H30 I N7 O19 P6 Averbuch-Pouchot M, Durif A European Journal of Solid State and Inorganic Chemistry 30 (1993) 447-459 (NH4)6P6O18.NH4X.H2O (X=Cl,Br,I). The first examples of cyclohexaphosphate-halides _cod_database_code 1007202 _database_code_amcsd 0012574 CELL PARAMETERS: 14.9600 24.8190 6.7100 90.000 91.860 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 2490.058 Density (g/cm3): 1.982 MAX. ABS. INTENSITY / VOLUME**2: 5.695662289 RIR: 0.936 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.26 1.59 9.5491 1 2 0 4 11.84 49.93 7.4761 2 0 0 2 13.68 11.35 6.4743 0 1 1 4 14.27 3.17 6.2048 0 4 0 2 14.30 35.36 6.1947 -1 0 1 2 14.65 27.47 6.0463 1 0 1 2 14.74 19.11 6.0103 -1 1 1 4 15.02 100.00 5.9000 0 2 1 4 15.08 14.70 5.8745 1 1 1 4 17.02 5.67 5.2097 0 3 1 4 17.84 5.84 4.9718 -2 1 1 4 17.89 9.72 4.9586 -1 3 1 4 18.17 9.76 4.8815 1 3 1 4 18.41 4.49 4.8200 2 1 1 4 19.19 60.97 4.6250 3 2 0 4 19.43 1.59 4.5684 2 2 1 4 20.26 4.84 4.3839 -1 4 1 4 20.51 39.36 4.3303 1 4 1 4 20.53 13.86 4.3257 -2 3 1 4 21.03 15.94 4.2246 2 3 1 4 21.87 27.15 4.0640 -3 0 1 2 22.17 1.60 4.0105 -3 1 1 4 22.28 16.57 3.9898 0 5 1 4 22.30 43.60 3.9867 1 6 0 4 22.57 5.78 3.9396 3 0 1 2 22.86 3.73 3.8908 3 1 1 4 22.96 9.12 3.8736 -1 5 1 4 23.18 8.91 3.8365 1 5 1 4 23.80 3.53 3.7380 4 0 0 2 24.40 14.48 3.6476 -3 3 1 4 25.04 9.57 3.5569 3 3 1 4 25.10 4.59 3.5485 -2 5 1 4 25.30 2.11 3.5207 0 6 1 4 25.51 4.95 3.4920 2 5 1 4 26.58 9.13 3.3532 0 0 2 2 26.81 54.60 3.3258 3 4 1 4 26.83 1.50 3.3230 0 1 2 4 27.17 2.80 3.2820 -4 1 1 4 27.30 3.55 3.2662 -1 1 2 4 27.69 3.45 3.2220 1 1 2 4 27.83 4.88 3.2063 -2 6 1 4 27.86 41.65 3.2019 4 4 0 4 27.89 19.49 3.1992 -4 2 1 4 27.93 3.31 3.1942 4 1 1 4 28.02 28.07 3.1845 -1 2 2 4 28.03 44.75 3.1830 3 6 0 4 28.20 24.95 3.1644 2 6 1 4 28.38 3.46 3.1445 -3 5 1 4 28.39 3.19 3.1435 1 2 2 4 28.48 1.77 3.1345 0 7 1 4 28.63 2.26 3.1176 4 2 1 4 28.73 1.75 3.1077 0 3 2 4 28.78 48.16 3.1024 0 8 0 2 28.82 24.99 3.0973 -2 0 2 2 29.02 4.96 3.0772 -1 7 1 4 29.05 11.34 3.0741 -4 3 1 4 29.05 2.38 3.0735 -2 1 2 4 29.17 2.57 3.0610 -1 3 2 4 29.53 1.48 3.0246 1 3 2 4 29.77 3.70 3.0015 4 3 1 4 29.77 1.85 3.0010 2 1 2 4 30.10 1.72 2.9690 5 1 0 4 30.30 9.23 2.9500 0 4 2 4 30.75 26.24 2.9072 5 2 0 4 30.76 4.62 2.9065 -2 7 1 4 30.83 2.28 2.9007 -2 3 2 4 31.11 2.32 2.8752 2 7 1 4 31.21 4.81 2.8654 2 8 0 4 31.51 5.22 2.8395 2 3 2 4 32.22 5.42 2.7786 0 5 2 4 32.38 10.64 2.7648 -5 0 1 2 32.51 2.99 2.7545 -4 5 1 4 32.51 7.41 2.7545 -3 2 2 4 32.59 1.91 2.7478 -5 1 1 4 32.62 5.26 2.7452 -1 5 2 4 32.87 1.66 2.7247 3 1 2 4 32.95 4.57 2.7188 1 5 2 4 32.96 25.46 2.7177 2 4 2 4 33.03 2.64 2.7119 1 9 0 4 33.40 2.44 2.6830 5 1 1 4 33.48 12.44 2.6767 3 2 2 4 33.52 4.18 2.6734 -3 3 2 4 33.54 2.46 2.6717 -3 7 1 4 34.02 1.28 2.6354 3 7 1 4 34.12 2.60 2.6277 -2 5 2 4 34.19 4.41 2.6222 -5 3 1 4 34.47 4.18 2.6021 3 3 2 4 34.67 3.95 2.5873 2 9 0 4 34.74 4.28 2.5820 2 5 2 4 34.81 15.11 2.5772 -1 6 2 4 34.88 2.25 2.5724 4 7 0 4 35.12 2.83 2.5553 1 6 2 4 35.32 4.15 2.5414 4 6 1 4 35.38 8.51 2.5374 -4 0 2 2 35.79 1.78 2.5090 1 9 1 4 36.04 6.41 2.4920 6 0 0 2 36.23 1.88 2.4796 6 1 0 4 36.43 4.07 2.4660 -3 8 1 4 36.58 1.50 2.4568 4 0 2 2 36.60 2.12 2.4552 -3 5 2 4 36.71 1.97 2.4484 1 10 0 4 36.76 1.05 2.4448 4 1 2 4 36.88 7.87 2.4373 3 8 1 4 37.06 2.50 2.4258 -4 3 2 4 37.23 2.43 2.4154 -5 5 1 4 37.40 1.12 2.4048 2 9 1 4 37.68 13.08 2.3873 4 8 0 4 37.70 1.57 2.3861 6 3 0 4 37.73 1.03 2.3841 4 7 1 4 37.95 1.20 2.3710 5 5 1 4 38.21 2.42 2.3551 4 3 2 4 38.29 2.96 2.3505 -6 1 1 4 38.59 2.14 2.3328 -3 6 2 4 38.60 1.05 2.3326 -2 7 2 4 38.68 6.77 2.3276 0 10 1 4 38.95 4.72 2.3125 6 4 0 4 39.14 2.17 2.3016 6 1 1 4 39.42 1.95 2.2859 5 7 0 4 39.70 1.35 2.2705 -6 3 1 4 39.90 1.32 2.2592 3 9 1 4 40.43 1.33 2.2310 1 11 0 4 40.61 3.11 2.2215 -1 0 3 2 40.73 4.59 2.2153 2 10 1 4 41.02 3.65 2.2005 1 0 3 2 41.18 9.22 2.1919 -2 8 2 4 41.26 2.00 2.1879 -5 3 2 4 41.72 4.98 2.1652 2 8 2 4 41.76 3.16 2.1631 5 2 2 4 41.82 2.41 2.1600 2 11 0 4 42.08 1.10 2.1475 5 7 1 4 42.26 1.28 2.1385 0 11 1 4 42.39 1.73 2.1322 -6 5 1 4 42.44 1.47 2.1299 0 9 2 4 42.46 3.52 2.1291 -2 2 3 4 42.48 1.40 2.1281 7 1 0 4 42.58 2.99 2.1231 5 3 2 4 42.65 2.85 2.1200 -1 11 1 4 42.67 1.93 2.1190 -4 9 1 4 42.76 1.57 2.1147 -1 9 2 4 43.02 2.07 2.1026 1 9 2 4 43.17 1.77 2.0955 6 5 1 4 43.19 1.62 2.0948 4 9 1 4 43.24 5.48 2.0926 2 2 3 4 43.77 3.54 2.0682 0 12 0 2 43.92 3.53 2.0617 -2 11 1 4 44.23 2.24 2.0476 -7 1 1 4 44.43 1.02 2.0388 6 7 0 4 44.45 1.15 2.0383 0 5 3 4 44.47 1.17 2.0374 2 9 2 4 44.69 1.05 2.0277 -1 5 3 4 44.89 1.68 2.0194 4 7 2 4 44.92 6.31 2.0179 6 6 1 4 44.95 3.82 2.0164 7 0 1 2 45.11 1.10 2.0098 7 1 1 4 45.61 4.65 1.9892 -5 6 2 4 45.68 1.00 1.9859 -4 10 1 4 45.77 3.88 1.9824 -1 10 2 4 45.99 2.21 1.9733 -6 3 2 4 46.01 2.28 1.9726 -3 11 1 4 46.16 1.18 1.9667 0 6 3 4 46.17 2.14 1.9660 4 10 1 4 46.22 4.23 1.9641 -4 8 2 4 46.28 1.49 1.9618 -1 12 1 4 46.34 4.86 1.9592 -3 4 3 4 46.38 1.25 1.9579 3 11 1 4 46.51 3.17 1.9525 -5 9 1 4 46.76 8.60 1.9428 6 8 0 4 46.83 1.27 1.9401 5 6 2 4 47.06 8.06 1.9311 -6 4 2 4 47.12 1.33 1.9288 5 9 1 4 47.27 4.35 1.9231 -4 2 3 4 47.41 1.85 1.9177 7 4 1 4 47.45 1.74 1.9162 6 3 2 4 47.61 2.96 1.9098 5 10 0 4 48.01 1.26 1.8949 -4 3 3 4 48.18 14.35 1.8887 2 6 3 4 48.72 2.97 1.8690 8 0 0 2 48.74 1.95 1.8682 7 5 1 4 48.77 1.59 1.8673 5 7 2 4 48.85 1.10 1.8645 -4 11 1 4 49.54 6.71 1.8398 3 10 2 4 49.65 1.53 1.8362 0 13 1 4 49.79 1.04 1.8312 3 12 1 4 50.11 1.47 1.8206 1 13 1 4 50.39 1.44 1.8109 -8 1 1 4 50.43 2.90 1.8097 4 12 0 4 50.44 3.55 1.8091 -7 2 2 4 50.53 1.53 1.8062 -1 8 3 4 50.87 2.07 1.7948 1 8 3 4 50.91 3.10 1.7935 -6 9 1 4 51.03 1.85 1.7896 8 4 0 4 51.16 1.21 1.7856 -7 3 2 4 51.43 1.26 1.7766 -5 3 3 4 51.85 3.10 1.7633 5 0 3 2 51.91 1.34 1.7613 -4 6 3 4 51.94 5.03 1.7605 1 14 0 4 52.18 1.05 1.7528 7 7 1 4 53.25 1.08 1.7204 4 6 3 4 53.26 1.99 1.7200 -2 12 2 4 53.70 1.51 1.7070 2 12 2 4 54.07 1.24 1.6961 5 4 3 4 54.90 4.05 1.6725 -7 6 2 4 54.92 1.09 1.6719 7 5 2 4 54.97 6.18 1.6703 3 14 0 4 55.31 1.36 1.6610 0 10 3 4 55.80 1.29 1.6476 -7 9 1 4 55.83 1.14 1.6467 9 2 0 4 55.89 2.38 1.6449 5 10 2 4 56.39 2.90 1.6317 7 6 2 4 56.46 2.78 1.6298 -2 10 3 4 56.54 1.22 1.6278 1 3 4 4 56.69 2.64 1.6238 6 2 3 4 56.78 1.16 1.6215 -9 1 1 4 56.87 2.61 1.6190 7 10 0 4 56.98 1.72 1.6161 -8 7 1 4 57.00 1.58 1.6157 -2 3 4 4 57.82 1.00 1.5947 8 7 1 4 57.92 3.53 1.5923 -2 4 4 4 58.07 1.08 1.5885 0 5 4 4 58.63 1.11 1.5745 1 5 4 4 58.66 1.17 1.5739 5 11 2 4 58.74 1.35 1.5718 2 4 4 4 58.82 2.27 1.5700 -7 0 3 2 58.96 1.04 1.5666 3 13 2 4 59.08 1.06 1.5636 -2 5 4 4 59.18 2.54 1.5612 -1 14 2 4 59.66 1.52 1.5498 9 4 1 4 60.01 5.88 1.5417 9 6 0 4 60.38 2.69 1.5330 5 8 3 4 60.44 1.67 1.5317 -4 10 3 4 61.98 1.76 1.4972 -9 2 2 4 62.60 1.21 1.4839 6 11 2 4 62.92 2.19 1.4772 -9 7 1 4 63.16 2.60 1.4722 -7 10 2 4 63.18 1.02 1.4718 4 15 1 4 64.55 1.88 1.4438 7 12 1 4 64.57 1.70 1.4433 3 16 1 4 65.09 1.00 1.4330 5 2 4 4 65.11 3.49 1.4327 4 16 0 4 65.64 2.11 1.4224 9 8 1 4 65.71 1.02 1.4210 -5 5 4 4 65.88 1.17 1.4177 -6 14 1 4 66.46 1.02 1.4067 6 14 1 4 66.69 1.18 1.4025 8 2 3 4 66.78 1.73 1.4009 -7 8 3 4 66.99 1.99 1.3969 -5 14 2 4 67.55 1.07 1.3867 8 12 0 4 67.66 1.50 1.3848 -10 6 1 4 67.92 4.23 1.3801 2 16 2 4 67.95 1.14 1.3796 5 14 2 4 68.66 2.61 1.3670 6 10 3 4 69.02 5.18 1.3607 2 14 3 4 69.20 1.66 1.3576 -10 7 1 4 69.69 1.69 1.3493 -10 4 2 4 70.13 1.60 1.3418 5 12 3 4 70.25 1.52 1.3398 -1 0 5 2 70.72 1.61 1.3321 1 0 5 2 71.66 1.48 1.3169 6 16 0 4 73.47 1.65 1.2889 -9 10 2 4 73.75 1.70 1.2847 9 4 3 4 74.35 2.02 1.2759 0 6 5 4 74.55 1.25 1.2728 -7 14 2 4 74.62 1.05 1.2718 -1 16 3 4 75.15 1.91 1.2642 -2 6 5 4 75.26 1.09 1.2627 -10 8 2 4 75.83 1.38 1.2546 7 14 2 4 76.44 1.11 1.2460 12 0 0 2 76.64 2.36 1.2434 4 2 5 4 76.81 1.97 1.2409 0 20 0 2 76.87 1.19 1.2402 -3 16 3 4 77.85 1.67 1.2270 8 10 3 4 78.77 1.31 1.2150 -5 4 5 4 78.98 1.38 1.2122 9 14 0 4 78.99 1.64 1.2121 12 2 1 4 79.39 1.22 1.2070 -10 6 3 4 83.63 1.36 1.1562 12 8 0 4 84.14 1.24 1.1506 -5 8 5 4 84.25 1.10 1.1493 -10 12 2 4 85.71 1.05 1.1335 -7 4 5 4 85.91 1.24 1.1314 -10 14 1 4 86.41 1.10 1.1260 11 4 3 4 87.37 1.28 1.1162 4 10 5 4 87.51 1.15 1.1148 -4 20 2 4 89.67 1.31 1.0934 12 10 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.