Cl H30 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 1007201 _database_code_amcsd 0012573 CELL PARAMETERS: 6.7380 10.1010 19.3300 101.480 90.840 107.310 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 1227.054 Density (g/cm3): 1.758 MAX. ABS. INTENSITY / VOLUME**2: 3.332602883 RIR: 0.617 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.37 48.28 9.4421 0 0 2 2 9.39 45.37 9.4221 0 1 0 2 11.77 19.34 7.5183 0 -1 2 2 14.23 100.00 6.2237 -1 0 1 2 14.59 97.20 6.0695 1 -1 1 2 14.63 5.87 6.0555 0 1 2 2 14.94 58.50 5.9313 1 0 1 2 15.17 63.14 5.8394 -1 1 1 2 18.80 17.28 4.7210 0 0 4 2 18.84 23.65 4.7110 0 2 0 2 19.15 20.53 4.6348 0 -1 4 2 19.18 16.73 4.6277 0 -2 2 2 19.67 3.50 4.5141 -1 2 0 2 19.76 1.37 4.4924 -1 -1 2 2 20.30 1.08 4.3754 1 1 1 2 20.54 20.18 4.3247 1 0 3 2 20.90 18.09 4.2499 -1 2 1 2 21.75 36.74 4.0869 -1 -1 3 2 22.47 1.75 3.9573 1 -2 3 2 22.49 4.52 3.9538 -1 0 4 2 22.55 4.28 3.9422 1 1 2 2 22.80 7.15 3.9011 0 1 4 2 22.82 8.26 3.8968 0 2 2 2 22.83 5.16 3.8944 1 -1 4 2 23.07 4.68 3.8558 -1 2 2 2 23.67 29.69 3.7592 0 -2 4 2 24.28 1.31 3.6662 1 0 4 2 25.52 7.15 3.4908 1 1 3 2 25.94 2.61 3.4346 -1 2 3 2 26.48 36.62 3.3665 -2 1 0 2 26.55 5.36 3.3576 -1 -2 2 2 26.76 22.21 3.3318 1 -1 5 2 26.87 1.30 3.3182 -2 1 1 2 26.93 2.18 3.3104 2 -1 1 2 27.07 26.36 3.2938 1 -3 1 2 27.25 1.45 3.2731 0 1 5 2 27.45 3.21 3.2495 1 -3 2 2 27.73 17.50 3.2170 -1 -2 3 2 27.82 8.57 3.2064 2 0 0 2 27.83 18.59 3.2052 -1 -1 5 2 27.85 1.25 3.2031 -2 0 1 2 27.91 18.45 3.1969 0 -1 6 2 27.96 15.07 3.1907 0 -3 2 2 28.01 1.73 3.1851 1 2 1 2 28.08 7.36 3.1778 -2 1 2 2 28.36 35.51 3.1475 1 0 5 2 28.36 17.46 3.1474 0 0 6 2 28.36 3.42 3.1467 -1 1 5 2 28.42 19.77 3.1407 0 3 0 2 28.56 1.78 3.1258 2 -2 1 2 28.69 17.93 3.1118 -2 0 2 2 28.78 33.05 3.1019 -1 3 1 2 29.50 40.23 3.0278 0 2 4 2 30.05 1.22 2.9738 1 2 2 2 30.13 1.69 2.9656 2 0 2 2 30.61 10.37 2.9202 0 -2 6 2 30.65 8.39 2.9172 0 -3 4 2 30.96 1.21 2.8887 1 -1 6 2 31.84 2.70 2.8101 -2 -1 1 2 32.13 2.14 2.7860 2 1 0 2 32.19 17.97 2.7809 -1 -2 5 2 32.32 2.69 2.7700 2 0 3 2 32.52 1.51 2.7534 0 -1 7 2 32.56 3.07 2.7498 -2 1 4 2 32.68 3.68 2.7401 1 2 3 2 32.72 4.21 2.7368 -2 2 3 2 32.78 13.72 2.7323 2 -1 4 2 32.82 1.87 2.7284 1 1 5 2 32.98 2.03 2.7160 0 -3 5 2 33.03 1.49 2.7121 1 -3 5 2 33.03 4.35 2.7119 2 -3 1 2 33.11 3.10 2.7053 2 1 1 2 33.21 1.19 2.6977 0 0 7 2 33.25 11.02 2.6944 -2 3 0 2 33.27 4.19 2.6932 2 -2 4 2 33.30 1.50 2.6907 -1 3 3 2 33.42 1.76 2.6811 0 2 5 2 33.51 3.73 2.6744 2 -3 2 2 34.16 3.64 2.6249 -2 3 1 2 34.52 6.29 2.5979 0 3 3 2 34.62 3.04 2.5912 0 -2 7 2 34.75 4.79 2.5815 2 1 2 2 35.18 5.74 2.5508 -2 -1 4 2 35.26 4.21 2.5455 -2 0 5 2 35.37 5.05 2.5374 -2 2 4 2 35.60 2.08 2.5216 -2 1 5 2 35.83 2.06 2.5061 0 -3 6 2 36.03 1.46 2.4929 1 -3 6 2 36.03 1.71 2.4928 2 -2 5 2 36.55 3.15 2.4586 0 1 7 2 36.78 2.70 2.4438 1 3 1 2 37.12 3.87 2.4220 -1 1 7 2 37.16 1.38 2.4193 1 0 7 2 37.46 3.49 2.4011 0 -4 1 2 37.63 2.87 2.3903 -1 4 1 2 38.00 1.19 2.3680 -2 -2 1 2 38.11 4.00 2.3613 -2 -2 2 2 38.12 5.32 2.3605 0 0 8 2 38.21 3.98 2.3555 0 4 0 2 38.46 3.99 2.3404 -2 0 6 2 38.84 2.03 2.3189 -2 -2 3 2 38.86 1.10 2.3174 0 -2 8 2 38.92 1.13 2.3139 0 -4 4 2 39.23 1.28 2.2966 2 -2 6 2 39.30 2.49 2.2927 1 2 5 2 39.32 1.09 2.2914 2 -1 6 2 39.43 1.05 2.2852 1 -3 7 2 39.67 3.90 2.2721 2 1 4 2 39.78 2.30 2.2660 -1 3 5 2 39.94 1.24 2.2570 -2 4 0 2 40.40 2.20 2.2326 2 -4 3 2 40.43 2.98 2.2309 -2 3 4 2 40.44 1.70 2.2307 -3 1 1 2 40.59 3.36 2.2226 0 -4 5 2 40.85 1.62 2.2089 3 -2 1 2 41.27 1.35 2.1877 2 2 2 2 41.28 1.71 2.1872 1 1 7 2 41.36 1.09 2.1827 0 1 8 2 41.44 1.40 2.1790 0 4 2 2 41.77 1.36 2.1624 2 0 6 2 41.79 1.62 2.1616 -1 4 3 2 41.97 1.45 2.1528 -2 2 6 2 41.99 3.90 2.1517 0 2 7 2 42.08 1.68 2.1474 0 -1 9 2 42.79 1.22 2.1131 2 1 5 2 42.96 1.14 2.1053 3 -2 3 2 43.11 1.32 2.0982 0 0 9 2 43.47 1.19 2.0818 -2 3 5 2 43.52 3.36 2.0797 -2 -1 7 2 43.63 1.49 2.0746 -3 0 3 2 43.81 2.65 2.0663 0 4 3 2 43.85 1.66 2.0646 -1 -4 2 2 43.89 2.13 2.0630 1 3 4 2 44.17 1.23 2.0502 3 0 2 2 44.62 1.04 2.0309 -2 4 3 2 44.65 3.52 2.0296 1 -1 9 2 44.68 1.78 2.0281 2 -3 7 2 44.71 1.78 2.0268 1 -4 7 2 44.85 2.41 2.0210 1 -2 9 2 44.91 1.66 2.0185 0 3 6 2 45.09 1.07 2.0108 1 -5 1 2 45.19 2.80 2.0064 1 -5 3 2 46.02 1.55 1.9723 -3 -1 1 2 46.18 1.01 1.9656 1 4 1 2 46.25 1.06 1.9629 2 3 0 2 46.50 1.66 1.9530 -3 1 5 2 46.52 1.11 1.9522 -1 1 9 2 46.66 1.85 1.9468 0 -3 9 2 46.79 2.27 1.9417 -2 -3 4 2 46.94 1.17 1.9357 -3 -1 3 2 47.02 2.06 1.9326 0 -1 10 2 47.07 2.64 1.9307 -2 -1 8 2 47.12 2.30 1.9285 0 -5 2 2 47.17 1.13 1.9267 -3 0 5 2 47.45 1.05 1.9159 0 -5 1 2 47.91 6.70 1.8988 3 -1 5 2 47.93 1.97 1.8981 0 -2 10 2 48.02 2.48 1.8946 0 -5 4 2 48.21 1.18 1.8875 -2 -3 5 2 48.43 3.35 1.8796 0 -4 8 2 48.55 1.15 1.8752 3 1 2 2 48.67 6.46 1.8707 -3 4 1 2 48.77 1.19 1.8671 -3 3 4 2 49.21 1.22 1.8516 -1 0 10 2 49.63 1.11 1.8370 -3 0 6 2 49.74 2.99 1.8331 2 0 8 2 49.88 1.13 1.8284 -3 -1 5 2 50.52 1.20 1.8067 -1 -4 7 2 50.56 1.00 1.8051 -1 -3 9 2 50.60 2.30 1.8038 -2 5 2 2 50.86 1.09 1.7955 3 -3 6 2 51.63 1.75 1.7704 3 -4 5 2 53.28 1.32 1.7192 0 3 8 2 53.31 1.53 1.7184 0 4 6 2 53.54 1.27 1.7116 -1 -5 2 2 53.72 1.05 1.7063 -2 -2 9 2 54.67 1.56 1.6788 -2 -4 4 2 55.16 2.38 1.6651 -2 -3 8 2 55.54 2.57 1.6545 -4 1 2 2 56.07 2.00 1.6403 1 2 9 2 56.13 1.81 1.6387 2 -3 10 2 56.21 1.20 1.6365 0 2 10 2 56.29 1.90 1.6344 0 5 4 2 56.64 1.31 1.6251 -1 5 5 2 56.65 1.33 1.6248 2 -6 4 2 56.83 1.18 1.6201 -2 6 0 2 57.48 1.81 1.6032 4 0 0 2 58.05 2.10 1.5889 -4 2 4 2 58.32 1.69 1.5821 4 -2 4 2 58.47 2.09 1.5786 -3 -2 7 2 58.91 1.80 1.5677 -4 4 0 2 59.22 1.13 1.5604 4 0 2 2 59.87 2.89 1.5449 0 -3 12 2 59.97 2.06 1.5426 0 -6 6 2 60.06 1.94 1.5405 -4 3 4 2 61.07 1.10 1.5174 4 -4 4 2 61.55 1.13 1.5068 3 -1 9 2 62.66 1.52 1.4826 -3 6 1 2 63.58 1.10 1.4635 -2 -5 4 2 64.98 1.16 1.4351 4 -5 4 2 65.89 1.45 1.4176 -1 -6 6 2 65.91 1.06 1.4171 -2 -2 12 2 66.54 1.63 1.4053 0 2 12 2 66.65 1.32 1.4032 0 6 4 2 66.75 1.17 1.4014 1 6 1 2 67.07 1.32 1.3955 -1 1 13 2 67.56 1.24 1.3865 -4 -2 4 2 68.05 1.36 1.3778 -4 0 8 2 68.30 1.10 1.3733 1 -4 13 2 68.48 1.19 1.3702 3 -2 11 2 68.82 1.64 1.3642 2 2 10 2 69.34 2.81 1.3552 3 1 9 2 69.92 1.53 1.3453 -2 6 6 2 69.93 1.47 1.3453 -5 2 1 2 70.41 1.43 1.3373 5 -3 1 2 70.59 1.07 1.3342 4 -1 8 2 70.76 1.98 1.3315 -3 6 5 2 70.79 1.27 1.3309 1 -6 11 2 71.53 1.27 1.3191 3 -6 9 2 71.94 1.03 1.3125 -4 6 2 2 73.63 1.11 1.2865 -5 0 1 2 74.25 1.03 1.2773 -5 2 5 2 75.94 1.08 1.2531 0 -6 12 2 76.15 1.27 1.2500 5 -4 5 2 76.48 1.08 1.2455 5 -5 3 2 77.26 1.02 1.2349 -2 8 0 2 79.07 1.54 1.2111 0 5 10 2 86.52 1.08 1.1249 -1 -8 3 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.