Nealite Giuseppetti G, Mazzi F, Tadini C Neues Jahrbuch fur Mineralogie, Monatshefte 1993 (1993) 278-288 The crystal structure of nealite: Pb4Fe(AsO3)2Cl4*2H2O Locality: Laurion, Greece _database_code_amcsd 0014867 CELL PARAMETERS: 6.5300 10.2300 5.5880 96.400 89.500 97.800 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 367.523 Density (g/cm3): 5.930 MAX. ABS. INTENSITY / VOLUME**2: 48.03622436 RIR: 2.638 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 8.78 63.82 10.0724 0 1 0 2 13.69 76.18 6.4694 1 0 0 2 15.24 16.12 5.8136 -1 1 0 2 15.96 1.97 5.5531 0 0 1 2 17.27 5.84 5.1359 1 1 0 2 19.09 4.41 4.6491 0 1 1 2 20.83 38.66 4.2641 -1 2 0 2 21.02 18.48 4.2273 -1 0 1 2 21.15 54.07 4.2002 1 0 1 2 21.47 4.91 4.1381 1 -1 1 2 22.47 36.49 3.9561 0 -2 1 2 22.85 49.81 3.8926 -1 -1 1 2 24.32 19.25 3.6592 1 1 1 2 25.16 53.75 3.5396 0 2 1 2 25.16 46.25 3.5394 1 -2 1 2 26.55 22.41 3.3575 0 3 0 2 27.50 61.97 3.2440 -1 2 1 2 27.58 5.24 3.2347 2 0 0 2 27.80 14.70 3.2091 -2 1 0 2 28.24 1.41 3.1604 -1 3 0 2 29.52 19.21 3.0261 0 -3 1 2 29.96 1.23 2.9828 1 2 1 2 30.14 44.99 2.9650 2 1 0 2 30.76 22.90 2.9068 -2 2 0 2 31.11 65.86 2.8752 1 -3 1 2 31.65 77.56 2.8274 1 3 0 2 31.80 3.15 2.8141 2 -1 1 2 31.93 31.88 2.8030 -2 0 1 2 32.11 46.14 2.7872 2 0 1 2 32.24 60.77 2.7765 0 0 2 2 32.48 26.25 2.7565 0 -1 2 2 32.63 14.66 2.7442 -2 1 1 2 32.67 3.62 2.7412 0 3 1 2 33.71 38.87 2.6586 -2 -1 1 2 33.96 1.57 2.6394 2 -2 1 2 34.04 49.05 2.6341 -1 3 1 2 34.17 8.48 2.6242 -1 -3 1 2 34.85 20.81 2.5744 2 1 1 2 35.09 8.64 2.5575 -1 0 2 2 35.13 1.23 2.5547 0 -2 2 2 35.26 3.97 2.5455 1 0 2 2 35.66 1.08 2.5181 0 4 0 2 35.84 1.25 2.5054 -2 3 0 2 36.49 9.96 2.4622 -1 4 0 2 36.67 1.39 2.4504 -1 1 2 2 37.01 4.58 2.4288 1 -2 2 2 37.05 4.46 2.4266 1 3 1 2 37.77 1.60 2.3815 1 1 2 2 38.24 1.47 2.3536 2 -3 1 2 39.57 1.16 2.2777 2 2 1 2 39.76 13.01 2.2672 0 -3 2 2 40.15 3.04 2.2459 1 4 0 2 40.33 3.22 2.2366 -1 2 2 2 41.30 2.44 2.1861 2 3 0 2 41.62 1.45 2.1698 -3 1 0 2 41.68 1.79 2.1670 -1 4 1 2 41.83 4.01 2.1597 -1 -4 1 2 41.89 1.22 2.1565 3 0 0 2 42.19 9.89 2.1417 1 2 2 2 42.43 4.81 2.1305 2 -1 2 2 42.78 3.41 2.1136 -2 0 2 2 43.07 3.49 2.1001 2 0 2 2 43.30 5.58 2.0896 -2 -3 1 2 43.35 17.52 2.0875 -3 2 0 2 43.42 19.95 2.0842 -1 -3 2 2 43.73 4.15 2.0702 -2 1 2 2 43.75 15.53 2.0690 2 -2 2 2 43.80 8.09 2.0670 -2 -1 2 2 44.11 8.91 2.0532 2 -4 1 2 44.12 10.29 2.0525 3 1 0 2 44.57 7.44 2.0330 3 -1 1 2 44.60 7.34 2.0315 0 3 2 2 45.00 1.01 2.0145 0 5 0 2 45.05 3.27 2.0123 1 4 1 2 45.13 8.35 2.0091 -3 1 1 2 45.21 1.22 2.0058 3 0 1 2 45.30 18.76 2.0020 -1 5 0 2 45.62 3.37 1.9886 2 1 2 2 45.76 12.02 1.9828 2 3 1 2 45.83 6.81 1.9801 3 -2 1 2 46.19 6.53 1.9651 0 -5 1 2 46.53 13.39 1.9516 -2 2 2 2 46.91 1.52 1.9368 2 -3 2 2 47.01 4.90 1.9331 -2 4 1 2 47.12 7.71 1.9288 -3 2 1 2 47.68 3.78 1.9074 3 1 1 2 48.10 18.55 1.8918 1 3 2 2 48.10 1.56 1.8917 3 2 0 2 48.87 1.32 1.8638 3 -3 1 2 49.16 1.21 1.8534 1 5 0 2 49.54 9.67 1.8399 -1 -4 2 2 49.84 7.63 1.8295 0 5 1 2 49.99 14.42 1.8246 -2 5 0 2 50.08 1.54 1.8213 -1 5 1 2 50.16 5.71 1.8186 -2 -4 1 2 50.20 6.24 1.8172 -3 -2 1 2 50.25 2.62 1.8158 -1 -5 1 2 50.61 3.93 1.8036 0 -2 3 2 51.16 1.03 1.7856 2 -5 1 2 51.16 3.56 1.7856 -2 -3 2 2 51.25 1.65 1.7827 -1 0 3 2 51.43 2.67 1.7768 -1 -1 3 2 51.44 2.52 1.7766 1 0 3 2 51.79 1.42 1.7653 3 2 1 2 51.95 3.96 1.7601 -3 4 0 2 52.21 2.34 1.7520 -1 4 2 2 53.44 9.05 1.7146 1 -5 2 2 53.46 5.54 1.7140 3 -4 1 2 53.53 2.32 1.7120 3 3 0 2 53.66 3.29 1.7080 1 1 3 2 53.75 5.61 1.7054 1 5 1 2 53.83 1.80 1.7031 0 -3 3 2 53.89 2.82 1.7014 3 -2 2 2 54.44 1.12 1.6855 -2 5 1 2 54.67 3.15 1.6787 0 6 0 2 54.70 2.46 1.6780 0 2 3 2 54.85 4.99 1.6737 -3 -1 2 2 54.87 9.75 1.6731 1 -3 3 2 55.15 1.06 1.6654 1 4 2 2 55.15 2.70 1.6653 -3 -3 1 2 55.38 8.06 1.6589 0 -6 1 2 55.46 1.04 1.6568 2 3 2 2 55.90 11.60 1.6448 -1 2 3 2 55.94 8.19 1.6438 -3 4 1 2 56.17 7.45 1.6375 -3 2 2 2 56.28 2.76 1.6345 3 -3 2 2 56.38 5.03 1.6319 -4 1 0 2 56.52 3.03 1.6282 3 1 2 2 57.29 2.90 1.6082 3 3 1 2 57.53 8.40 1.6021 2 0 3 2 57.68 9.54 1.5982 -2 -1 3 2 57.70 1.30 1.5977 2 -5 2 2 58.40 1.45 1.5802 -2 6 0 2 58.66 4.60 1.5739 1 6 0 2 58.79 1.18 1.5706 4 -1 1 2 59.06 4.16 1.5641 4 1 0 2 59.19 2.23 1.5609 -4 1 1 2 59.25 7.57 1.5595 0 6 1 2 59.31 2.26 1.5581 -1 -6 1 2 59.37 3.78 1.5567 3 -5 1 2 59.50 2.12 1.5535 4 -2 1 2 59.65 1.89 1.5501 4 0 1 2 59.82 5.52 1.5462 -1 5 2 2 60.16 7.38 1.5381 3 4 0 2 60.17 1.42 1.5378 3 -4 2 2 60.48 2.00 1.5308 -1 3 3 2 61.18 6.30 1.5148 -4 -1 1 2 61.36 1.72 1.5108 -3 -4 1 2 61.61 1.65 1.5054 -1 -4 3 2 61.89 1.30 1.4993 -3 -3 2 2 62.02 3.74 1.4963 4 1 1 2 62.25 1.38 1.4914 2 4 2 2 62.30 1.07 1.4903 -3 5 1 2 62.58 1.08 1.4844 1 3 3 2 63.29 1.03 1.4694 -2 -3 3 2 63.35 1.36 1.4681 -4 3 1 2 63.69 4.99 1.4611 -2 5 2 2 63.97 1.33 1.4554 3 4 1 2 64.07 5.15 1.4534 -4 4 0 2 64.42 2.68 1.4464 -4 -2 1 2 64.73 1.93 1.4401 -3 4 2 2 64.77 2.77 1.4394 1 -7 1 2 64.86 2.16 1.4376 2 -6 2 2 64.94 2.84 1.4360 -1 -6 2 2 65.83 1.98 1.4187 4 2 1 2 65.84 3.22 1.4185 3 3 2 2 66.08 3.57 1.4140 4 -1 2 2 66.09 5.01 1.4137 2 6 0 2 66.12 1.91 1.4132 3 -2 3 2 66.67 3.24 1.4028 -2 -6 1 2 66.83 3.32 1.3999 -4 1 2 2 67.02 4.05 1.3964 0 -1 4 2 67.03 3.06 1.3962 -3 1 3 2 67.43 4.78 1.3889 -3 -4 2 2 67.46 3.35 1.3883 0 0 4 2 67.96 2.67 1.3794 2 -7 1 2 68.17 1.50 1.3756 -2 -4 3 2 68.63 1.03 1.3676 2 -5 3 2 68.84 1.55 1.3638 -1 7 1 2 68.95 1.06 1.3619 2 3 3 2 70.28 2.68 1.3394 2 6 1 2 70.28 1.27 1.3394 -2 4 3 2 71.20 2.25 1.3243 3 -4 3 2 71.49 1.31 1.3197 4 -4 2 2 71.55 2.62 1.3187 0 -6 3 2 71.90 4.05 1.3132 -2 7 1 2 71.97 1.18 1.3121 -2 -6 2 2 72.04 1.38 1.3109 1 6 2 2 72.36 2.89 1.3059 -5 1 0 2 72.36 2.19 1.3059 3 4 2 2 72.96 1.17 1.2967 -1 -3 4 2 73.07 1.40 1.2949 -4 5 1 2 73.19 3.96 1.2932 0 5 3 2 73.54 1.59 1.2878 2 -1 4 2 73.80 1.11 1.2840 4 4 0 2 74.09 2.41 1.2797 -3 7 0 2 74.31 1.70 1.2764 -2 -1 4 2 74.85 2.61 1.2685 -1 8 0 2 75.02 1.09 1.2661 1 2 4 2 75.51 1.81 1.2590 0 8 0 2 75.60 1.48 1.2578 -4 4 2 2 75.77 1.04 1.2555 3 -5 3 2 76.20 1.38 1.2494 -2 -7 1 2 77.00 1.50 1.2385 -1 -4 4 2 77.01 1.13 1.2382 -3 -6 1 2 77.50 1.65 1.2317 -3 4 3 2 77.54 1.13 1.2311 4 -1 3 2 77.63 2.06 1.2299 2 -8 1 2 77.80 1.16 1.2276 -3 -4 3 2 77.98 2.48 1.2252 -5 3 1 2 78.27 1.37 1.2214 -3 6 2 2 78.40 1.06 1.2197 3 3 3 2 78.83 2.65 1.2141 5 2 0 2 78.90 1.53 1.2133 2 6 2 2 79.25 1.50 1.2088 -4 -1 3 2 79.42 1.54 1.2067 3 -7 2 2 79.52 1.05 1.2054 -1 -8 1 2 79.65 1.83 1.2038 5 -4 1 2 79.65 1.08 1.2037 1 -5 4 2 79.79 1.46 1.2020 -4 6 1 2 79.86 1.94 1.2011 1 3 4 2 79.99 1.00 1.1994 0 8 1 2 80.11 2.00 1.1979 0 -8 2 2 80.44 1.71 1.1939 -4 -4 2 2 80.48 1.61 1.1934 3 6 1 2 81.50 1.28 1.1810 4 1 3 2 81.60 1.06 1.1799 0 6 3 2 81.62 2.15 1.1796 -4 -2 3 2 81.74 2.00 1.1782 -5 1 2 2 81.92 1.26 1.1760 -4 -5 1 2 82.45 1.10 1.1698 2 -7 3 2 83.50 1.22 1.1577 -1 4 4 2 83.68 1.21 1.1557 -4 7 0 2 83.95 1.18 1.1527 1 8 1 2 86.40 1.58 1.1261 -5 -2 2 2 88.15 1.66 1.1083 -1 8 2 2 88.84 1.40 1.1015 0 8 2 2 88.93 1.32 1.1005 4 -7 2 2 89.05 1.15 1.0994 -5 6 0 2 89.07 1.50 1.0992 5 2 2 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.