Yoshimuraite McDonald A M, Grice J D, Chao G Y The Canadian Mineralogist 38 (2000) 649-656 The crystal structure of yoshimuraite, a layered Ba-Mn-Ti silicophosphate, with comments on five-coordinated Ti _database_code_amcsd 0005651 CELL PARAMETERS: 6.9990 14.7480 5.3860 93.620 89.980 95.500 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 552.277 Density (g/cm3): 4.379 MAX. ABS. INTENSITY / VOLUME**2: 26.45097775 RIR: 1.967 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 6.03 100.00 14.6506 0 1 0 2 12.08 1.31 7.3253 0 2 0 2 12.71 6.61 6.9667 1 0 0 2 16.70 5.81 5.3092 -1 2 0 2 17.21 4.71 5.1530 0 -1 1 2 17.93 4.50 4.9459 0 1 1 2 18.17 5.27 4.8835 0 3 0 2 18.40 12.63 4.8223 1 2 0 2 20.81 15.91 4.2676 -1 0 1 2 20.93 1.81 4.2439 1 0 1 2 21.15 2.31 4.2000 1 -1 1 2 21.19 8.21 4.1926 -1 3 0 2 21.74 20.76 4.0880 -1 -1 1 2 22.43 23.31 3.9630 1 1 1 2 23.05 14.90 3.8583 1 -2 1 2 23.83 17.00 3.7343 0 -3 1 2 24.04 7.76 3.7011 -1 2 1 2 24.23 20.82 3.6739 -1 -2 1 2 24.30 1.03 3.6626 0 4 0 2 25.41 6.28 3.5056 0 3 1 2 25.57 11.21 3.4833 2 0 0 2 25.71 1.19 3.4645 -2 1 0 2 26.28 37.78 3.3907 1 -3 1 2 26.38 16.77 3.3783 -1 4 0 2 26.87 21.17 3.3179 2 1 0 2 27.27 6.98 3.2699 -2 2 0 2 27.64 36.82 3.2271 -1 3 1 2 27.88 9.38 3.2000 -1 -3 1 2 28.60 3.39 3.1208 1 4 0 2 28.61 19.04 3.1202 0 -4 1 2 29.34 22.22 3.0439 1 3 1 2 29.43 18.42 3.0348 2 2 0 2 30.05 13.78 2.9741 -2 3 0 2 30.39 14.05 2.9412 0 4 1 2 30.46 17.15 2.9348 1 -4 1 2 30.51 13.49 2.9301 0 5 0 2 30.66 2.67 2.9156 2 0 1 2 31.40 5.22 2.8487 -2 -1 1 2 31.70 4.66 2.8224 2 -2 1 2 31.98 13.95 2.7987 2 1 1 2 32.35 13.41 2.7678 -1 -4 1 2 32.37 32.72 2.7656 -2 2 1 2 33.34 14.61 2.6876 0 0 2 2 33.45 5.02 2.6788 -2 -2 1 2 33.52 21.55 2.6737 0 -1 2 2 33.90 6.39 2.6441 0 -5 1 2 33.95 6.14 2.6403 2 -3 1 2 34.02 17.03 2.6349 1 4 1 2 34.32 3.84 2.6128 1 5 0 2 34.39 3.16 2.6080 2 2 1 2 34.82 4.14 2.5765 0 -2 2 2 35.28 1.37 2.5438 1 -5 1 2 35.74 2.63 2.5123 -1 0 2 2 35.88 1.90 2.5026 1 0 2 2 36.33 2.53 2.4729 0 2 2 2 37.07 1.45 2.4252 -1 5 1 2 37.14 1.24 2.4204 2 -4 1 2 37.29 5.09 2.4111 2 4 0 2 37.38 1.24 2.4060 -1 -5 1 2 37.86 9.90 2.3767 -1 6 0 2 38.44 2.08 2.3418 -2 4 1 2 38.87 2.67 2.3169 1 -3 2 2 39.11 1.21 2.3033 1 2 2 2 39.27 1.89 2.2939 0 3 2 2 40.29 3.43 2.2382 1 6 0 2 40.35 14.00 2.2355 0 -4 2 2 40.79 4.57 2.2120 -1 3 2 2 41.42 2.64 2.1799 -3 3 0 2 41.58 1.78 2.1719 0 6 1 2 41.75 6.93 2.1633 2 4 1 2 41.77 2.28 2.1627 1 -4 2 2 42.08 2.83 2.1472 1 3 2 2 42.16 5.18 2.1432 2 5 0 2 42.23 2.61 2.1399 3 -1 1 2 42.31 1.45 2.1363 -3 0 1 2 42.36 1.01 2.1338 -2 0 2 2 42.37 4.27 2.1332 -3 1 1 2 42.50 1.19 2.1272 -1 6 1 2 42.61 8.29 2.1220 2 0 2 2 42.61 4.78 2.1218 -2 5 1 2 42.77 2.09 2.1141 -2 1 2 2 42.88 14.43 2.1090 -2 -1 2 2 42.91 3.90 2.1077 3 -2 1 2 42.99 9.11 2.1041 0 4 2 2 43.07 6.02 2.1000 2 -2 2 2 43.16 7.46 2.0960 -1 -4 2 2 43.18 2.09 2.0951 -3 -1 1 2 43.23 1.86 2.0929 0 7 0 2 43.37 10.08 2.0865 -3 2 1 2 43.68 4.04 2.0722 3 1 1 2 43.77 11.50 2.0684 2 1 2 2 43.96 7.52 2.0597 -1 7 0 2 44.10 5.85 2.0533 -2 2 2 2 44.13 1.78 2.0524 -3 4 0 2 44.32 4.94 2.0440 -2 -2 2 2 44.49 4.38 2.0364 3 -3 1 2 44.68 2.05 2.0283 2 -3 2 2 44.73 4.07 2.0259 -2 -5 1 2 44.94 4.42 2.0169 -3 -2 1 2 45.24 2.59 2.0042 -3 3 1 2 45.50 1.41 1.9935 0 -7 1 2 45.64 7.35 1.9876 2 -6 1 2 45.74 10.11 1.9838 3 2 1 2 45.78 6.81 1.9818 1 4 2 2 46.49 6.06 1.9534 1 7 0 2 47.06 2.66 1.9309 -1 -5 2 2 47.52 1.98 1.9133 -3 -3 1 2 47.57 6.52 1.9115 -3 5 0 2 47.61 4.96 1.9098 0 7 1 2 48.30 1.06 1.8844 -1 5 2 2 48.38 2.59 1.8813 3 4 0 2 49.67 2.90 1.8356 1 -6 2 2 50.69 2.14 1.8009 2 -7 1 2 50.82 1.68 1.7966 -3 -4 1 2 51.50 6.05 1.7744 2 6 1 2 51.65 4.63 1.7697 -3 6 0 2 51.70 2.08 1.7680 0 -8 1 2 51.89 1.13 1.7622 -3 0 2 2 52.30 10.29 1.7493 -4 1 0 2 52.54 4.54 1.7417 -2 7 1 2 52.54 1.06 1.7417 4 0 0 2 52.58 1.95 1.7404 3 5 0 2 52.82 1.35 1.7332 -1 -1 3 2 52.83 2.55 1.7329 1 0 3 2 52.90 6.02 1.7308 1 8 0 2 52.93 3.67 1.7298 -1 6 2 2 53.76 1.06 1.7052 -1 -2 3 2 53.78 3.04 1.7045 0 -7 2 2 53.80 2.02 1.7040 1 1 3 2 53.90 1.22 1.7009 0 8 1 2 54.46 2.48 1.6849 1 -7 2 2 54.67 2.39 1.6788 1 -3 3 2 54.75 4.14 1.6767 -1 2 3 2 54.75 1.31 1.6765 -3 -5 1 2 55.19 1.43 1.6643 4 -1 1 2 55.38 2.95 1.6590 4 2 0 2 55.50 1.00 1.6557 3 -4 2 2 55.66 1.71 1.6513 0 -4 3 2 55.76 2.80 1.6486 0 3 3 2 56.23 1.29 1.6358 3 5 1 2 56.27 1.54 1.6349 -4 4 0 2 56.53 1.52 1.6279 -1 -7 2 2 56.81 1.30 1.6207 1 -4 3 2 56.91 2.20 1.6180 -1 3 3 2 57.04 2.13 1.6147 2 7 1 2 57.32 1.07 1.6074 3 6 0 2 57.71 1.25 1.5976 2 -1 3 2 57.73 2.16 1.5970 -2 0 3 2 57.88 4.31 1.5933 -1 -4 3 2 57.97 3.09 1.5909 1 3 3 2 58.02 1.44 1.5898 -2 -1 3 2 58.02 2.53 1.5896 2 0 3 2 58.05 1.31 1.5889 -1 7 2 2 58.14 2.90 1.5867 2 -2 3 2 58.15 3.18 1.5864 -2 8 1 2 58.19 1.95 1.5855 -2 1 3 2 58.19 1.26 1.5854 3 -5 2 2 59.23 1.43 1.5601 0 -8 2 2 59.24 1.01 1.5597 -3 -6 1 2 59.71 1.12 1.5485 1 -8 2 2 60.24 2.68 1.5363 1 7 2 2 60.45 3.87 1.5314 -3 5 2 2 60.87 6.24 1.5218 -2 -8 1 2 60.96 1.08 1.5198 -1 -5 3 2 61.53 2.42 1.5071 3 -6 2 2 61.97 1.32 1.4975 -1 -8 2 2 62.03 5.80 1.4963 2 -9 1 2 62.28 2.30 1.4908 -4 5 1 2 62.33 1.72 1.4897 -3 -5 2 2 62.45 1.60 1.4870 -4 6 0 2 63.23 2.13 1.4706 0 8 2 2 63.39 1.26 1.4673 4 -1 2 2 63.48 1.69 1.4654 -4 0 2 2 63.50 1.76 1.4651 0 10 0 2 63.51 2.06 1.4649 -4 1 2 2 63.63 1.22 1.4623 -1 10 0 2 63.64 3.25 1.4622 4 -2 2 2 64.15 2.36 1.4518 -2 9 1 2 64.16 1.69 1.4515 -4 -1 2 2 64.85 1.07 1.4377 4 5 0 2 64.90 1.49 1.4368 0 -10 1 2 65.02 1.28 1.4345 4 1 2 2 65.06 1.41 1.4337 3 5 2 2 65.87 1.85 1.4179 3 -2 3 2 65.92 1.19 1.4170 -3 1 3 2 66.01 1.12 1.4153 2 7 2 2 66.51 1.15 1.4058 0 -7 3 2 66.82 1.19 1.4000 3 -3 3 2 67.14 2.02 1.3942 -3 -2 3 2 67.17 1.41 1.3937 3 1 3 2 67.30 1.71 1.3913 0 10 1 2 67.58 2.04 1.3861 -4 -3 2 2 67.82 1.44 1.3818 -1 -9 2 2 69.36 1.32 1.3549 4 3 2 2 69.36 1.42 1.3548 0 9 2 2 69.83 1.93 1.3469 5 0 1 2 69.89 4.14 1.3460 0 -1 4 2 69.99 1.90 1.3443 -2 -6 3 2 70.02 3.76 1.3438 0 0 4 2 70.12 1.28 1.3421 2 5 3 2 70.52 1.00 1.3354 -2 10 1 2 70.75 1.59 1.3317 2 -7 3 2 70.91 2.32 1.3290 -2 6 3 2 71.95 1.54 1.3123 0 -11 1 2 72.08 1.18 1.3103 -5 -2 1 2 72.73 1.38 1.3002 -5 4 1 2 72.76 1.07 1.2998 5 2 1 2 73.69 1.04 1.2856 1 11 0 2 74.29 1.38 1.2767 -5 -3 1 2 74.30 1.87 1.2766 3 9 0 2 74.32 1.04 1.2763 -4 8 1 2 74.48 1.08 1.2740 3 4 3 2 76.65 1.26 1.2432 -2 -2 4 2 77.50 1.63 1.2317 -4 -6 2 2 77.60 1.43 1.2303 4 -9 1 2 78.99 1.58 1.2121 5 -4 2 2 80.35 1.59 1.1950 -5 4 2 2 82.95 1.22 1.1640 -5 8 0 2 83.47 1.00 1.1581 1 -7 4 2 85.53 1.35 1.1354 2 -10 3 2 86.02 1.23 1.1302 3 9 2 2 86.41 1.24 1.1261 -3 12 0 2 88.02 1.08 1.1096 -3 -10 2 2 88.90 1.03 1.1009 4 9 1 2 89.56 1.13 1.0944 -1 -8 4 2 89.78 1.29 1.0923 3 -6 4 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.