Heulandite-Ba Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R061012 Larsen A O, Nordrum F S, Dobelin N, Armbruster T, Petersen O V, Erambert M European Journal of Mineralogy 17 (2005) 143-153 Heulandite-Ba, a new zeolite species from Norway Locality: Northern Ravnas silver prospect, southern Vinoren, Flesberg community, Buskerud county, Norway (Kongsberg ore district) CELL PARAMETERS: 17.8040 17.9200 7.4680 90.000 116.570 90.000 SPACE GROUP: C2/m ATOM X Y Z OCCUPANCY ISO(B) Ba 0.35504 0.50000 0.32370 0.359 2.480 Ba 0.25280 0.50000 0.07680 0.190 2.670 Ca 0.45840 0.00000 0.80140 0.392 2.200 K 0.21900 0.50000 0.98700 0.410 5.900 Na 0.46300 0.00000 0.72500 0.050 1.900 Si 0.17934 0.16850 0.09567 0.750 1.070 Al 0.17934 0.16850 0.09567 0.250 1.070 Si 0.28857 0.08986 0.50023 0.750 1.088 Al 0.28857 0.08986 0.50023 0.250 1.088 Si 0.29214 0.30922 0.28287 0.750 1.092 Al 0.29214 0.30922 0.28287 0.250 1.092 Si 0.43568 0.20123 0.58874 0.750 1.079 Al 0.43568 0.20123 0.58874 0.250 1.079 Si 0.00000 0.21324 0.00000 0.750 1.130 Al 0.00000 0.21324 0.00000 0.250 1.130 O 0.30470 0.00000 0.54940 1.000 2.460 O 0.26840 0.37980 0.38890 1.000 2.390 O 0.31710 0.34920 0.11770 1.000 2.060 O 0.23850 0.10470 0.25450 1.000 2.110 O 0.50000 0.17330 0.50000 1.000 2.450 O 0.08210 0.15860 0.06360 1.000 1.830 O 0.37450 0.26600 0.44980 1.000 3.090 O 0.00860 0.26770 0.18500 1.000 2.500 O 0.21150 0.25310 0.17530 1.000 2.130 O 0.38390 0.12750 0.59970 1.000 2.250 Wa 0.57740 0.08160 0.97280 0.750 3.910 Wa 0.40500 0.50000 0.15500 0.360 15.000 Wa 0.50000 0.00000 0.50000 1.000 7.500 Wa 0.42500 0.50000 0.09100 0.641 8.400 Wa 0.48240 0.40510 0.50700 0.500 7.600 Wa 0.40740 0.50000 0.71900 0.720 9.200 Wa 0.60500 0.09100 0.92200 0.250 6.000 Wa 0.38500 0.50000 0.48100 0.150 4.740 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 0.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 14 +/- 16 +/- 6 MAX. ABS. INTENSITY / VOLUME**2: 2.563177354 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 7.43 3.25 11.9032 1 1 0 9.87 40.10 8.9600 0 2 0 11.11 100.00 7.9618 2 0 0 12.85 10.30 6.8905 -1 1 1 12.94 3.34 6.8409 -2 0 1 13.26 9.88 6.6793 0 0 1 14.88 27.07 5.9516 2 2 0 16.30 2.93 5.4373 -2 2 1 16.55 3.23 5.3551 0 2 1 16.77 30.36 5.2859 -3 1 1 17.26 73.34 5.1378 1 1 1 17.43 38.74 5.0893 3 1 0 19.03 77.37 4.6638 -1 3 1 19.82 6.72 4.4800 0 4 0 20.22 23.23 4.3907 -4 0 1 21.90 1.82 4.0588 -3 3 1 22.28 68.51 3.9906 1 3 1 22.33 26.80 3.9809 4 0 0 22.41 37.09 3.9677 3 3 0 22.55 16.67 3.9428 -4 2 1 22.78 31.39 3.9044 2 4 0 23.10 20.89 3.8499 2 2 1 23.74 18.54 3.7478 -2 4 1 23.84 16.37 3.7322 -2 0 2 23.92 2.82 3.7206 0 4 1 24.47 5.33 3.6380 4 2 0 24.83 54.78 3.5851 -3 1 2 25.17 3.14 3.5378 -1 1 2 25.47 7.28 3.4965 1 5 0 25.52 21.19 3.4907 -5 1 1 25.86 51.66 3.4453 -2 2 2 26.05 26.22 3.4205 -4 0 2 26.17 2.14 3.4049 3 1 1 26.69 28.26 3.3396 0 0 2 27.92 66.70 3.1955 -4 2 2 28.46 67.93 3.1358 -4 4 1 28.52 1.11 3.1293 0 2 2 28.61 1.47 3.1202 -3 3 2 28.91 35.84 3.0889 -1 3 2 29.21 2.35 3.0574 -5 3 1 29.25 15.26 3.0534 -5 1 2 29.70 30.27 3.0079 -3 5 1 29.79 8.61 2.9992 3 3 1 29.92 11.35 2.9867 0 6 0 29.99 89.13 2.9798 1 5 1 30.09 69.73 2.9703 3 5 0 30.11 28.81 2.9677 1 1 2 30.16 2.26 2.9627 -6 0 1 30.87 5.99 2.8969 4 0 1 31.81 27.87 2.8129 -6 2 1 31.84 65.24 2.8103 5 3 0 32.48 1.53 2.7564 4 2 1 32.55 13.04 2.7506 -5 3 2 32.72 26.81 2.7372 -2 6 1 32.85 11.76 2.7265 0 6 1 33.34 4.90 2.6875 1 3 2 33.42 2.19 2.6814 2 0 2 33.47 7.92 2.6775 0 4 2 33.92 5.12 2.6429 -6 2 2 34.93 7.99 2.5689 2 2 2 35.05 2.54 2.5604 -3 5 2 35.27 7.30 2.5447 6 2 0 35.29 2.74 2.5430 -1 5 2 35.52 9.15 2.5275 1 7 0 35.55 4.75 2.5253 -5 5 1 35.91 6.41 2.5008 -7 1 1 36.04 11.97 2.4923 3 5 1 36.35 5.09 2.4712 -6 4 1 36.37 5.76 2.4700 -4 0 3 36.38 13.02 2.4695 -4 6 1 36.63 2.11 2.4531 5 1 1 36.73 3.05 2.4467 -2 0 3 36.74 10.85 2.4462 2 6 1 36.87 6.59 2.4378 -7 1 2 36.95 20.60 2.4326 4 4 1 37.65 5.49 2.3891 4 6 0 37.78 12.56 2.3812 -4 2 3 38.04 3.12 2.3654 3 1 2 38.13 8.46 2.3603 -2 2 3 38.24 8.55 2.3536 -6 4 2 38.40 4.47 2.3441 -5 5 2 38.61 1.30 2.3319 -2 6 2 38.76 1.26 2.3233 -3 7 1 38.99 3.95 2.3103 1 7 1 39.06 5.57 2.3058 3 7 0 39.15 5.16 2.3008 2 4 2 39.39 1.96 2.2876 5 3 1 39.46 2.87 2.2834 6 4 0 39.61 1.59 2.2752 -7 3 2 39.95 3.23 2.2567 7 1 0 40.08 2.13 2.2497 -4 6 2 40.26 5.28 2.2400 0 8 0 40.52 1.01 2.2263 0 6 2 40.72 2.85 2.2160 3 3 2 40.83 4.61 2.2099 -6 2 3 41.12 1.74 2.1951 -8 0 1 41.22 1.07 2.1902 -1 3 3 41.76 2.40 2.1631 -4 4 3 41.81 1.53 2.1607 0 2 3 41.90 2.21 2.1563 2 8 0 42.08 5.32 2.1473 -2 4 3 42.39 1.34 2.1321 -8 2 1 42.40 5.49 2.1318 4 0 2 42.52 6.19 2.1259 7 3 0 42.54 5.21 2.1249 -7 1 3 43.00 1.09 2.1034 -6 6 1 43.13 2.50 2.0976 -3 7 2 43.13 17.51 2.0974 6 2 1 43.52 2.82 2.0794 4 6 1 43.79 4.11 2.0671 1 1 3 44.32 1.92 2.0439 -3 5 3 44.47 1.50 2.0374 5 5 1 44.59 9.66 2.0322 -6 4 3 44.67 4.36 2.0286 -7 5 2 45.46 2.68 1.9953 -4 8 1 45.46 1.30 1.9953 5 7 0 45.73 2.16 1.9839 6 6 0 45.99 6.08 1.9736 -5 7 2 46.04 6.11 1.9714 -8 4 2 46.04 2.90 1.9712 -8 4 1 46.13 14.81 1.9676 -1 5 3 46.19 1.93 1.9652 1 3 3 46.37 3.84 1.9581 -9 1 2 46.73 8.68 1.9437 6 4 1 46.74 5.28 1.9436 -8 2 3 46.75 1.43 1.9431 8 2 0 47.22 1.52 1.9250 4 4 2 47.25 5.08 1.9238 -1 9 1 47.33 2.28 1.9206 -2 8 2 48.58 1.59 1.8739 -4 8 2 48.67 2.39 1.8708 -9 3 2 48.80 3.78 1.8661 -4 0 4 49.61 6.91 1.8374 -7 5 3 49.62 6.54 1.8371 -3 1 4 49.84 1.70 1.8295 -6 0 4 49.99 4.77 1.8246 5 3 2 50.15 1.39 1.8190 8 4 0 50.94 1.25 1.7926 -6 2 4 50.96 9.32 1.7920 0 10 0 51.17 4.31 1.7850 0 6 3 51.20 2.39 1.7842 -3 7 3 51.33 2.89 1.7799 5 7 1 51.35 4.11 1.7794 -10 0 2 51.37 2.55 1.7788 3 1 3 51.51 14.33 1.7740 -7 7 2 51.58 4.82 1.7720 4 8 1 51.67 1.82 1.7692 -7 1 4 51.67 1.86 1.7689 -2 2 4 51.67 1.73 1.7689 -8 6 2 51.82 5.19 1.7644 -3 3 4 52.29 4.96 1.7494 -5 7 3 52.31 6.16 1.7489 -3 9 2 52.42 1.71 1.7453 -10 2 2 52.76 1.61 1.7351 4 6 2 52.90 6.35 1.7308 0 10 1 53.03 5.35 1.7268 3 9 1 53.29 2.81 1.7191 2 8 2 53.51 4.97 1.7126 3 3 3 53.59 1.38 1.7102 -8 0 4 53.75 6.18 1.7055 -10 0 3 53.77 3.62 1.7050 -9 5 1 53.86 1.41 1.7022 -10 2 1 53.92 3.32 1.7005 7 7 0 54.34 1.44 1.6883 5 9 0 54.63 8.21 1.6799 -8 2 4 54.85 3.93 1.6737 -1 3 4 55.38 2.11 1.6591 -4 10 1 55.48 2.62 1.6563 8 6 0 55.63 3.19 1.6522 -2 8 3 55.63 1.94 1.6520 2 10 1 55.67 1.63 1.6510 -5 5 4 56.01 2.25 1.6419 -7 7 3 56.02 1.09 1.6417 -3 5 4 56.30 2.55 1.6341 4 10 0 56.62 1.54 1.6256 -9 1 4 56.75 9.90 1.6220 2 6 3 57.62 6.35 1.5997 3 5 3 57.69 3.57 1.5980 -6 8 3 57.71 3.42 1.5973 8 4 1 57.91 1.84 1.5924 10 0 0 58.15 1.53 1.5865 9 5 0 58.63 2.05 1.5746 -9 3 4 58.66 1.31 1.5737 7 1 2 58.91 4.19 1.5678 -8 8 1 58.91 3.01 1.5678 10 2 0 59.49 3.95 1.5539 6 8 1 59.85 2.17 1.5453 -9 7 1 60.34 1.24 1.5340 5 7 2 60.57 1.41 1.5288 3 9 2 60.63 1.84 1.5273 7 3 2 60.70 3.01 1.5257 5 1 3 60.78 1.73 1.5240 4 10 1 60.94 1.35 1.5203 -1 9 3 61.63 1.37 1.5048 -5 7 4 61.93 2.76 1.4983 7 9 0 61.94 3.48 1.4981 9 3 1 62.03 1.94 1.4963 -9 7 3 62.16 3.37 1.4933 0 12 0 62.40 1.85 1.4881 -8 8 3 62.41 5.91 1.4879 8 8 0 62.54 1.17 1.4851 6 10 0 62.63 1.07 1.4833 5 3 3 62.72 1.07 1.4813 -5 11 1 63.37 2.11 1.4677 2 12 0 63.47 1.34 1.4657 3 7 3 63.64 1.75 1.4622 -4 2 5 63.67 4.47 1.4615 -12 2 2 63.87 2.54 1.4575 0 6 4 63.87 1.22 1.4574 0 12 1 63.96 1.92 1.4555 9 7 0 64.12 1.15 1.4524 1 5 4 64.45 1.37 1.4456 7 5 2 64.51 3.46 1.4445 -11 5 3 64.64 4.29 1.4420 -5 11 2 64.68 1.31 1.4411 -1 7 4 64.80 6.49 1.4387 1 9 3 64.94 2.58 1.4360 -11 5 1 65.11 3.19 1.4326 1 11 2 65.11 1.15 1.4326 -7 3 5 65.25 1.71 1.4299 8 2 2 65.27 3.76 1.4295 -12 0 1 65.47 3.59 1.4256 -2 0 5 65.60 6.50 1.4231 -11 3 4 66.09 1.63 1.4138 -4 12 1 66.34 1.44 1.4090 -6 10 3 66.40 1.50 1.4080 -9 1 5 66.44 1.56 1.4071 -4 4 5 66.45 1.39 1.4069 11 3 0 66.63 1.74 1.4036 6 2 3 66.80 1.39 1.4004 -9 9 2 67.04 1.03 1.3960 0 10 3 67.06 2.27 1.3957 10 2 1 67.19 1.03 1.3933 -10 8 2 67.47 3.84 1.3882 -8 10 1 68.03 3.71 1.3781 -5 5 5 68.39 3.00 1.3717 4 10 2 68.59 1.17 1.3682 -10 0 5 68.80 5.43 1.3645 -7 5 5 68.89 1.41 1.3629 -3 11 3 69.10 1.85 1.3593 -8 8 4 69.16 3.49 1.3584 -7 11 2 69.50 1.50 1.3525 -10 2 5 69.56 3.65 1.3514 -3 5 5 69.98 3.40 1.3444 7 7 2 70.03 1.90 1.3436 -11 7 3 70.20 1.05 1.3407 4 0 4 70.44 1.77 1.3367 -11 7 1 70.62 1.39 1.3338 -6 6 5 71.03 2.18 1.3271 -12 6 2 71.06 1.49 1.3266 -13 3 3 71.83 1.23 1.3143 -12 6 3 71.84 1.72 1.3141 5 7 3 72.44 4.63 1.3047 2 12 2 73.34 2.00 1.2909 -1 5 5 73.55 1.20 1.2878 -11 3 5 73.63 1.44 1.2866 -2 6 5 73.70 2.23 1.2854 -5 13 1 74.01 1.06 1.2809 1 1 5 74.21 5.34 1.2779 -4 12 3 74.65 4.72 1.2715 -2 10 4 74.76 2.05 1.2698 11 3 1 74.91 1.34 1.2677 -3 7 5 75.09 2.25 1.2650 5 13 0 75.26 1.33 1.2627 -10 10 2 75.35 1.12 1.2613 5 1 4 75.77 3.20 1.2554 -9 11 2 76.04 1.07 1.2516 9 5 2 76.86 1.50 1.2403 -7 1 6 76.87 1.05 1.2402 0 12 3 77.06 1.09 1.2376 7 9 2 77.21 3.43 1.2356 -12 8 2 77.27 1.69 1.2347 -8 12 1 77.30 1.21 1.2344 -5 1 6 77.38 2.55 1.2333 -13 5 1 77.57 1.21 1.2307 2 0 5 77.60 1.85 1.2303 -14 0 4 77.71 1.67 1.2288 -4 14 1 77.78 2.99 1.2279 6 12 1 78.25 1.28 1.2217 0 10 4 78.42 1.10 1.2194 0 6 5 78.86 1.04 1.2138 5 9 3 79.62 1.19 1.2041 3 11 3 79.94 1.39 1.2000 6 8 3 80.04 1.24 1.1988 -4 14 2 80.90 2.36 1.1883 -13 3 5 81.36 1.06 1.1827 6 2 4 81.57 2.63 1.1802 -11 9 4 82.26 2.12 1.1720 -10 10 4 82.64 1.37 1.1676 -10 8 5 82.77 1.75 1.1661 1 15 1 83.16 1.20 1.1616 -6 14 2 83.93 1.01 1.1529 6 4 4 84.25 1.30 1.1493 -14 2 5 85.57 1.75 1.1350 9 3 3 86.65 1.52 1.1235 -10 12 3 87.42 1.30 1.1156 -2 10 5 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.