Labuntsovite-Mn Golovastikov N I Soviet Physics Crystallography 18 (1973) 950-955 Crystal structure of the alkali titanosilicate labuntsovite Sample: double cell _database_code_amcsd 0015562 CELL PARAMETERS: 14.1800 15.4800 13.7000 90.000 90.000 117.000 SPACE GROUP: B2/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 2679.468 Density (g/cm3): 2.724 MAX. ABS. INTENSITY / VOLUME**2: 6.073575189 RIR: 0.726 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 6.41 1.09 13.7928 0 1 0 2 9.52 16.53 9.2878 1 0 1 4 9.54 3.49 9.2694 1 -1 1 4 12.48 1.26 7.0899 -2 1 0 2 12.84 100.00 6.8964 0 2 0 2 12.92 29.83 6.8500 0 0 2 2 13.19 10.68 6.7119 -1 2 1 4 14.02 42.62 6.3172 2 0 0 2 14.07 81.86 6.2941 -2 2 0 2 17.98 4.62 4.9324 -2 3 0 2 18.01 7.11 4.9263 2 -1 2 4 18.25 29.41 4.8600 0 2 2 4 18.41 4.32 4.8202 1 2 1 4 18.46 4.02 4.8074 -1 3 1 4 19.15 9.61 4.6347 2 -2 2 4 19.31 1.30 4.5976 0 3 0 2 20.12 2.86 4.4137 3 -1 1 4 20.69 1.30 4.2929 1 -1 3 4 22.08 11.41 4.0256 3 0 1 4 22.16 4.29 4.0121 3 -3 1 4 23.01 3.81 3.8655 2 2 0 2 23.10 12.41 3.8496 -2 4 0 2 25.12 9.79 3.5450 -4 2 0 2 25.71 1.13 3.4650 -3 4 1 4 25.84 2.50 3.4482 0 4 0 2 25.92 1.70 3.4371 -4 1 0 2 26.48 4.60 3.3665 2 2 2 4 27.34 2.73 3.2624 3 -1 3 4 28.25 27.84 3.1586 4 0 0 2 28.35 57.48 3.1484 4 -2 2 4 28.36 31.26 3.1471 -4 4 0 2 28.99 44.08 3.0800 0 4 2 4 29.07 3.00 3.0721 4 -1 2 4 29.11 62.18 3.0675 0 2 4 4 29.67 34.96 3.0109 2 0 4 4 29.70 26.78 3.0084 2 -2 4 4 30.17 10.49 2.9618 3 2 1 4 30.52 23.69 2.9293 1 4 1 4 30.57 1.37 2.9241 -1 5 1 4 31.18 10.64 2.8684 4 0 2 4 31.28 6.09 2.8597 4 -4 2 4 31.72 2.98 2.8208 -2 5 2 4 31.76 1.55 2.8174 2 1 4 4 31.81 3.69 2.8133 -2 3 4 4 32.39 2.72 2.7643 5 -2 1 4 33.67 1.16 2.6618 5 -1 1 4 34.75 8.29 2.5814 -1 2 5 4 34.84 13.61 2.5747 2 4 0 2 34.95 21.50 2.5669 -2 6 0 2 35.00 32.25 2.5635 2 2 4 4 35.07 1.05 2.5589 0 5 2 4 35.07 16.15 2.5588 -2 4 4 4 35.53 2.09 2.5268 3 2 3 4 35.59 2.09 2.5225 -3 6 1 4 35.64 1.27 2.5191 -3 5 3 4 35.87 1.28 2.5033 -1 5 3 4 36.26 7.99 2.4773 4 2 0 2 36.43 18.70 2.4662 -4 6 0 2 36.48 21.38 2.4632 4 -2 4 4 36.99 15.07 2.4300 0 4 4 4 37.10 2.78 2.4235 4 -3 4 4 37.17 2.60 2.4189 1 2 5 4 37.46 1.37 2.4009 5 -2 3 4 38.11 4.24 2.3613 3 -2 5 4 38.60 1.27 2.3327 5 -1 3 4 38.78 1.56 2.3219 4 0 4 4 38.86 1.85 2.3173 4 -4 4 4 39.19 1.92 2.2988 0 6 0 2 39.27 1.49 2.2942 3 -3 5 4 40.28 1.21 2.2388 -6 1 0 2 40.31 2.56 2.2373 -3 6 3 4 40.62 4.78 2.2210 -1 4 5 4 41.20 1.45 2.1909 3 4 1 4 41.43 1.77 2.1793 0 6 2 4 41.50 3.99 2.1762 -3 4 5 4 41.54 1.63 2.1740 4 1 4 4 42.08 2.56 2.1474 2 0 6 4 42.95 6.54 2.1057 6 0 0 2 43.12 6.64 2.0980 -6 6 0 2 43.60 1.62 2.0757 1 6 1 4 43.90 5.45 2.0625 5 2 1 4 44.09 1.29 2.0541 -2 6 4 4 44.56 10.29 2.0333 3 2 5 4 44.81 2.65 2.0227 1 4 5 4 45.17 6.43 2.0073 4 2 4 4 45.31 8.10 2.0013 -4 6 4 4 45.39 2.26 1.9980 7 -4 1 4 46.17 2.65 1.9660 2 2 6 4 46.17 4.28 1.9660 5 -2 5 4 46.98 1.17 1.9341 1 0 7 4 47.02 4.69 1.9327 4 4 0 2 47.16 1.63 1.9271 6 -2 4 4 47.21 3.01 1.9251 6 -4 4 4 47.22 1.87 1.9248 -4 8 0 2 47.64 4.08 1.9087 0 6 4 4 47.77 5.15 1.9038 0 4 6 4 48.40 3.32 1.8808 7 -6 1 4 48.61 3.05 1.8731 -3 6 5 4 49.05 1.30 1.8571 -5 8 1 4 49.31 1.20 1.8481 4 -4 6 4 49.90 1.65 1.8275 -2 8 2 4 50.76 2.74 1.7987 6 2 0 2 50.90 1.40 1.7938 6 0 4 4 51.00 6.63 1.7907 -6 8 0 2 51.05 3.07 1.7891 6 -6 4 4 51.56 12.36 1.7725 -8 4 0 2 53.10 5.80 1.7246 3 4 5 4 53.12 8.21 1.7241 0 8 0 2 53.31 1.30 1.7186 -8 2 0 2 53.43 1.13 1.7148 -8 6 0 2 53.51 15.30 1.7125 0 0 8 2 54.52 6.34 1.6832 4 4 4 4 54.67 4.67 1.6790 4 2 6 4 54.70 11.70 1.6780 -4 8 4 4 54.79 3.19 1.6755 -4 6 6 4 54.91 1.20 1.6720 0 8 2 4 55.10 1.15 1.6669 8 -2 2 4 55.10 3.20 1.6668 1 6 5 4 55.22 1.55 1.6635 8 -6 2 4 55.27 1.30 1.6620 0 2 8 4 55.35 2.40 1.6599 5 2 5 4 55.60 1.26 1.6528 2 0 8 4 56.41 1.25 1.6312 6 -2 6 4 56.45 5.58 1.6300 6 -4 6 4 56.83 4.63 1.6200 0 6 6 4 57.42 1.28 1.6049 7 -2 5 4 57.53 1.54 1.6019 1 8 1 4 57.91 2.73 1.5925 6 2 4 4 58.13 2.89 1.5869 -6 8 4 4 58.44 1.86 1.5793 -3 8 5 4 58.86 1.31 1.5689 7 2 1 4 59.87 2.54 1.5449 6 -6 6 4 59.99 2.10 1.5420 4 -2 8 4 60.12 1.35 1.5389 8 0 2 4 60.25 9.87 1.5360 8 -2 4 4 60.36 3.06 1.5336 8 -8 2 4 60.37 6.09 1.5334 8 -6 4 4 61.19 1.90 1.5148 4 6 2 4 61.34 3.74 1.5113 1 0 9 4 61.42 3.47 1.5097 -4 10 2 4 61.52 2.68 1.5073 7 0 5 4 61.60 1.75 1.5055 4 0 8 4 61.66 2.61 1.5042 4 -4 8 4 62.01 2.22 1.4965 -2 10 0 2 63.36 1.11 1.4679 3 4 7 4 63.64 1.74 1.4621 -2 10 2 4 64.01 1.53 1.4546 3 6 5 4 65.03 3.83 1.4342 8 0 4 4 65.16 1.19 1.4316 3 0 9 4 65.25 4.02 1.4298 8 -8 4 4 65.53 2.03 1.4246 -2 6 8 4 66.05 8.10 1.4146 4 6 4 4 66.27 10.44 1.4104 -4 10 4 4 66.36 4.77 1.4087 4 2 8 4 66.47 5.85 1.4066 -4 6 8 4 66.62 3.68 1.4037 5 6 1 4 66.77 1.24 1.4009 -3 4 9 4 66.82 1.53 1.4001 8 -4 6 4 67.01 1.31 1.3965 9 0 1 4 67.78 1.94 1.3825 3 8 1 4 68.04 1.11 1.3780 8 2 2 4 68.49 1.07 1.3700 0 0 10 2 68.81 2.38 1.3644 9 -4 5 4 69.22 2.96 1.3573 1 4 9 4 70.10 4.29 1.3424 -5 10 5 4 70.32 2.02 1.3387 2 -2 10 4 71.03 2.62 1.3270 9 -2 5 4 72.43 2.28 1.3048 10 -4 4 4 72.50 2.15 1.3038 10 -6 4 4 73.50 1.18 1.2885 6 6 0 2 73.57 2.88 1.2874 4 8 0 2 73.83 1.75 1.2835 -4 12 0 2 73.85 1.15 1.2832 -6 12 0 2 73.95 2.06 1.2817 4 4 8 4 74.11 3.22 1.2794 0 10 4 4 74.21 2.49 1.2779 4 -2 10 4 74.25 1.13 1.2772 -1 10 5 4 74.53 4.07 1.2732 0 4 10 4 75.08 1.44 1.2652 4 8 2 4 75.21 1.30 1.2634 6 4 6 4 75.35 1.76 1.2614 10 -2 4 4 75.54 2.39 1.2586 10 -8 4 4 76.86 1.04 1.2403 6 2 8 4 76.98 1.20 1.2387 8 4 0 2 77.05 1.68 1.2377 -6 8 8 4 77.51 3.51 1.2316 8 -4 8 4 78.72 2.11 1.2156 7 -4 9 4 78.77 1.16 1.2150 0 8 8 4 79.20 1.68 1.2094 2 4 10 4 80.13 1.23 1.1977 8 2 6 4 80.95 1.38 1.1877 7 -6 9 4 86.33 1.09 1.1269 -2 10 8 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.