.01 1.3012 2 12 2 4 72.97 1.17 1.2966 -6 0 4 2 73.26 4.99 1.2921 -7 2 3 4 73.68 1.39 1.2858 -4 12 2 4 73.89 1.46 1.2826 7 4 0 4 74.29 2.33 1.2767 3 8 3 4 75.19 1.24 1.2636 3 13 1 4 75.60 1.12 1.2579 -7 4 3 4 75.93 1.25 1.2531 -2 3 5 4 76.06 1.00 1.2513 -3 14 1 4 76.08 1.10 1.2511 -6 4 4 4 76.54 1.28 1.2447 -6 8 3 4 76.65 2.24 1.2432 -1 15 1 4 77.57 2.52 1.2307 3 9 3 4 77.75 1.32 1.2283 7 6 0 4 78.04 1.40 1.2245 -2 10 4 4 78.09 1.10 1.2238 1 15 1 4 79.40 2.26 1.2069 -1 13 3 4 79.44 1.25 1.2064 -7 6 3 4 80.31 1.10 1.1954 3 4 4 4 80.74 1.05 1.1902 0 13 3 4 81.20 1.38 1.1847 2 15 1 4 81.29 1.50 1.1835 6 5 2 4 81.48 1.92 1.1813 -3 13 3 4 81.96 2.21 1.1755 -5 3 5 4 82.60 1.31 1.1680 2 8 4 4 82.75 1.03 1.1663 1 1 5 4 83.57 1.18 1.1569 -8 5 2 4 83.58 1.15 1.1569 6 11 0 4 84.20 1.44 1.1499 1 10 4 4 84.73 1.00 1.1441 -1 7 5 4 84.75 1.06 1.1438 -2 14 3 4 84.88 1.11 1.1424 -4 13 3 4 87.64 1.01 1.1134 1 17 0 4 88.29 1.58 1.1069 -2 16 2 4 88.73 1.15 1.1025 1 14 3 4 89.84 1.27 1.0918 7 10 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.