CsIn2(PO4)(HPO4)2*2H2O Dhingra S S, Haushalter R C Journal of Solid State Chemistry 112 (1994) 96-99 Synthesis and crystal structure of the octahedral-tetrahedral framework indium phosphate Cs[In2(PO4)(HPO4)2(H2O)2] _database_code_amcsd 0013823 CELL PARAMETERS: 6.5800 18.0920 10.1800 90.000 97.920 90.000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1200.322 Density (g/cm3): 3.806 MAX. ABS. INTENSITY / VOLUME**2: 19.51991872 RIR: 1.670 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.78 2.40 9.0460 0 2 0 2 10.04 13.31 8.8075 0 1 1 4 13.15 19.87 6.7333 0 2 1 4 14.45 10.60 6.1315 1 1 0 4 15.91 1.99 5.5692 -1 1 1 4 17.13 7.48 5.1756 0 3 1 4 17.59 3.77 5.0414 0 0 2 2 17.88 10.81 4.9612 1 1 1 4 18.05 12.65 4.9143 -1 2 1 4 18.27 6.63 4.8564 0 1 2 4 19.63 1.09 4.5230 0 4 0 2 19.81 10.65 4.4814 1 2 1 4 20.06 39.68 4.4264 1 3 0 4 20.16 34.75 4.4037 0 2 2 4 20.74 1.92 4.2835 -1 0 2 2 21.15 20.41 4.2003 -1 3 1 4 21.32 57.35 4.1683 -1 1 2 4 21.53 32.59 4.1268 0 4 1 4 22.68 1.95 3.9202 1 3 1 4 22.97 2.45 3.8714 -1 2 2 4 22.99 73.80 3.8679 0 3 2 4 23.75 12.22 3.7457 1 0 2 2 24.27 37.49 3.6679 1 1 2 4 24.88 56.43 3.5790 -1 4 1 4 25.74 2.59 3.4607 1 2 2 4 26.17 25.72 3.4057 0 5 1 4 26.20 23.12 3.4010 1 4 1 4 26.47 4.66 3.3667 0 4 2 4 27.37 100.00 3.2586 2 0 0 2 27.82 22.35 3.2070 2 1 0 4 28.03 13.55 3.1834 -2 1 1 4 28.33 1.60 3.1505 0 2 3 4 28.70 1.14 3.1101 -1 4 2 4 29.33 3.66 3.0451 -2 2 1 4 29.63 7.29 3.0153 0 6 0 2 29.86 1.03 2.9920 -1 2 3 4 30.17 6.90 2.9624 1 5 1 4 30.45 88.18 2.9358 0 3 3 4 30.95 9.17 2.8892 -2 1 2 4 30.95 33.07 2.8889 0 6 1 4 31.00 2.99 2.8849 1 4 2 4 31.58 1.08 2.8328 2 2 1 4 31.89 15.27 2.8062 -1 3 3 4 32.14 13.54 2.7846 -2 2 2 4 33.43 16.59 2.6806 -1 6 1 4 34.05 7.21 2.6330 -2 3 2 4 34.45 2.89 2.6033 1 6 1 4 34.46 1.11 2.6024 1 5 2 4 34.55 1.40 2.5961 -1 4 3 4 34.78 1.07 2.5795 2 0 2 2 35.00 9.86 2.5637 1 3 3 4 35.14 2.14 2.5536 2 1 2 4 35.87 8.28 2.5036 0 7 1 4 35.97 12.64 2.4966 0 1 4 4 36.07 14.19 2.4901 2 4 1 4 36.21 1.39 2.4806 2 2 2 4 36.49 1.36 2.4625 0 5 3 4 36.57 5.12 2.4572 -2 4 2 4 36.75 9.03 2.4456 -1 1 4 4 37.02 4.70 2.4282 0 2 4 4 37.04 2.58 2.4271 -2 2 3 4 37.13 1.34 2.4214 2 5 0 4 37.29 9.47 2.4112 -2 5 1 4 37.46 4.88 2.4005 1 4 3 4 37.78 2.23 2.3812 -1 2 4 4 37.94 10.54 2.3716 2 3 2 4 38.06 1.88 2.3643 -1 7 1 4 38.32 2.58 2.3488 1 6 2 4 38.72 6.16 2.3257 0 3 4 4 38.73 19.09 2.3247 -2 3 3 4 38.98 13.77 2.3108 1 7 1 4 39.14 7.97 2.3016 2 5 1 4 39.17 1.23 2.2999 0 7 2 4 39.45 1.16 2.2843 -1 3 4 4 40.18 8.15 2.2444 0 6 3 4 40.41 1.97 2.2319 1 1 4 4 40.44 2.13 2.2303 1 5 3 4 40.77 1.46 2.2132 2 6 0 4 40.78 2.05 2.2129 -1 7 2 4 40.92 6.03 2.2054 -2 6 1 4 41.01 2.31 2.2010 -2 4 3 4 41.32 27.93 2.1849 -1 6 3 4 41.37 7.10 2.1826 1 2 4 4 41.69 1.13 2.1666 -1 4 4 4 41.88 1.81 2.1569 3 1 0 4 42.40 3.80 2.1316 2 2 3 4 42.49 3.75 2.1273 1 7 2 4 42.50 3.09 2.1269 -2 1 4 4 42.64 2.79 2.1206 2 6 1 4 43.31 15.83 2.0891 -3 1 2 4 43.42 5.87 2.0841 -2 2 4 4 43.85 28.27 2.0644 1 6 3 4 43.93 12.62 2.0613 2 3 3 4 44.05 10.13 2.0557 -3 3 1 4 44.12 2.60 2.0525 3 1 1 4 44.21 6.31 2.0488 0 7 3 4 44.21 4.77 2.0485 -3 2 2 4 44.32 6.82 2.0438 3 3 0 4 44.91 3.45 2.0182 -2 3 4 4 45.01 2.81 2.0140 3 2 1 4 45.02 1.43 2.0138 1 4 4 4 45.25 1.32 2.0042 0 1 5 4 45.69 1.09 1.9859 -3 3 2 4 46.11 4.61 1.9686 -3 4 1 4 46.36 1.83 1.9585 -1 2 5 4 46.37 1.42 1.9582 3 4 0 4 46.49 4.53 1.9533 2 7 1 4 46.90 2.27 1.9373 -2 7 2 4 47.32 10.77 1.9209 1 9 0 4 47.54 2.88 1.9125 0 3 5 4 47.61 1.09 1.9101 1 5 4 4 47.68 1.56 1.9073 -3 2 3 4 47.78 1.02 1.9035 -1 3 5 4 47.82 3.59 1.9021 3 0 2 2 48.10 1.95 1.8917 3 1 2 4 48.44 2.17 1.8791 3 4 1 4 48.65 2.48 1.8714 -3 5 1 4 48.77 12.32 1.8673 0 9 2 4 48.89 3.57 1.8629 2 1 4 4 48.93 1.55 1.8614 3 2 2 4 49.07 2.28 1.8564 -3 3 3 4 49.51 1.22 1.8411 -1 8 3 4 49.72 6.52 1.8338 -1 4 5 4 50.58 3.51 1.8046 0 7 4 4 50.65 1.22 1.8021 2 8 1 4 50.90 4.47 1.7941 3 5 1 4 51.04 3.59 1.7895 -2 8 2 4 51.17 2.49 1.7850 -1 7 4 4 51.52 2.37 1.7737 2 6 3 4 51.53 4.78 1.7736 1 3 5 4 51.62 2.71 1.7707 -3 0 4 2 51.88 1.11 1.7623 -3 1 4 4 51.91 1.07 1.7615 0 5 5 4 52.17 1.54 1.7534 3 4 2 4 53.08 1.82 1.7252 0 9 3 4 53.35 1.04 1.7174 -3 5 3 4 53.37 3.13 1.7168 1 4 5 4 53.84 8.84 1.7029 0 10 2 4 54.48 6.08 1.6843 -1 0 6 2 54.50 2.70 1.6836 3 5 2 4 54.51 1.33 1.6833 0 8 4 4 54.61 7.66 1.6805 0 0 6 2 54.76 9.75 1.6763 0 6 5 4 54.90 1.64 1.6723 2 7 3 4 54.98 1.55 1.6702 -1 6 5 4 55.10 5.65 1.6666 -1 10 2 4 55.45 1.67 1.6570 -2 9 2 4 55.74 1.57 1.6491 -2 7 4 4 56.15 10.03 1.6381 -3 6 3 4 56.16 4.18 1.6378 -4 1 1 4 56.30 4.16 1.6340 -2 5 5 4 56.40 1.41 1.6313 -3 7 2 4 56.48 3.63 1.6293 4 0 0 2 56.49 2.19 1.6291 1 10 2 4 56.73 6.19 1.6227 4 1 0 4 56.75 1.09 1.6223 -1 3 6 4 56.88 1.77 1.6188 0 3 6 4 57.07 7.39 1.6137 3 7 1 4 57.20 1.73 1.6105 -4 1 2 4 57.32 3.66 1.6074 3 4 3 4 57.82 4.14 1.5947 1 11 0 4 57.99 1.36 1.5905 -3 5 4 4 58.01 5.56 1.5899 0 7 5 4 58.18 5.90 1.5856 2 9 2 4 58.20 4.89 1.5852 -2 0 6 2 58.39 1.59 1.5803 1 6 5 4 58.59 6.86 1.5756 1 0 6 2 58.74 1.38 1.5720 -3 8 1 4 58.75 1.29 1.5717 0 9 4 4 58.76 1.54 1.5713 -2 9 3 4 58.83 2.11 1.5697 1 1 6 4 58.93 1.31 1.5673 -3 2 5 4 58.95 1.24 1.5667 3 8 0 4 59.01 3.75 1.5653 -2 6 5 4 59.29 1.70 1.5587 -1 9 4 4 59.35 1.51 1.5572 -3 7 3 4 60.13 6.48 1.5389 -2 10 2 4 60.43 1.39 1.5319 3 7 2 4 60.51 2.74 1.5301 -4 2 3 4 60.72 1.44 1.5253 3 8 1 4 60.76 1.17 1.5244 1 3 6 4 60.84 1.52 1.5226 -4 4 2 4 60.87 4.05 1.5218 3 2 4 4 61.11 1.61 1.5165 2 7 4 4 61.51 4.21 1.5077 0 12 0 2 61.70 2.55 1.5035 -4 3 3 4 61.80 6.15 1.5011 -3 4 5 4 62.12 8.22 1.4943 -2 7 5 4 62.14 4.12 1.4938 3 6 3 4 62.45 5.10 1.4871 4 4 1 4 62.52 1.93 1.4856 4 5 0 4 62.73 1.24 1.4812 2 10 2 4 63.00 2.94 1.4755 3 9 0 4 63.71 1.29 1.4608 -3 7 4 4 63.74 1.41 1.4600 -1 12 1 4 63.78 3.07 1.4592 -1 10 4 4 64.35 1.06 1.4478 4 3 2 4 64.51 1.52 1.4446 -4 2 4 4 64.54 1.67 1.4438 4 5 1 4 64.55 2.77 1.4438 -4 6 1 4 64.70 1.18 1.4407 3 9 1 4 65.36 2.02 1.4278 -3 0 6 2 65.47 4.41 1.4257 2 6 5 4 65.65 1.41 1.4221 -4 3 4 4 65.77 1.42 1.4199 3 5 4 4 65.95 1.00 1.4164 4 4 2 4 65.96 1.56 1.4162 2 0 6 2 66.30 4.99 1.4097 1 10 4 4 66.43 2.21 1.4074 -3 6 5 4 66.90 1.67 1.3986 1 12 2 4 67.36 1.13 1.3902 3 10 0 4 67.40 1.56 1.3894 -3 3 6 4 68.12 3.17 1.3765 4 2 3 4 68.35 3.83 1.3725 0 4 7 4 68.40 3.66 1.3716 -3 10 2 4 68.44 1.18 1.3708 -4 7 2 4 68.58 3.27 1.3683 2 12 0 4 69.00 2.78 1.3610 1 13 0 4 69.24 1.31 1.3570 4 3 3 4 69.41 1.57 1.3540 -1 13 1 4 69.61 1.69 1.3506 3 3 5 4 69.93 1.29 1.3453 -1 5 7 4 69.96 1.31 1.3447 4 7 1 4 70.02 3.06 1.3437 1 13 1 4 70.92 2.82 1.3288 -2 4 7 4 71.25 1.34 1.3236 -1 13 2 4 71.76 1.25 1.3153 -4 8 2 4 72.02 1.48 1.3113 3 11 0 4 73.44 1.20 1.2893 0 9 6 4 73.68 1.30 1.2857 -5 3 1 4 74.13 1.77 1.2791 1 5 7 4 74.40 1.54 1.2750 -4 5 5 4 74.93 1.17 1.2674 -1 1 8 4 75.06 1.49 1.2655 -3 10 4 4 75.46 1.18 1.2597 -4 0 6 2 75.69 2.04 1.2566 -3 3 7 4 76.26 1.08 1.2486 3 0 6 2 76.47 2.12 1.2456 3 1 6 4 76.52 1.24 1.2450 4 8 2 4 76.79 1.24 1.2412 -3 12 1 4 77.12 1.11 1.2367 -5 5 1 4 78.51 1.21 1.2183 0 13 4 4 79.26 1.61 1.2086 1 7 7 4 79.50 1.89 1.2056 -4 10 2 4 79.53 3.15 1.2052 -4 7 5 4 80.13 1.67 1.1977 4 9 2 4 81.30 1.43 1.1834 1 3 8 4 81.42 1.12 1.1820 -3 6 7 4 82.06 2.76 1.1744 3 10 4 4 82.27 1.14 1.1719 3 13 0 4 82.95 1.37 1.1641 -3 9 6 4 83.25 1.37 1.1606 -3 13 2 4 83.35 1.91 1.1595 -3 1 8 4 83.81 1.97 1.1542 3 13 1 4 83.83 1.05 1.1540 4 7 4 4 84.61 1.27 1.1454 0 13 5 4 85.54 1.33 1.1352 0 15 3 4 87.87 1.30 1.1111 -1 3 9 4 87.96 1.28 1.1102 -1 16 1 4 88.17 1.52 1.1081 -2 13 5 4 88.53 1.61 1.1045 1 16 1 4 88.68 1.05 1.1030 2 12 5 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.