Ba Cl2 H4 O2 Padmanabhan V, Busing W, Levy H Acta Crystallographica B34 (1978) 2290-2292 Barium chloride dihydrate by neutron diffraction _cod_database_code 1008028 _database_code_amcsd 0015975 CELL PARAMETERS: 6.7215 10.9080 7.1316 90.000 91.104 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 522.778 Density (g/cm3): 3.103 MAX. ABS. INTENSITY / VOLUME**2: 17.59722814 RIR: 1.847 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 14.84 5.91 5.9683 0 1 1 4 15.49 10.91 5.7216 1 1 0 4 16.25 89.87 5.4540 0 2 0 2 17.96 61.31 4.9382 -1 0 1 2 18.31 18.67 4.8441 1 0 1 2 19.73 43.44 4.4987 -1 1 1 4 20.06 100.00 4.4272 1 1 1 4 20.50 15.74 4.3320 0 2 1 4 24.31 44.57 3.6606 -1 2 1 4 24.58 14.68 3.6218 1 2 1 4 24.98 12.78 3.5651 0 0 2 2 26.30 52.11 3.3887 0 1 2 4 26.53 22.08 3.3601 2 0 0 2 27.54 8.27 3.2392 0 3 1 4 27.78 20.25 3.2112 2 1 0 4 27.90 17.36 3.1979 1 3 0 4 29.74 7.35 3.0038 1 1 2 4 30.31 38.09 2.9484 -2 1 1 4 30.53 44.25 2.9279 -1 3 1 4 30.75 8.19 2.9080 2 1 1 4 30.75 76.03 2.9080 1 3 1 4 31.27 42.82 2.8608 2 2 0 4 33.04 49.29 2.7112 1 2 2 4 33.56 12.77 2.6702 -2 2 1 4 35.24 20.99 2.5471 0 4 1 4 35.26 56.63 2.5456 0 3 2 4 35.53 13.50 2.5269 1 4 0 4 36.39 2.07 2.4691 -2 0 2 2 36.41 8.79 2.4677 2 3 0 4 37.12 12.70 2.4221 2 0 2 2 37.34 39.21 2.4082 -2 1 2 4 37.68 18.58 2.3872 -1 4 1 4 37.86 1.39 2.3763 1 4 1 4 37.97 2.66 2.3698 1 3 2 4 38.06 17.47 2.3645 2 1 2 4 38.43 20.19 2.3423 -2 3 1 4 38.78 1.85 2.3223 0 1 3 4 39.99 24.31 2.2544 -1 0 3 2 40.50 22.11 2.2273 1 0 3 2 40.76 13.27 2.2136 2 2 2 4 40.87 20.66 2.2078 -1 1 3 4 41.37 1.00 2.1823 1 1 3 4 42.05 13.43 2.1490 -3 0 1 2 42.70 13.05 2.1174 2 4 0 4 42.89 1.35 2.1084 -3 1 1 4 43.37 41.19 2.0862 3 1 1 4 43.37 6.59 2.0861 0 5 1 4 43.43 9.42 2.0835 -1 2 3 4 43.62 18.43 2.0750 1 5 0 4 43.76 20.66 2.0686 -1 4 2 4 43.91 16.78 2.0620 1 2 3 4 44.08 6.68 2.0546 1 4 2 4 44.35 12.41 2.0426 -2 3 2 4 44.49 1.40 2.0366 -2 4 1 4 44.80 12.27 2.0231 2 4 1 4 44.97 5.60 2.0158 2 3 2 4 45.36 18.63 1.9994 -3 2 1 4 45.45 1.08 1.9955 -1 5 1 4 45.60 5.12 1.9894 0 3 3 4 45.61 2.96 1.9892 1 5 1 4 47.15 1.29 1.9275 -2 1 3 4 47.68 4.24 1.9072 3 3 0 4 48.95 3.81 1.8608 0 5 2 4 49.17 1.11 1.8532 3 1 2 4 49.69 2.01 1.8349 3 3 1 4 50.18 2.68 1.8180 0 6 0 2 50.39 3.04 1.8109 2 4 2 4 51.25 2.31 1.7826 0 0 4 2 51.40 1.09 1.7778 3 2 2 4 51.43 1.58 1.7768 -2 5 1 4 51.71 3.72 1.7679 2 5 1 4 51.90 4.69 1.7616 0 6 1 4 51.98 1.21 1.7592 0 1 4 4 52.89 5.80 1.7310 3 4 0 4 53.09 2.76 1.7250 1 4 3 4 53.60 2.79 1.7099 -1 1 4 4 53.73 2.45 1.7061 -1 6 1 4 53.94 3.36 1.6999 2 3 3 4 54.13 7.87 1.6944 0 2 4 4 54.35 5.38 1.6879 -3 4 1 4 54.97 3.82 1.6703 3 3 2 4 55.33 5.67 1.6605 4 1 0 4 56.27 1.22 1.6349 -2 5 2 4 56.54 4.10 1.6276 -3 1 3 4 56.80 2.67 1.6210 2 5 2 4 56.85 2.70 1.6196 0 6 2 4 57.33 6.82 1.6072 0 5 3 4 57.39 3.74 1.6056 4 2 0 4 57.59 5.91 1.6006 0 3 4 4 57.72 2.14 1.5973 3 1 3 4 57.98 7.14 1.5906 -2 4 3 4 58.11 4.29 1.5874 -2 0 4 2 58.50 9.22 1.5776 -1 6 2 4 58.58 1.69 1.5759 -3 2 3 4 58.75 1.25 1.5716 2 4 3 4 58.76 2.21 1.5714 1 6 2 4 58.97 4.61 1.5663 -3 4 2 4 59.10 3.79 1.5631 -1 3 4 4 59.11 2.62 1.5629 3 5 0 4 59.14 2.26 1.5623 2 0 4 2 59.22 2.27 1.5602 4 2 1 4 59.35 10.73 1.5572 2 6 1 4 59.73 7.45 1.5483 3 2 3 4 59.80 6.15 1.5465 2 1 4 4 60.46 4.20 1.5312 -4 0 2 2 60.73 4.24 1.5251 4 3 0 4 60.77 5.44 1.5242 -2 2 4 4 60.85 1.58 1.5224 3 5 1 4 60.85 3.27 1.5224 0 7 1 4 61.04 9.39 1.5180 1 7 0 4 61.12 6.77 1.5163 -4 1 2 4 61.46 1.53 1.5086 4 0 2 2 61.77 2.08 1.5019 2 2 4 4 61.87 8.05 1.4996 -3 3 3 4 62.00 1.63 1.4968 -4 3 1 4 62.11 1.12 1.4944 4 1 2 4 62.22 4.10 1.4921 0 4 4 4 63.06 1.58 1.4742 -4 2 2 4 64.04 6.73 1.4540 4 2 2 4 64.15 1.04 1.4517 1 4 4 4 64.54 1.80 1.4440 0 6 3 4 64.61 7.09 1.4426 2 5 3 4 64.97 2.10 1.4354 2 3 4 4 65.23 2.86 1.4304 4 4 0 4 65.54 2.17 1.4244 3 5 2 4 66.01 1.01 1.4152 -1 6 3 4 66.20 2.75 1.4116 3 6 0 4 66.33 1.59 1.4092 -3 4 3 4 66.37 1.21 1.4084 1 6 3 4 66.93 2.02 1.3980 4 4 1 4 67.01 1.32 1.3965 -3 1 4 4 67.12 2.65 1.3945 1 7 2 4 67.40 4.86 1.3894 3 4 3 4 67.42 3.52 1.3891 -1 1 5 4 67.43 5.53 1.3888 -2 7 1 4 67.94 1.50 1.3797 0 2 5 4 68.01 4.92 1.3784 1 1 5 4 68.38 3.09 1.3719 -2 4 4 4 69.27 1.16 1.3565 -1 2 5 4 69.29 1.27 1.3561 -1 5 4 4 69.75 4.16 1.3482 1 5 4 4 70.12 1.23 1.3420 -4 2 3 4 70.27 1.28 1.3396 3 2 4 4 70.29 3.09 1.3392 0 8 1 4 70.71 2.66 1.3324 -2 6 3 4 70.78 1.46 1.3311 4 5 0 4 71.13 1.75 1.3254 -5 0 1 2 71.46 2.81 1.3201 4 4 2 4 71.60 4.47 1.3180 -3 6 2 4 71.71 1.01 1.3162 5 0 1 2 71.90 2.01 1.3131 -3 3 4 4 71.97 4.24 1.3121 -4 5 1 4 72.29 1.27 1.3071 3 6 2 4 72.30 2.62 1.3069 -1 3 5 4 72.31 2.51 1.3067 5 1 1 4 72.42 2.23 1.3050 5 2 0 4 72.54 4.17 1.3032 0 7 3 4 72.87 2.33 1.2980 1 3 5 4 73.53 3.20 1.2880 -5 2 1 4 74.10 1.31 1.2795 5 2 1 4 74.12 1.20 1.2792 3 7 0 4 74.51 1.47 1.2735 4 3 3 4 74.74 1.05 1.2702 2 5 4 4 74.89 2.24 1.2680 2 2 5 4 75.19 1.90 1.2637 0 4 5 4 75.95 2.38 1.2528 -1 8 2 4 76.18 3.31 1.2497 1 8 2 4 76.34 1.35 1.2474 1 6 4 4 76.70 3.04 1.2425 2 8 1 4 77.06 1.04 1.2376 5 3 1 4 77.28 1.75 1.2345 -4 0 4 2 77.28 1.58 1.2345 -4 4 3 4 77.42 1.32 1.2327 3 4 4 4 78.43 2.34 1.2193 -2 7 3 4 78.87 2.04 1.2136 -3 0 5 2 78.93 2.78 1.2129 4 6 1 4 79.10 1.99 1.2107 2 7 3 4 79.29 1.66 1.2083 -3 7 2 4 79.46 1.32 1.2062 -3 1 5 4 79.62 1.64 1.2041 -4 2 4 4 79.66 4.21 1.2036 4 1 4 4 79.96 1.86 1.1999 3 7 2 4 80.53 1.62 1.1928 1 9 0 4 80.80 2.21 1.1895 -2 4 5 4 80.89 1.02 1.1884 0 0 6 2 81.12 1.63 1.1855 3 1 5 4 81.33 1.01 1.1831 -3 5 4 4 81.47 2.53 1.1814 0 1 6 4 82.19 1.93 1.1729 -5 1 3 4 82.52 1.34 1.1690 -4 3 4 4 82.86 1.43 1.1651 3 2 5 4 83.20 1.01 1.1611 0 2 6 4 83.46 2.71 1.1582 -1 7 4 4 83.84 1.76 1.1539 5 1 3 4 86.00 2.10 1.1304 -4 7 1 4 86.33 2.48 1.1269 -2 9 1 4 86.79 1.95 1.1221 -5 3 3 4 86.80 1.68 1.1220 0 6 5 4 86.87 2.32 1.1213 -2 1 6 4 87.56 2.54 1.1142 6 1 0 4 87.94 1.09 1.1104 -3 8 2 4 88.84 1.26 1.1015 -4 6 3 4 88.97 2.05 1.1002 3 6 4 4 89.52 1.77 1.0948 -5 5 2 4 89.91 1.74 1.0911 2 2 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.