P4W16O56 Labbe P, Goreaud M, Raveau B Journal of Solid State Chemistry 61 (1986) 324-331 Monophosphate tungsten bronzes with pentagonal tunnels (PO2)4(WO3)2m: Structure of two even-m members P4W12O44 (m=6) and P4W16O56 (m=8) _cod_database_code 1001336 _database_code_amcsd 0013573 CELL PARAMETERS: 5.2943 6.5534 29.7000 90.000 90.000 90.000 SPACE GROUP: P2_12_12_1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 1030.461 Density (g/cm3): 6.383 MAX. ABS. INTENSITY / VOLUME**2: 100.1217154 RIR: 5.108 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 5.95 64.41 14.8500 0 0 2 2 11.92 12.88 7.4250 0 0 4 2 16.22 4.87 5.4646 0 1 3 4 17.92 5.06 4.9500 0 0 6 2 18.05 1.80 4.9134 0 1 4 4 20.18 21.38 4.4011 0 1 5 4 20.60 2.28 4.3107 1 0 4 4 21.58 14.60 4.1183 1 1 0 4 22.40 57.48 3.9685 1 1 2 4 22.51 68.84 3.9499 0 1 6 4 23.39 100.00 3.8024 1 1 3 4 23.97 1.82 3.7125 0 0 8 2 24.62 4.74 3.6158 1 0 6 4 24.72 80.95 3.6014 1 1 4 4 25.00 40.41 3.5616 0 1 7 4 26.33 19.10 3.3844 1 1 5 4 27.62 8.43 3.2302 0 1 8 4 28.19 2.15 3.1659 1 1 6 4 29.38 6.24 3.0396 1 0 8 4 30.24 3.01 2.9551 1 1 7 4 31.17 1.55 2.8691 0 2 5 4 32.70 12.27 2.7385 1 2 2 4 32.78 13.53 2.7323 0 2 6 4 33.12 3.63 2.7052 0 1 10 4 33.41 44.17 2.6820 1 2 3 4 33.86 36.14 2.6472 2 0 0 2 34.38 21.06 2.6086 1 2 4 4 34.41 1.97 2.6061 2 0 2 4 34.59 19.06 2.5934 0 2 7 4 34.63 60.50 2.5903 1 0 10 4 34.84 1.09 2.5752 1 1 9 4 36.02 1.27 2.4934 2 0 4 4 36.58 4.78 2.4567 0 2 8 4 37.76 1.08 2.3823 2 1 3 4 38.90 5.18 2.3154 0 1 12 4 39.73 4.93 2.2684 2 1 5 4 41.05 12.69 2.1990 2 1 6 4 41.45 14.55 2.1786 0 3 1 4 41.88 3.54 2.1573 0 1 13 4 42.55 7.74 2.1246 2 1 7 4 44.08 1.07 2.0542 2 2 1 4 44.24 3.42 2.0475 2 1 8 4 44.91 3.40 2.0183 0 1 14 4 44.96 1.02 2.0160 2 2 3 4 45.40 1.02 1.9978 1 1 13 4 45.95 5.77 1.9749 0 2 12 4 46.69 2.48 1.9456 2 2 5 4 47.84 16.37 1.9012 2 2 6 4 48.00 2.26 1.8954 0 1 15 4 48.09 2.35 1.8920 2 1 10 4 48.58 13.79 1.8741 0 2 13 4 49.18 22.04 1.8525 2 2 7 4 49.24 1.26 1.8504 1 2 12 4 50.02 1.23 1.8234 1 3 7 4 50.70 5.27 1.8007 2 2 8 4 51.19 5.17 1.7845 1 1 15 4 51.30 5.03 1.7808 0 2 14 4 52.51 6.94 1.7428 2 1 12 4 53.18 33.08 1.7224 1 3 9 4 53.80 1.35 1.7041 3 1 0 4 54.18 5.26 1.6930 3 1 2 4 54.20 13.04 1.6923 1 1 16 4 54.55 23.57 1.6822 2 3 1 4 54.65 9.45 1.6794 3 1 3 4 54.90 7.77 1.6723 2 1 13 4 55.31 1.57 1.6610 2 3 3 4 55.31 8.60 1.6609 3 1 4 4 55.71 1.18 1.6500 0 0 18 2 56.15 2.45 1.6380 3 1 5 4 56.94 16.83 1.6171 1 3 11 4 57.06 1.33 1.6140 1 2 15 4 57.28 5.31 1.6083 1 1 17 4 57.41 5.77 1.6050 2 1 14 4 57.85 1.08 1.5939 3 0 8 4 58.29 2.37 1.5829 2 2 12 4 59.43 3.11 1.5554 0 4 6 4 59.83 7.16 1.5459 1 4 3 4 59.85 2.30 1.5453 3 2 2 4 59.87 4.14 1.5448 1 2 16 4 60.03 1.83 1.5411 2 1 15 4 60.30 8.39 1.5350 3 2 3 4 60.45 6.32 1.5315 1 4 4 4 60.53 8.59 1.5296 2 2 13 4 60.58 3.70 1.5284 0 4 7 4 60.92 4.54 1.5208 3 2 4 4 61.08 12.47 1.5171 3 0 10 4 61.26 1.37 1.5130 1 3 13 4 62.55 5.23 1.4850 0 0 20 2 62.78 6.11 1.4801 1 2 17 4 62.90 3.78 1.4776 2 2 14 4 65.78 2.01 1.4197 1 2 18 4 66.81 2.48 1.4003 2 0 18 4 69.28 1.47 1.3563 2 4 5 4 70.18 5.56 1.3410 2 4 6 4 70.77 2.93 1.3314 0 4 13 4 71.25 5.99 1.3236 2 4 7 4 71.25 5.81 1.3236 4 0 0 2 72.96 2.22 1.2967 0 4 14 4 73.06 9.22 1.2951 2 0 20 4 73.29 1.70 1.2916 3 1 15 4 73.88 3.87 1.2828 1 1 22 4 74.67 5.63 1.2712 0 3 19 4 74.91 2.88 1.2676 1 5 2 4 74.92 1.07 1.2675 4 1 5 4 74.92 10.18 1.2675 3 3 9 4 74.96 1.15 1.2670 0 5 6 4 75.31 3.49 1.2619 1 5 3 4 75.78 4.69 1.2553 3 1 16 4 75.80 3.49 1.2550 4 1 6 4 75.87 2.06 1.2540 1 5 4 4 75.99 1.48 1.2523 0 5 7 4 76.83 2.63 1.2407 4 1 7 4 77.46 2.65 1.2322 1 1 23 4 78.10 6.06 1.2237 3 3 11 4 78.39 2.07 1.2199 3 1 17 4 80.22 1.99 1.1966 1 4 16 4 80.60 2.55 1.1920 3 4 3 4 80.64 1.49 1.1915 3 2 16 4 80.66 2.09 1.1912 4 2 6 4 80.80 3.17 1.1894 2 4 13 4 80.99 2.11 1.1872 0 3 21 4 81.14 2.42 1.1853 3 4 4 4 81.16 1.23 1.1852 1 1 24 4 81.68 3.42 1.1789 4 2 7 4 82.30 3.23 1.1716 1 2 23 4 82.80 2.40 1.1657 1 4 17 4 82.91 2.90 1.1645 2 4 14 4 83.21 2.48 1.1610 3 2 17 4 84.27 1.31 1.1491 4 1 12 4 84.56 5.13 1.1459 2 3 19 4 84.84 1.08 1.1429 2 5 6 4 85.85 1.68 1.1320 2 5 7 4 85.93 4.29 1.1312 4 3 1 4 85.94 1.39 1.1310 1 2 24 4 86.21 1.32 1.1282 4 1 13 4 86.48 1.10 1.1253 0 1 26 4 87.01 1.22 1.1199 2 5 8 4 88.30 1.14 1.1068 4 1 14 4 89.04 1.19 1.0995 4 2 12 4 89.79 2.67 1.0922 0 6 0 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.