Mosandrite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R100097 Bellezza M, Merlino S, Perchiazzi N The Canadian Mineralogist 47 (2009) 897-908 Mosandrite: Structural and crystal-chemical relationships with rinkite Locality: nepheline syenite pegmatites on Laven Island, Langesundsfjord, Norway _database_code_amcsd 0006295 CELL PARAMETERS: 7.4417 5.6678 18.8300 90.000 101.422 90.000 SPACE GROUP: P2_1/c ATOM X Y Z OCCUPANCY ISO(B) Ti 0.00000 0.00000 0.00000 0.960 1.816 Nb 0.00000 0.00000 0.00000 0.040 1.816 Wa 0.50000 0.00000 0.00000 0.700 2.132 Na 0.50000 0.00000 0.00000 0.140 2.132 Ca 0.50000 0.00000 0.00000 0.160 2.132 Na 0.75070 0.50130 0.00040 0.050 2.211 Ca 0.75070 0.50130 0.00040 0.230 2.211 Ce 0.75070 0.50130 0.00040 0.070 2.211 Ca 0.09440 0.66580 0.19250 0.650 1.263 Ce 0.09440 0.66580 0.19250 0.310 1.263 Zr 0.09440 0.66580 0.19250 0.040 1.263 Ca 0.59730 0.66460 0.19180 0.830 1.263 Ce 0.59730 0.66460 0.19180 0.170 1.263 Si 0.35040 0.16050 0.13850 1.000 1.105 Si 0.78370 0.15950 0.13650 1.000 1.105 O 0.21350 0.15790 0.06110 1.000 2.527 O 0.83790 0.15040 0.05810 1.000 2.369 O 0.33690 0.39910 0.18500 1.000 1.658 O 0.84640 0.39840 0.18170 1.000 1.895 O 0.33660 0.93260 0.19030 1.000 1.737 O 0.85210 0.93370 0.18860 1.000 1.500 O 0.55690 0.15430 0.11890 1.000 3.158 OH 0.03110 0.69580 0.06230 0.650 2.842 F 0.03110 0.69580 0.06230 0.350 2.842 Wa 0.52950 0.66590 0.06110 0.460 3.395 OH 0.52950 0.66590 0.06110 0.440 3.395 F 0.52950 0.66590 0.06110 0.100 3.395 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 6 +/- 5 +/- 16 MAX. ABS. INTENSITY / VOLUME**2: 18.05086156 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 9.58 29.03 9.2285 0 0 2 16.36 6.58 5.4181 0 1 1 19.84 1.05 4.4755 1 1 0 20.64 2.75 4.3035 -1 0 4 20.98 4.03 4.2340 -1 1 2 20.99 1.35 4.2333 1 1 1 21.32 8.78 4.1685 0 1 3 23.11 3.66 3.8485 -1 1 3 23.12 1.06 3.8476 1 1 2 24.40 1.26 3.6478 -2 0 2 24.41 1.16 3.6472 2 0 0 24.79 3.56 3.5914 1 0 4 24.88 23.78 3.5784 0 1 4 26.00 3.03 3.4266 1 1 3 28.70 8.04 3.1105 -2 1 1 28.86 7.85 3.0932 0 1 5 29.03 26.13 3.0762 0 0 6 29.11 51.22 3.0674 -2 1 2 29.12 48.78 3.0670 2 1 0 29.19 1.02 3.0597 -1 0 6 29.44 1.85 3.0337 1 1 4 30.32 17.14 2.9479 -2 1 3 30.33 16.36 2.9472 2 1 1 31.57 1.25 2.8339 0 2 0 31.95 25.15 2.8011 0 2 1 33.07 5.26 2.7090 0 2 2 33.13 32.04 2.7036 0 1 6 34.21 4.83 2.6211 -2 0 6 34.22 4.76 2.6200 2 0 4 34.78 4.62 2.5796 -2 1 5 34.79 4.63 2.5787 2 1 3 34.86 3.89 2.5740 0 2 3 37.23 5.81 2.4148 0 2 4 37.62 5.94 2.3907 0 1 7 39.04 8.20 2.3071 0 0 8 41.22 5.16 2.1902 -2 2 3 41.22 5.32 2.1899 2 2 1 41.99 3.06 2.1518 -2 0 8 42.01 2.78 2.1509 2 0 6 42.29 2.29 2.1369 0 1 8 42.71 3.92 2.1170 -2 2 4 42.72 4.24 2.1166 2 2 2 43.42 1.53 2.0843 0 2 6 44.73 11.11 2.0258 -2 2 5 44.74 11.63 2.0254 2 2 3 45.07 7.54 2.0117 -2 1 8 45.08 7.92 2.0109 2 1 6 47.08 1.07 1.9304 0 2 7 47.24 2.40 1.9243 -2 2 6 47.25 2.29 1.9238 2 2 4 48.96 21.49 1.8604 -4 0 2 49.16 6.75 1.8534 -2 1 9 49.18 6.93 1.8527 2 1 7 49.38 3.17 1.8457 0 0 10 50.16 9.75 1.8186 -2 2 7 50.18 9.41 1.8182 2 2 5 50.54 1.37 1.8060 0 3 3 51.05 3.00 1.7892 0 2 8 52.11 2.98 1.7550 0 1 10 53.47 2.58 1.7137 -2 2 8 53.48 2.52 1.7133 2 2 6 53.51 2.21 1.7124 -2 1 10 53.53 2.22 1.7119 2 1 8 53.98 1.05 1.6987 3 2 3 54.47 17.73 1.6846 -2 3 1 54.57 9.89 1.6818 0 3 5 55.68 1.27 1.6509 -4 1 6 55.69 1.50 1.6504 4 1 2 57.26 1.18 1.6089 0 1 11 57.92 3.05 1.5922 -4 0 8 57.94 2.89 1.5916 4 0 4 59.66 2.45 1.5498 -4 2 3 59.66 2.29 1.5497 -4 2 1 60.26 3.18 1.5357 0 3 7 60.35 1.07 1.5337 -4 2 4 60.39 4.33 1.5329 -4 1 8 60.41 4.07 1.5323 4 1 4 60.52 1.22 1.5298 -2 0 12 60.54 1.23 1.5293 2 0 10 62.58 3.03 1.4844 0 1 12 62.90 2.19 1.4776 -2 3 7 62.91 2.18 1.4774 2 3 5 63.33 1.11 1.4685 -4 1 9 65.33 1.91 1.4283 -2 2 11 65.35 1.92 1.4280 2 2 9 66.14 5.12 1.4128 0 4 1 66.80 1.55 1.4005 0 4 2 67.98 1.17 1.3789 -2 1 13 68.01 1.17 1.3785 2 1 11 72.06 1.15 1.3106 -4 0 12 72.10 1.20 1.3100 4 0 8 74.70 3.05 1.2707 -2 2 13 74.72 3.06 1.2704 2 2 11 74.79 1.01 1.2694 0 2 13 75.83 3.06 1.2546 0 3 11 76.29 1.25 1.2481 0 4 7 76.32 2.30 1.2477 -4 3 7 76.34 2.39 1.2475 4 3 3 79.23 1.03 1.2090 -6 1 4 79.24 1.04 1.2090 -6 1 2 81.21 1.14 1.1845 -4 3 9 83.87 2.15 1.1536 0 0 16 85.57 1.01 1.1350 0 3 13 86.50 1.61 1.1252 -4 4 3 86.50 1.51 1.1251 -4 4 1 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.