Cs O25 P6 Si2 Ti3 Benmoussa A, Borel M, Grandin A, Leclaire A, Raveau B Acta Crystallographica C47 (1991) 936-938 Structure of mixed-valent titanium silicophosphates, K Ti3 P6 Si2 O25 and Cs Ti3 P6 Si2 O25 _cod_database_code 1001858 _database_code_amcsd 0010253 CELL PARAMETERS: 8.2145 8.2145 17.2490 90.000 90.000 120.000 SPACE GROUP: P-31c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1007.991 Density (g/cm3): 3.026 MAX. ABS. INTENSITY / VOLUME**2: 17.94705072 RIR: 1.931 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.26 7.84 8.6245 0 0 2 2 12.44 39.21 7.1140 1 0 0 6 13.46 2.56 6.5766 1 0 1 12 16.15 19.20 5.4879 1 0 2 12 19.85 3.37 4.4717 1 0 3 12 20.60 2.65 4.3122 0 0 4 2 21.64 72.12 4.1073 1 1 0 6 24.00 73.06 3.7082 2 -1 2 6 24.00 26.94 3.7082 1 1 2 6 24.13 50.72 3.6877 1 0 4 12 25.57 21.04 3.4837 2 0 1 12 27.12 5.54 3.2883 2 0 2 12 28.76 12.38 3.1041 1 0 5 12 30.05 53.11 2.9741 1 1 4 6 30.05 29.01 2.9741 2 -1 4 6 31.11 10.71 2.8748 0 0 6 2 32.63 29.57 2.7440 2 0 4 12 33.62 1.30 2.6654 1 0 6 12 33.74 26.21 2.6567 2 1 1 12 33.74 1.11 2.6567 3 -1 1 12 34.95 3.95 2.5670 2 1 2 12 34.95 12.16 2.5670 3 -1 2 12 36.28 13.71 2.4764 2 0 5 12 36.90 7.09 2.4357 2 1 3 12 37.94 24.16 2.3713 3 0 0 6 38.21 10.98 2.3552 1 1 6 6 38.31 2.38 2.3492 3 0 1 12 38.67 3.77 2.3284 1 0 7 12 39.41 1.31 2.2865 3 0 2 12 39.50 3.18 2.2816 3 -1 4 12 39.50 4.37 2.2816 2 1 4 12 41.18 7.93 2.1922 3 0 3 12 41.90 4.28 2.1561 0 0 8 2 42.63 2.78 2.1207 2 1 5 12 42.63 1.86 2.1207 3 -1 5 12 43.56 6.44 2.0779 3 0 4 12 44.10 4.36 2.0536 2 2 0 6 45.40 1.77 1.9978 4 -2 2 6 46.00 1.82 1.9731 3 1 0 12 46.23 1.11 1.9638 3 -1 6 12 46.32 1.26 1.9603 4 -1 1 12 46.47 1.22 1.9542 3 0 5 12 47.26 2.22 1.9234 3 1 2 12 47.63 8.15 1.9091 2 -1 8 6 48.80 1.98 1.8662 3 1 3 12 49.14 14.79 1.8541 4 -2 4 6 49.14 8.02 1.8541 2 2 4 6 49.24 3.22 1.8506 1 0 9 12 49.43 1.60 1.8438 2 0 8 12 49.85 7.69 1.8293 3 0 6 12 50.89 3.81 1.7942 4 -1 4 12 50.89 3.30 1.7942 3 1 4 12 51.38 1.36 1.7785 4 0 0 6 52.54 1.68 1.7418 4 0 2 12 53.50 1.49 1.7127 4 -1 5 12 53.50 10.54 1.7127 3 1 5 12 53.97 3.33 1.6991 4 0 3 12 54.38 2.75 1.6872 2 0 9 12 54.56 1.92 1.6821 2 1 8 12 54.56 5.57 1.6821 3 -1 8 12 54.76 1.45 1.6763 1 0 10 12 54.95 2.94 1.6711 4 -2 6 6 56.65 5.06 1.6248 5 -2 1 12 57.47 1.52 1.6036 3 2 2 12 57.80 12.77 1.5953 3 0 8 12 57.99 3.29 1.5903 2 -1 10 6 58.38 2.53 1.5808 4 0 5 12 59.20 4.07 1.5607 2 1 9 12 59.20 2.17 1.5607 3 -1 9 12 59.55 16.19 1.5524 4 1 0 12 59.57 5.45 1.5520 2 0 10 12 60.07 1.04 1.5402 3 1 7 12 60.61 1.96 1.5278 5 -1 2 12 60.67 3.53 1.5264 5 -2 4 12 60.67 1.88 1.5264 3 2 4 12 62.45 2.28 1.4870 2 2 8 6 63.01 2.54 1.4753 3 2 5 12 63.71 3.22 1.4606 5 -1 4 12 63.71 4.04 1.4606 4 1 4 12 63.96 2.25 1.4556 3 1 8 12 64.15 2.37 1.4518 2 1 10 12 66.62 1.16 1.4038 5 0 2 12 68.22 2.50 1.3748 4 -1 9 12 68.38 1.19 1.3720 4 0 8 12 68.54 6.19 1.3691 3 3 0 6 68.72 2.58 1.3660 4 1 6 12 69.02 1.23 1.3607 3 2 7 12 69.25 5.35 1.3567 1 1 12 6 69.58 2.21 1.3511 5 0 4 12 70.22 1.33 1.3403 4 2 1 12 71.42 1.49 1.3208 2 2 10 6 72.43 1.05 1.3049 3 3 4 6 72.46 1.35 1.3044 1 0 13 12 72.51 2.40 1.3037 4 0 9 12 72.83 2.50 1.2986 3 1 10 12 73.83 1.70 1.2835 4 2 4 12 74.46 2.15 1.2742 5 1 1 12 75.17 1.47 1.2639 6 -1 2 12 75.46 2.50 1.2598 5 -1 8 12 75.97 1.45 1.2527 6 -2 5 12 76.65 1.27 1.2432 2 0 13 12 76.69 1.96 1.2426 5 -2 9 12 77.17 1.78 1.2361 6 -3 6 6 77.17 1.07 1.2361 3 3 6 6 77.47 1.79 1.2321 0 0 14 2 77.68 1.53 1.2292 3 0 12 12 78.00 2.93 1.2251 5 1 4 12 78.00 2.73 1.2251 6 -1 4 12 80.09 3.58 1.1982 6 -1 5 12 80.77 2.46 1.1899 3 -1 13 12 81.11 2.96 1.1857 6 0 0 6 81.13 2.40 1.1855 3 2 10 12 81.79 1.61 1.1776 4 -2 12 6 81.79 1.02 1.1776 2 2 12 6 83.67 1.10 1.1558 3 3 8 6 84.88 1.27 1.1424 5 0 9 12 88.92 1.61 1.1006 4 2 9 12 89.68 2.74 1.0933 3 0 14 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.