Na3(MoO)4(PO4)5 Leclaire A, Hoareau T, Borel M, Grandin A, Raveau B Journal of Solid State Chemistry 114 (1995) 543-549 A sodium Mo(V) monophosphate with a tunnel structure: Na3(MoO)4(PO4)5 _cod_database_code 1001643 _database_code_amcsd 0013838 CELL PARAMETERS: 16.7890 8.5000 16.3610 90.000 126.340 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1880.731 Density (g/cm3): 3.501 MAX. ABS. INTENSITY / VOLUME**2: 21.19091498 RIR: 1.971 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.01 2.85 7.3688 -1 1 1 4 12.30 4.80 7.1966 1 1 0 4 13.09 27.53 6.7619 2 0 0 2 13.44 13.34 6.5895 0 0 2 2 15.10 31.65 5.8682 -1 1 2 4 15.78 16.50 5.6152 1 1 1 4 19.07 100.00 4.6533 -3 1 2 4 20.09 7.75 4.4204 -1 1 3 4 20.84 1.05 4.2632 -3 1 3 4 20.90 16.17 4.2500 0 2 0 2 20.95 41.12 4.2395 1 1 2 4 21.27 2.23 4.1770 -4 0 2 2 21.92 15.51 4.0557 -2 0 4 2 21.97 6.06 4.0449 0 2 1 4 23.79 1.76 3.7398 2 0 2 2 24.16 6.88 3.6844 -2 2 2 4 25.95 42.41 3.4334 -1 1 4 4 26.36 32.43 3.3809 4 0 0 2 26.56 5.38 3.3566 3 1 1 4 26.62 52.16 3.3491 -2 2 3 4 26.91 15.36 3.3136 1 1 3 4 27.06 7.27 3.2948 0 0 4 2 28.59 4.27 3.1218 -5 1 3 4 29.22 19.10 3.0561 -5 1 2 4 29.24 1.30 3.0545 0 2 3 4 29.58 3.56 3.0198 -5 1 4 4 30.00 2.36 2.9790 -4 2 2 4 30.29 9.97 2.9505 -4 2 3 4 30.47 29.48 2.9341 -2 2 4 4 31.24 8.37 2.8629 -4 2 1 4 31.38 8.43 2.8508 -5 1 1 4 32.05 1.94 2.7926 -5 1 5 4 32.09 9.50 2.7888 -4 2 4 4 32.17 4.73 2.7827 -1 3 1 4 32.20 7.06 2.7803 -6 0 4 2 32.28 4.59 2.7735 -1 1 5 4 32.28 1.74 2.7731 1 3 0 4 33.29 1.40 2.6916 1 1 4 4 33.50 2.23 2.6748 -1 3 2 4 33.54 3.78 2.6719 -6 0 2 2 33.83 18.59 2.6496 1 3 1 4 33.88 12.85 2.6459 4 2 0 4 34.81 2.79 2.5774 5 1 0 4 34.82 13.38 2.5766 -3 1 6 4 35.19 4.10 2.5500 -4 2 5 4 35.87 7.32 2.5032 -3 3 1 4 36.35 2.32 2.4715 4 0 2 2 36.65 2.01 2.4517 1 3 2 4 36.75 2.76 2.4457 2 0 4 2 36.95 1.27 2.4329 2 2 3 4 37.60 1.86 2.3924 3 1 3 4 38.66 2.11 2.3292 -6 2 3 4 38.70 1.42 2.3266 -6 2 4 4 38.91 2.43 2.3145 -1 1 6 4 39.02 3.03 2.3082 -7 1 4 4 39.22 2.33 2.2969 5 1 1 4 39.33 4.96 2.2910 -4 2 6 4 40.00 1.10 2.2540 6 0 0 2 40.26 1.61 2.2400 0 2 5 4 40.28 4.72 2.2390 3 3 1 4 40.33 2.48 2.2365 -5 1 7 4 41.35 3.11 2.1835 -7 1 6 4 41.55 6.59 2.1734 -7 1 2 4 42.19 3.16 2.1419 -3 3 5 4 42.20 3.85 2.1415 -6 2 1 4 42.40 2.00 2.1316 -6 2 6 4 42.44 2.20 2.1301 -5 3 4 4 43.12 1.07 2.0979 0 4 1 4 43.32 8.02 2.0885 -8 0 4 2 43.89 8.01 2.0630 3 1 4 4 43.97 1.54 2.0594 -2 4 1 4 44.26 3.65 2.0465 -4 2 7 4 44.28 6.88 2.0457 -5 3 5 4 44.36 1.41 2.0423 -2 4 2 4 44.38 3.62 2.0410 5 1 2 4 44.45 7.33 2.0382 -1 3 5 4 44.47 1.47 2.0371 -7 1 1 4 44.81 1.71 2.0224 0 4 2 4 44.97 1.46 2.0156 -6 0 8 2 45.55 1.18 1.9913 6 2 0 4 45.63 1.25 1.9880 -5 1 8 4 45.82 1.36 1.9802 -6 2 7 4 45.84 13.17 1.9793 -2 4 3 4 46.42 1.42 1.9561 -3 3 6 4 46.54 7.27 1.9513 0 2 6 4 46.88 2.97 1.9380 -2 2 7 4 46.90 1.35 1.9372 1 1 6 4 47.41 10.26 1.9176 -3 1 8 4 47.95 1.50 1.8971 -7 1 8 4 48.31 5.14 1.8839 7 1 0 4 48.45 5.68 1.8789 -8 2 5 4 48.57 3.77 1.8744 -8 2 4 4 49.31 1.32 1.8479 -8 0 8 2 49.98 2.19 1.8249 5 3 1 4 50.09 1.24 1.8212 -6 2 8 4 50.28 2.14 1.8146 -7 3 5 4 50.37 2.27 1.8117 -7 3 3 4 50.55 1.10 1.8056 3 1 5 4 51.28 1.02 1.7816 -8 2 7 4 51.51 1.50 1.7743 -5 1 9 4 51.75 3.04 1.7665 -7 3 6 4 51.92 1.78 1.7611 -7 3 2 4 52.92 1.70 1.7302 7 1 1 4 53.00 14.64 1.7276 2 4 3 4 53.21 4.72 1.7214 0 2 7 4 53.37 1.20 1.7167 -2 2 8 4 54.17 1.81 1.6933 -7 3 7 4 54.26 1.94 1.6905 8 0 0 2 54.30 3.25 1.6893 -6 4 3 4 54.69 1.51 1.6783 6 2 2 4 55.11 4.54 1.6665 -9 1 2 4 55.43 3.61 1.6577 1 5 1 4 56.23 1.66 1.6360 -6 0 10 2 56.39 3.02 1.6316 5 1 4 4 56.83 2.28 1.6200 -3 5 1 4 56.97 1.87 1.6166 -3 3 8 4 57.02 1.13 1.6151 -1 5 3 4 57.09 1.84 1.6134 -6 4 1 4 57.33 1.71 1.6071 -3 5 3 4 57.86 1.23 1.5937 -8 0 10 2 57.87 2.57 1.5935 -5 1 10 4 58.14 1.87 1.5866 -4 0 10 2 58.75 5.01 1.5716 -4 4 7 4 58.78 1.28 1.5708 8 2 0 4 59.75 3.70 1.5477 3 3 5 4 59.85 2.53 1.5453 -10 2 7 4 60.04 3.61 1.5410 -6 4 7 4 60.24 1.52 1.5363 6 2 3 4 60.61 6.74 1.5279 -5 3 9 4 60.92 1.31 1.5208 -2 4 7 4 61.05 2.45 1.5179 -9 1 10 4 61.11 3.53 1.5166 -5 5 3 4 61.26 2.34 1.5131 -10 0 2 2 61.41 4.17 1.5099 -10 2 8 4 61.47 1.03 1.5085 -3 5 5 4 61.49 6.18 1.5080 -9 3 3 4 61.59 3.98 1.5059 1 1 8 4 61.81 4.18 1.5010 -11 1 6 4 61.88 2.23 1.4994 7 3 1 4 62.23 2.67 1.4918 -8 4 5 4 62.48 1.03 1.4864 -4 2 10 4 62.62 3.62 1.4836 4 0 6 2 62.95 1.19 1.4765 1 3 7 4 63.08 1.07 1.4738 -5 5 5 4 63.09 1.59 1.4735 -3 3 9 4 63.22 4.30 1.4709 -1 5 5 4 63.40 1.65 1.4671 -2 0 10 2 63.81 1.20 1.4586 -10 2 9 4 64.52 1.04 1.4443 8 0 2 2 64.65 1.32 1.4417 -8 4 7 4 65.71 2.32 1.4211 -9 3 9 4 65.94 1.11 1.4167 0 6 0 2 66.33 2.09 1.4092 0 4 7 4 67.03 1.10 1.3963 -10 2 10 4 67.55 1.06 1.3868 -2 2 10 4 67.67 5.16 1.3845 5 5 1 4 68.43 1.13 1.3709 -2 6 3 4 68.63 1.66 1.3675 8 2 2 4 69.91 2.06 1.3456 -7 1 12 4 70.47 2.31 1.3362 7 1 4 4 72.32 1.36 1.3066 4 6 0 4 72.45 3.02 1.3045 -12 2 5 4 72.61 1.84 1.3021 6 4 3 4 72.78 1.21 1.2995 -5 3 11 4 74.17 2.23 1.2784 2 6 3 4 76.04 1.34 1.2516 -6 6 2 4 76.40 1.22 1.2466 6 0 6 2 77.48 1.30 1.2320 -12 0 12 2 77.78 1.18 1.2279 2 2 9 4 77.99 2.13 1.2251 7 5 1 4 80.85 2.10 1.1889 -10 4 1 4 81.48 1.44 1.1813 -9 5 9 4 81.71 1.36 1.1785 1 7 2 4 84.01 1.17 1.1520 -1 3 11 4 86.16 1.19 1.1287 5 1 8 4 86.23 1.52 1.1280 2 2 10 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.