H Na3 O4.5 P Averbuch-Pouchot M, Durif A Journal of Solid State Chemistry 46 (1983) 193-196 Crystal Structure of Na3 P O4 (H2 O).5 _cod_database_code 1007097 _database_code_amcsd 0013501 CELL PARAMETERS: 9.6310 5.4160 16.9380 90.000 102.600 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 862.234 Density (g/cm3): 2.664 MAX. ABS. INTENSITY / VOLUME**2: 4.675038707 RIR: 0.571 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.70 8.59 8.2650 0 0 2 2 18.88 9.66 4.6995 2 0 0 2 18.91 26.42 4.6927 1 1 0 4 19.59 11.53 4.5321 -2 0 2 2 20.23 53.69 4.3904 1 1 1 4 20.72 19.83 4.2861 -1 1 2 4 21.50 40.04 4.1325 0 0 4 2 22.79 13.00 3.9024 1 1 2 4 23.53 4.99 3.7817 -1 1 3 4 23.73 20.75 3.7490 2 0 2 2 25.41 9.92 3.5057 -2 0 4 2 26.25 2.29 3.3948 1 1 3 4 27.16 4.05 3.2838 -1 1 4 4 30.34 5.94 2.9463 1 1 4 4 31.35 3.29 2.8529 -1 1 5 4 31.80 4.69 2.8138 2 0 4 2 32.43 73.47 2.7608 -3 1 1 4 32.50 14.11 2.7550 0 0 6 2 32.75 1.54 2.7343 -3 1 2 4 33.03 100.00 2.7120 3 1 0 4 33.08 2.30 2.7080 0 2 0 2 33.53 45.70 2.6724 0 2 1 4 33.94 33.41 2.6414 -2 0 6 2 33.98 32.88 2.6386 -3 1 3 4 34.51 6.96 2.5989 3 1 1 4 34.86 4.49 2.5734 0 2 2 4 35.96 11.49 2.4976 -1 1 6 4 36.78 5.47 2.4437 3 1 2 4 36.99 4.13 2.4303 0 2 3 4 38.15 1.88 2.3591 -2 2 1 4 38.31 1.62 2.3498 4 0 0 2 38.36 7.02 2.3463 2 2 0 4 38.74 16.06 2.3246 -2 2 2 4 39.37 8.51 2.2886 2 2 1 4 39.70 71.75 2.2703 1 1 6 4 39.72 1.01 2.2693 3 1 3 4 39.78 6.89 2.2661 -4 0 4 2 39.80 5.68 2.2650 0 2 4 4 40.10 11.75 2.2489 -2 2 3 4 40.87 1.69 2.2082 -1 1 7 4 41.12 12.98 2.1952 2 2 2 4 41.45 11.42 2.1784 2 0 6 2 42.11 23.90 2.1458 -3 1 6 4 42.17 28.73 2.1431 -2 2 4 4 42.22 1.36 2.1407 4 0 2 2 43.22 1.43 2.0933 3 1 4 4 43.85 7.56 2.0647 -2 0 8 2 44.81 18.04 2.0228 1 1 7 4 44.87 11.30 2.0201 -2 2 5 4 44.91 9.53 2.0184 -4 0 6 2 45.95 4.97 1.9752 -3 1 7 4 46.03 6.23 1.9719 -1 1 8 4 46.54 2.86 1.9512 2 2 4 4 47.05 3.84 1.9313 0 2 6 4 47.19 8.82 1.9260 3 1 5 4 48.57 3.59 1.8745 4 0 4 2 50.06 10.81 1.8220 2 2 5 4 50.14 2.73 1.8194 1 1 8 4 50.20 1.53 1.8173 -3 1 8 4 50.28 3.12 1.8148 -5 1 2 4 50.83 1.97 1.7963 -4 2 1 4 51.34 8.03 1.7798 0 2 7 4 51.41 5.31 1.7773 -1 1 9 4 51.49 3.39 1.7748 4 2 0 4 51.56 13.42 1.7726 3 1 6 4 51.85 13.84 1.7632 -2 2 7 4 52.11 2.18 1.7552 1 3 1 4 52.18 2.17 1.7528 -4 0 8 2 52.67 2.47 1.7379 -4 2 4 4 52.78 2.87 1.7346 4 2 1 4 52.98 1.73 1.7283 5 1 1 4 53.29 18.89 1.7191 -5 1 5 4 53.29 5.18 1.7190 1 3 2 4 54.02 5.79 1.6974 2 2 6 4 54.50 1.58 1.6836 -4 2 5 4 55.06 1.01 1.6678 1 3 3 4 55.48 9.60 1.6561 -5 1 6 4 55.56 12.33 1.6542 -1 3 4 4 56.01 1.55 1.6419 -2 2 8 4 56.28 2.31 1.6346 3 1 7 4 56.77 6.39 1.6217 4 0 6 2 57.39 3.38 1.6056 1 3 4 4 57.73 2.44 1.5969 5 1 3 4 58.26 3.57 1.5838 -6 0 4 2 58.68 5.58 1.5734 -3 3 1 4 58.96 5.57 1.5665 6 0 0 2 59.06 2.86 1.5642 3 3 0 4 59.77 1.38 1.5473 -3 1 10 4 59.81 1.83 1.5464 -4 2 7 4 60.01 1.16 1.5416 3 3 1 4 60.24 5.26 1.5363 1 3 5 4 60.54 3.89 1.5294 -2 2 9 4 60.97 2.77 1.5196 -1 3 6 4 61.32 2.19 1.5117 3 1 8 4 61.37 3.57 1.5107 -6 0 6 2 61.47 1.26 1.5085 1 1 10 4 61.52 3.92 1.5072 3 3 2 4 63.11 3.65 1.4731 2 2 8 4 63.19 3.08 1.4715 -4 2 8 4 63.44 2.15 1.4663 4 2 5 4 63.58 9.88 1.4635 3 3 3 4 64.47 3.32 1.4452 5 1 5 4 65.03 1.83 1.4342 -3 1 11 4 65.11 1.04 1.4327 -5 1 9 4 66.14 2.46 1.4129 3 3 4 4 66.24 1.01 1.4109 0 2 10 4 66.43 3.86 1.4074 -2 0 12 2 66.45 1.63 1.4069 4 0 8 2 67.02 1.40 1.3964 -4 2 9 4 67.48 1.75 1.3879 1 1 11 4 67.90 1.25 1.3804 -6 2 2 4 68.01 5.01 1.3785 -6 2 3 4 68.21 3.22 1.3748 -3 3 7 4 68.33 8.54 1.3727 -6 2 1 4 69.21 2.25 1.3575 -5 1 10 4 69.30 3.78 1.3560 6 2 0 4 70.66 1.62 1.3331 -2 2 11 4 70.78 4.16 1.3311 6 2 1 4 71.09 1.52 1.3261 -7 1 4 4 71.39 1.29 1.3213 -7 1 1 4 71.43 1.13 1.3207 -4 0 12 2 71.64 1.74 1.3172 -5 3 2 4 71.79 2.47 1.3149 0 4 3 4 71.85 2.82 1.3140 0 2 11 4 72.05 1.24 1.3108 -7 1 5 4 72.35 1.07 1.3061 3 1 10 4 72.57 1.15 1.3027 -1 3 9 4 72.92 1.28 1.2973 -2 4 2 4 73.62 2.98 1.2867 0 4 4 4 73.71 2.31 1.2854 -6 2 7 4 73.77 5.05 1.2845 1 1 12 4 73.87 1.04 1.2830 5 3 1 4 75.23 1.05 1.2631 -2 4 4 4 75.27 2.14 1.2625 6 2 3 4 76.15 2.71 1.2501 1 3 9 4 76.65 1.93 1.2432 3 3 7 4 78.31 1.85 1.2209 -5 3 7 4 78.35 2.68 1.2204 3 1 11 4 78.64 4.23 1.2166 -5 1 12 4 78.75 2.87 1.2152 0 4 6 4 79.67 2.56 1.2035 -3 3 10 4 80.36 2.41 1.1949 1 1 13 4 80.90 1.06 1.1882 -7 1 9 4 81.52 1.36 1.1807 0 0 14 2 81.81 3.54 1.1774 -8 0 6 2 82.20 4.38 1.1727 -2 2 13 4 82.56 1.80 1.1686 -6 0 12 2 82.76 1.07 1.1662 -3 1 14 4 83.18 1.52 1.1613 4 4 1 4 83.87 1.01 1.1535 5 3 5 4 83.98 1.74 1.1524 -5 1 13 4 84.19 1.21 1.1500 2 4 6 4 84.38 2.19 1.1479 -3 3 11 4 84.45 3.03 1.1472 -5 3 9 4 84.71 4.37 1.1443 4 4 2 4 84.73 1.10 1.1440 3 1 12 4 85.72 1.45 1.1333 7 1 5 4 85.80 1.39 1.1325 0 4 8 4 85.82 1.32 1.1323 -2 4 8 4 87.28 2.18 1.1171 -6 2 11 4 89.81 1.60 1.0921 7 1 6 4 89.99 1.98 1.0904 6 2 7 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.