Cs3 Mn3 O16 V4 le Page Y, Strobel P Inorganic Chemistry 21 (1982) 620-623 Crystal Structure of a New Cesium Manganese Vanadium Oxide, Cs3Mn3V4O16 _cod_database_code 1008179 _database_code_amcsd 0016116 CELL PARAMETERS: 5.1947 7.5017 11.4367 77.700 89.720 82.620 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 431.724 Density (g/cm3): 3.935 MAX. ABS. INTENSITY / VOLUME**2: 19.87478660 RIR: 1.644 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 7.91 26.89 11.1712 0 0 1 2 12.18 13.43 7.2669 0 1 0 2 13.03 7.88 6.7927 0 1 1 2 15.87 18.19 5.5856 0 0 2 2 17.22 6.69 5.1503 1 0 0 2 18.80 3.65 4.7190 -1 0 1 2 19.79 10.84 4.4871 1 1 0 2 20.49 18.73 4.3351 1 1 1 2 22.16 40.42 4.0112 -1 -1 1 2 22.42 9.86 3.9651 -1 1 0 2 22.76 8.13 3.9063 -1 1 1 2 23.22 67.19 3.8309 -1 0 2 2 23.77 78.76 3.7433 1 0 2 2 23.90 13.38 3.7237 0 0 3 2 24.01 1.51 3.7068 1 1 2 2 24.08 24.57 3.6960 0 2 1 2 24.82 1.81 3.5875 1 -1 1 2 25.74 35.16 3.4608 -1 1 2 2 26.24 2.29 3.3963 0 2 2 2 26.84 2.21 3.3212 -1 -1 2 2 27.39 100.00 3.2562 0 -2 1 2 27.90 75.27 3.1981 1 2 1 2 28.15 1.65 3.1701 1 2 0 2 29.20 9.72 3.0587 0 -1 3 2 29.33 25.71 3.0454 1 -1 2 2 29.40 36.02 3.0376 1 1 3 2 29.91 6.14 2.9872 1 2 2 2 29.94 6.60 2.9849 1 0 3 2 30.47 57.56 2.9335 0 2 3 2 31.51 45.04 2.8394 -1 2 1 2 31.77 9.32 2.8167 0 1 4 2 32.05 31.45 2.7928 0 0 4 2 32.14 1.47 2.7853 0 -2 2 2 32.93 24.25 2.7197 -1 -1 3 2 33.82 2.22 2.6501 1 2 3 2 34.35 1.97 2.6104 1 -2 1 2 34.84 21.75 2.5751 2 0 0 2 34.87 2.21 2.5730 -1 -2 2 2 35.22 7.75 2.5485 1 -1 3 2 35.43 11.28 2.5335 2 1 0 2 35.60 9.28 2.5222 -2 0 1 2 35.94 5.56 2.4988 2 1 1 2 35.97 1.11 2.4967 2 0 1 2 36.12 3.23 2.4865 0 2 4 2 36.78 10.69 2.4436 -2 -1 1 2 36.78 37.39 2.4435 -1 1 4 2 36.97 1.29 2.4315 1 0 4 2 37.12 1.28 2.4223 0 3 0 2 38.13 3.52 2.3601 0 -2 3 2 38.21 1.48 2.3556 1 3 1 2 38.24 2.88 2.3536 2 1 2 2 38.42 9.45 2.3430 1 -2 2 2 38.59 13.27 2.3333 -2 1 0 2 38.97 6.88 2.3111 1 3 0 2 39.13 1.31 2.3019 1 2 4 2 39.19 5.06 2.2988 1 3 2 2 39.58 1.04 2.2770 0 1 5 2 39.83 2.82 2.2635 -2 -1 2 2 39.89 1.28 2.2602 -1 -1 4 2 40.10 7.27 2.2488 2 2 1 2 40.18 6.64 2.2441 2 -1 1 2 40.19 5.50 2.2435 2 2 0 2 40.43 7.20 2.2312 -1 -2 3 2 40.54 4.20 2.2253 -2 1 2 2 41.39 3.85 2.1814 -1 2 4 2 41.67 6.27 2.1676 2 2 2 2 41.95 6.19 2.1535 -2 -2 1 2 42.01 10.06 2.1509 1 -1 4 2 42.08 5.68 2.1471 2 1 3 2 42.44 7.43 2.1300 -1 3 1 2 42.73 1.62 2.1162 0 2 5 2 43.16 1.73 2.0959 1 1 5 2 43.35 5.98 2.0874 2 -1 2 2 43.75 2.19 2.0691 1 -2 3 2 43.79 2.98 2.0673 -1 0 5 2 43.81 2.36 2.0666 0 -3 2 2 43.90 1.56 2.0623 -2 1 3 2 44.27 8.39 2.0459 -2 -1 3 2 44.58 4.88 2.0325 1 0 5 2 44.76 4.87 2.0246 2 2 3 2 44.93 3.34 2.0176 0 -1 5 2 44.98 1.51 2.0155 0 -2 4 2 45.21 2.43 2.0056 -2 -2 2 2 45.28 12.88 2.0027 -1 -3 2 2 45.45 8.66 1.9956 1 2 5 2 45.46 3.20 1.9950 -1 3 3 2 45.70 4.89 1.9854 1 -3 1 2 45.85 5.91 1.9790 1 3 4 2 46.50 1.41 1.9531 -2 2 2 2 47.45 8.05 1.9162 -1 -1 5 2 47.53 6.71 1.9132 2 3 1 2 47.65 7.68 1.9083 2 -2 1 2 47.76 1.73 1.9043 0 1 6 2 48.10 1.49 1.8918 2 3 0 2 48.54 6.25 1.8754 -2 1 4 2 48.65 6.46 1.8717 2 0 4 2 48.92 2.96 1.8619 0 0 6 2 49.06 4.83 1.8568 -2 2 3 2 49.20 1.49 1.8518 0 3 5 2 49.31 15.31 1.8480 0 4 2 2 49.45 4.69 1.8432 1 -3 2 2 50.05 1.84 1.8226 1 -2 4 2 50.22 2.03 1.8167 0 4 0 2 50.33 1.31 1.8129 1 4 2 2 51.05 3.70 1.7890 1 3 5 2 51.08 6.83 1.7880 1 4 0 2 51.33 4.54 1.7801 -1 1 6 2 51.83 2.59 1.7641 -1 0 6 2 52.47 8.69 1.7438 0 -2 5 2 52.66 7.12 1.7381 1 0 6 2 52.75 1.54 1.7353 0 -4 1 2 53.24 4.88 1.7205 2 1 5 2 53.38 4.37 1.7164 2 -1 4 2 53.42 5.50 1.7152 -2 -3 2 2 53.64 2.55 1.7088 3 1 1 2 53.69 2.87 1.7073 -2 0 5 2 53.95 9.47 1.6996 -1 3 5 2 54.00 1.87 1.6982 0 4 4 2 54.12 1.61 1.6947 -3 -1 1 2 54.25 2.52 1.6910 3 0 1 2 54.33 4.91 1.6885 2 3 4 2 54.36 4.87 1.6878 1 -3 3 2 55.09 3.79 1.6671 1 4 4 2 55.12 3.07 1.6662 -2 3 2 2 55.27 1.23 1.6622 0 -3 4 2 55.81 4.91 1.6472 -1 4 0 2 56.20 3.82 1.6369 3 2 0 2 56.29 2.56 1.6342 -2 -1 5 2 56.31 1.03 1.6338 0 1 7 2 56.38 4.20 1.6318 -1 -3 4 2 56.52 3.12 1.6281 0 -4 2 2 56.68 1.83 1.6241 -3 1 0 2 56.98 3.10 1.6162 -2 3 3 2 57.11 1.16 1.6127 1 -2 5 2 57.20 3.41 1.6105 1 3 6 2 57.28 5.15 1.6084 2 4 1 2 57.44 3.78 1.6044 2 -3 1 2 57.65 4.23 1.5990 2 4 2 2 57.92 10.06 1.5921 0 2 7 2 58.03 2.47 1.5895 -3 1 2 2 58.43 7.37 1.5794 3 1 3 2 58.69 2.35 1.5730 -3 0 3 2 59.09 2.35 1.5634 -1 4 4 2 59.29 2.51 1.5586 1 4 5 2 59.79 5.95 1.5467 -3 -1 3 2 60.02 1.22 1.5413 3 2 3 2 60.32 1.40 1.5345 -1 0 7 2 60.47 4.78 1.5311 3 -1 2 2 60.54 1.37 1.5294 0 -2 6 2 60.80 2.59 1.5236 -2 1 6 2 61.96 1.46 1.4977 -1 -4 3 2 62.05 1.94 1.4957 3 3 0 2 62.45 2.16 1.4870 3 3 2 2 62.88 3.94 1.4779 -3 0 4 2 62.95 1.26 1.4765 1 5 1 2 63.28 1.99 1.4697 -3 2 2 2 63.39 1.93 1.4673 -2 -3 4 2 63.42 3.05 1.4668 0 4 6 2 64.08 1.62 1.4531 -1 -1 7 2 64.28 2.29 1.4492 -2 3 5 2 64.31 3.45 1.4486 -3 1 4 2 64.35 3.18 1.4476 3 0 4 2 64.76 1.81 1.4395 2 3 6 2 65.13 2.04 1.4323 2 -3 3 2 65.32 1.31 1.4285 -3 2 3 2 65.68 1.08 1.4216 -2 4 1 2 65.78 5.88 1.4197 -2 4 2 2 66.45 1.97 1.4069 -1 3 7 2 66.50 1.50 1.4060 -3 -3 2 2 66.54 1.94 1.4052 1 -4 3 2 66.65 1.18 1.4033 0 -5 1 2 66.80 5.00 1.4005 -1 -5 1 2 67.02 7.37 1.3964 0 0 8 2 67.07 1.07 1.3955 -2 4 3 2 67.22 4.16 1.3927 2 -2 5 2 67.22 1.73 1.3926 0 -4 4 2 67.66 2.33 1.3847 3 3 4 2 67.80 3.27 1.3823 3 1 5 2 68.12 1.22 1.3765 -1 1 8 2 68.18 1.90 1.3754 -2 -4 3 2 68.19 3.93 1.3753 2 2 7 2 68.57 1.55 1.3685 -3 -2 4 2 68.85 1.05 1.3636 2 5 1 2 68.88 3.13 1.3632 3 -1 4 2 69.07 4.24 1.3598 -2 -2 6 2 69.18 1.06 1.3580 0 -2 7 2 69.45 2.69 1.3534 -1 5 0 2 69.65 2.58 1.3500 1 5 5 2 69.88 1.61 1.3460 -3 -1 5 2 70.49 1.36 1.3359 -1 -2 7 2 70.63 1.20 1.3337 -3 3 1 2 70.86 2.41 1.3299 -1 5 4 2 71.15 1.40 1.3251 2 4 6 2 71.53 1.27 1.3191 3 4 3 2 72.17 1.43 1.3089 2 5 4 2 72.22 1.42 1.3081 1 -4 4 2 72.29 1.55 1.3070 -3 -4 1 2 72.41 1.38 1.3052 2 -4 2 2 73.24 1.68 1.2924 3 -3 1 2 73.30 3.07 1.2915 1 -2 7 2 73.59 1.06 1.2872 0 5 6 2 73.90 4.10 1.2825 -4 0 1 2 74.36 1.24 1.2757 4 0 1 2 74.37 1.21 1.2755 -1 -4 5 2 75.11 1.47 1.2648 -1 -5 3 2 75.71 1.16 1.2563 -2 3 7 2 76.20 2.19 1.2494 4 2 2 2 76.32 1.04 1.2478 3 0 6 2 77.21 1.29 1.2356 3 3 6 2 77.42 1.87 1.2327 0 6 1 2 77.47 2.26 1.2320 0 6 3 2 77.61 3.10 1.2301 1 2 9 2 77.78 2.74 1.2279 1 4 8 2 78.24 2.53 1.2218 -4 -2 2 2 78.25 1.63 1.2218 -2 2 8 2 78.54 1.14 1.2179 -1 2 9 2 78.71 2.43 1.2158 2 0 8 2 79.05 1.18 1.2113 -3 3 5 2 80.28 1.34 1.1958 3 -3 3 2 80.40 1.04 1.1944 -2 -5 3 2 81.37 1.86 1.1826 -3 0 7 2 81.58 1.07 1.1801 0 -4 6 2 82.72 1.61 1.1667 -4 2 0 2 82.81 1.50 1.1657 -1 6 3 2 83.03 1.42 1.1631 -4 2 2 2 83.10 1.59 1.1624 -3 -5 1 2 86.15 2.93 1.1288 4 4 1 2 86.19 1.27 1.1284 -2 0 9 2 86.33 1.53 1.1269 -4 0 5 2 86.41 1.17 1.1260 3 5 5 2 87.72 1.08 1.1126 -4 2 4 2 90.00 1.14 1.0903 -1 5 8 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.