Johninnesite Grice J D, Dunn P J American Mineralogist 79 (1994) 991-995 Johninnesite: Crystal-structure determination and its relationship to other arsenosilicates _database_code_amcsd 0001674 CELL PARAMETERS: 10.4850 11.0650 9.6540 107.110 81.170 111.860 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 992.263 Density (g/cm3): 3.445 MAX. ABS. INTENSITY / VOLUME**2: 8.348371966 RIR: 0.789 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 8.91 100.00 9.9204 0 1 0 2 9.10 31.20 9.7191 1 0 0 2 9.60 10.24 9.2154 0 0 1 2 11.29 2.66 7.8370 0 -1 1 2 12.06 13.26 7.3372 1 -1 1 2 13.56 2.40 6.5277 -1 0 1 2 14.81 25.21 5.9832 1 1 0 2 16.87 15.80 5.2546 1 -2 1 2 17.02 2.16 5.2087 -1 2 0 2 17.88 6.11 4.9602 0 2 0 2 18.19 11.48 4.8771 2 -1 1 2 20.23 8.81 4.3892 2 0 1 2 20.35 2.88 4.3644 2 -2 1 2 20.69 1.99 4.2936 -2 2 0 2 20.92 6.62 4.2457 1 0 2 2 21.09 3.39 4.2132 -2 0 1 2 21.36 3.86 4.1603 -2 1 1 2 21.75 6.91 4.0859 -1 0 2 2 21.96 10.04 4.0472 -1 2 1 2 22.44 9.63 3.9612 0 2 1 2 22.69 3.05 3.9185 0 -2 2 2 22.78 37.75 3.9043 1 2 0 2 22.84 6.63 3.8943 -1 -1 2 2 23.00 3.71 3.8668 2 1 0 2 23.05 11.24 3.8583 -1 -2 1 2 24.24 11.61 3.6715 1 -3 1 2 24.26 4.71 3.6686 2 -2 2 2 25.52 11.35 3.4901 2 1 1 2 25.71 5.51 3.4653 2 -3 1 2 25.84 3.81 3.4476 1 1 2 2 25.98 3.83 3.4296 2 0 2 2 26.17 3.02 3.4048 0 -3 1 2 26.24 7.58 3.3966 3 -1 1 2 26.38 33.24 3.3790 1 2 1 2 26.74 2.09 3.3343 3 -2 1 2 26.85 2.07 3.3208 -2 3 0 2 26.96 3.14 3.3068 0 3 0 2 27.09 10.31 3.2916 -1 -2 2 2 27.17 1.53 3.2826 -3 2 0 2 27.53 60.65 3.2397 3 0 0 2 28.14 4.97 3.1714 2 -3 2 2 28.36 4.75 3.1470 -2 1 2 2 28.75 3.10 3.1049 3 0 1 2 28.88 1.86 3.0916 0 -3 2 2 29.23 16.18 3.0557 -2 -1 2 2 29.67 2.19 3.0107 -1 3 1 2 29.72 2.32 3.0063 3 -2 2 2 30.11 16.01 2.9677 3 -3 1 2 30.23 5.09 2.9564 -2 -2 1 2 30.87 8.94 2.8963 -3 2 1 2 30.91 7.30 2.8926 -1 -3 1 2 30.93 1.55 2.8909 2 -2 3 2 30.96 1.82 2.8881 -1 0 3 2 31.00 5.64 2.8845 0 3 1 2 31.25 1.27 2.8624 -3 3 0 2 31.45 24.63 2.8445 1 3 0 2 32.07 2.84 2.7908 -2 2 2 2 32.56 2.25 2.7499 1 -3 3 2 32.59 1.27 2.7475 1 -4 1 2 32.67 2.03 2.7410 0 1 3 2 33.00 6.33 2.7142 3 0 2 2 33.09 3.62 2.7073 -3 -1 1 2 33.40 2.83 2.6824 -1 -3 2 2 33.42 87.83 2.6810 2 -3 3 2 33.51 90.64 2.6743 -1 1 3 2 33.61 1.37 2.6665 -2 -2 2 2 34.07 13.84 2.6314 -1 4 0 2 34.44 1.72 2.6044 -2 4 0 2 34.57 4.05 2.5943 4 -2 1 2 34.84 21.04 2.5752 -4 1 0 2 34.89 1.49 2.5715 1 3 1 2 35.05 14.40 2.5604 -4 2 0 2 35.23 1.23 2.5473 -3 3 1 2 35.32 3.22 2.5409 3 -2 3 2 35.33 3.60 2.5403 -2 0 3 2 36.21 8.56 2.4805 -2 -1 3 2 36.22 27.76 2.4801 0 4 0 2 36.26 8.77 2.4774 3 -1 3 2 36.50 1.02 2.4620 4 -3 1 2 36.71 1.02 2.4482 3 -4 2 2 36.75 8.57 2.4457 3 -3 3 2 36.81 9.84 2.4418 -2 1 3 2 36.86 1.11 2.4385 4 -2 2 2 37.00 6.70 2.4298 4 0 0 2 37.25 3.34 2.4139 -3 4 0 2 37.37 4.19 2.4066 -4 1 1 2 37.58 4.36 2.3932 -4 3 0 2 37.62 1.49 2.3910 1 -1 4 2 37.82 2.14 2.3787 4 0 1 2 37.93 2.33 2.3720 4 -1 2 2 38.05 1.59 2.3651 3 1 2 2 38.06 13.03 2.3642 2 -4 3 2 38.08 2.59 2.3633 3 2 0 2 38.10 1.79 2.3621 1 -4 3 2 38.19 13.95 2.3565 -1 2 3 2 38.24 2.38 2.3534 0 2 3 2 38.40 5.25 2.3440 -1 -3 3 2 38.49 5.68 2.3387 -3 -2 1 2 38.53 4.45 2.3365 2 1 3 2 38.79 2.78 2.3213 -4 0 1 2 39.12 2.63 2.3029 2 -2 4 2 39.32 7.22 2.2916 -2 -2 3 2 39.41 6.67 2.2864 3 0 3 2 40.14 1.66 2.2465 -1 -1 4 2 40.31 2.87 2.2373 3 -4 3 2 40.41 1.73 2.2322 0 -4 3 2 40.42 1.96 2.2317 -2 2 3 2 40.51 1.58 2.2266 4 -4 1 2 40.54 8.39 2.2255 1 4 0 2 40.70 2.65 2.2171 2 3 1 2 40.96 1.01 2.2033 -1 -4 2 2 41.15 4.41 2.1939 -4 3 1 2 41.20 6.91 2.1911 4 1 0 2 41.31 1.23 2.1856 -3 4 1 2 41.35 3.61 2.1836 -3 3 2 2 41.58 3.50 2.1719 0 -3 4 2 42.03 4.73 2.1497 4 -3 3 2 42.07 5.08 2.1478 -3 1 3 2 42.09 2.18 2.1466 1 -5 2 2 42.53 2.11 2.1258 4 1 1 2 42.59 4.28 2.1229 2 0 4 2 42.85 1.80 2.1105 -2 5 0 2 43.27 2.10 2.0911 -1 5 0 2 44.03 1.85 2.0568 3 -1 4 2 44.27 7.07 2.0460 -5 1 0 2 44.28 2.94 2.0454 2 -5 3 2 44.44 3.20 2.0384 -1 3 3 2 44.53 1.93 2.0348 -3 5 0 2 44.56 1.64 2.0335 4 -4 3 2 44.59 1.13 2.0323 3 2 2 2 44.64 1.14 2.0300 -3 2 3 2 45.01 4.21 2.0141 1 -5 3 2 45.04 1.52 2.0127 5 -2 2 2 45.18 5.02 2.0068 0 3 3 2 45.30 1.04 2.0019 -3 -3 1 2 45.48 1.66 1.9944 3 3 0 2 45.60 1.63 1.9892 3 -5 3 2 45.68 2.06 1.9861 2 3 2 2 45.74 1.47 1.9835 -2 3 3 2 46.52 3.32 1.9521 2 4 0 2 46.63 1.71 1.9477 5 -1 2 2 47.00 3.49 1.9334 4 2 0 2 48.12 2.07 1.8909 -4 5 0 2 48.77 12.16 1.8673 5 -3 3 2 48.79 11.65 1.8666 -4 1 3 2 48.84 1.25 1.8648 4 -5 3 2 49.49 3.08 1.8417 1 2 4 2 49.70 1.08 1.8343 4 -4 4 2 49.91 2.77 1.8271 1 -5 4 2 50.27 2.38 1.8151 3 -5 4 2 50.40 1.78 1.8106 5 -4 3 2 50.46 1.91 1.8086 -4 2 3 2 50.59 5.07 1.8043 -2 -4 3 2 50.75 4.35 1.7990 3 2 3 2 50.90 10.95 1.7939 5 1 0 2 51.40 2.48 1.7777 -3 -3 3 2 51.53 2.23 1.7735 4 1 3 2 51.55 1.80 1.7728 -4 4 2 2 51.66 1.73 1.7692 2 -6 3 2 51.85 1.28 1.7634 -1 4 3 2 51.88 2.83 1.7625 -2 6 0 2 52.14 1.55 1.7541 -1 -5 3 2 52.21 1.38 1.7520 3 3 2 2 52.33 1.44 1.7484 2 3 3 2 52.52 1.65 1.7425 0 -5 4 2 52.72 3.00 1.7362 -3 6 0 2 52.93 6.19 1.7300 1 -6 3 2 53.04 1.11 1.7265 -3 -2 4 2 53.12 6.91 1.7241 0 4 3 2 53.52 1.50 1.7121 -1 3 4 2 53.69 1.08 1.7072 6 -3 2 2 53.70 1.93 1.7070 -6 3 0 2 53.75 2.94 1.7053 0 -4 5 2 53.77 5.32 1.7048 3 4 0 2 54.02 2.00 1.6974 4 3 0 2 54.08 2.38 1.6959 0 3 4 2 54.57 1.93 1.6816 4 -6 3 2 54.72 1.60 1.6774 -3 4 3 2 55.33 1.21 1.6604 -4 6 0 2 55.54 1.82 1.6547 -6 2 1 2 55.78 3.68 1.6479 2 5 0 2 56.03 3.71 1.6413 -6 4 0 2 56.08 1.15 1.6399 -2 1 5 2 56.38 1.24 1.6319 -4 0 4 2 56.52 4.45 1.6283 5 2 0 2 56.62 2.29 1.6257 6 -3 3 2 56.62 1.63 1.6256 -5 1 3 2 56.62 1.26 1.6255 2 1 5 2 56.77 1.26 1.6216 -1 -5 4 2 56.84 4.08 1.6199 6 0 0 2 57.26 34.87 1.6090 1 -2 6 2 57.51 7.82 1.6025 6 -4 3 2 57.55 8.49 1.6014 -5 2 3 2 57.70 2.07 1.5976 -4 -1 4 2 57.73 7.02 1.5968 -3 -4 3 2 57.89 7.06 1.5928 4 2 3 2 58.04 1.53 1.5892 1 -3 6 2 58.04 2.10 1.5890 -2 -5 3 2 58.11 2.55 1.5874 6 -5 2 2 58.11 1.81 1.5873 1 -1 6 2 58.23 1.43 1.5845 3 3 3 2 58.31 1.40 1.5823 3 2 4 2 59.28 1.20 1.5589 0 6 1 2 59.54 1.10 1.5526 2 -1 6 2 59.54 2.26 1.5525 -5 6 0 2 59.59 6.17 1.5515 -4 -3 3 2 59.72 6.32 1.5484 5 1 3 2 59.91 2.05 1.5439 1 6 0 2 59.91 12.04 1.5439 3 -7 3 2 59.91 1.55 1.5439 -6 5 0 2 59.97 11.71 1.5426 2 -7 3 2 60.01 3.67 1.5416 6 -5 3 2 60.09 4.34 1.5398 -5 3 3 2 60.10 11.29 1.5395 -2 5 3 2 60.17 11.48 1.5379 -1 5 3 2 60.75 1.36 1.5246 5 -3 5 2 61.29 1.01 1.5124 6 -3 4 2 61.48 2.07 1.5082 -2 7 0 2 61.93 2.69 1.4983 5 -6 4 2 62.05 3.26 1.4958 4 4 0 2 62.17 1.87 1.4931 -4 3 4 2 62.34 1.50 1.4894 0 -4 6 2 62.51 2.17 1.4858 2 0 6 2 63.07 1.00 1.4739 -3 2 5 2 64.00 1.51 1.4548 6 -6 3 2 64.11 2.13 1.4526 -5 4 3 2 64.29 1.05 1.4489 1 4 4 2 64.57 7.33 1.4432 -7 4 0 2 64.65 2.04 1.4418 -2 -2 6 2 64.69 1.39 1.4409 5 -7 3 2 64.72 2.13 1.4403 4 -2 6 2 64.85 1.62 1.4377 -4 5 3 2 65.18 2.54 1.4312 -3 -5 3 2 65.37 2.69 1.4276 4 3 3 2 65.39 2.04 1.4271 -6 1 3 2 65.40 2.04 1.4269 7 -3 3 2 65.69 1.02 1.4214 7 -4 3 2 65.72 1.04 1.4208 -6 2 3 2 66.45 1.34 1.4069 -2 -6 3 2 66.59 1.22 1.4044 -6 0 3 2 66.63 1.14 1.4036 7 -2 3 2 66.66 1.17 1.4031 3 4 3 2 66.68 1.39 1.4026 0 -5 6 2 66.86 1.52 1.3994 -1 7 1 2 66.89 1.56 1.3989 -5 7 0 2 66.92 1.80 1.3983 2 1 6 2 67.45 1.73 1.3884 7 0 0 2 67.64 2.74 1.3851 -7 5 0 2 68.21 1.95 1.3749 2 -6 6 2 68.46 1.14 1.3705 0 2 6 2 68.69 5.57 1.3664 -5 -3 3 2 68.79 3.17 1.3648 -3 -1 6 2 68.81 2.38 1.3643 5 -3 6 2 68.82 5.33 1.3641 6 1 3 2 68.91 1.37 1.3627 5 -4 6 2 68.95 1.80 1.3620 -3 0 6 2 69.52 5.19 1.3521 1 -6 6 2 69.79 4.43 1.3475 1 2 6 2 70.21 1.63 1.3405 4 -6 6 2 70.38 1.26 1.3378 1 7 0 2 70.41 2.15 1.3372 -2 2 6 2 71.41 3.75 1.3209 -3 8 0 2 71.74 2.35 1.3157 -2 8 0 2 72.10 1.23 1.3100 -7 6 0 2 72.60 4.57 1.3022 -4 8 0 2 72.87 1.54 1.2981 -3 -3 6 2 72.96 1.12 1.2966 8 -2 1 2 73.61 1.60 1.2869 2 0 7 2 73.66 1.09 1.2861 -3 -6 3 2 73.86 1.19 1.2830 4 4 3 2 74.05 4.17 1.2802 -8 4 0 2 74.28 1.66 1.2768 7 -1 4 2 75.22 1.19 1.2632 -6 -1 4 2 75.30 1.39 1.2621 4 -5 7 2 75.79 1.07 1.2551 -2 0 7 2 78.73 1.29 1.2154 2 -9 2 2 78.77 2.12 1.2149 8 0 0 2 79.40 2.74 1.2069 -6 8 0 2 80.04 2.15 1.1989 -4 -3 6 2 80.21 2.07 1.1967 6 -1 6 2 82.26 1.74 1.1720 -2 -6 6 2 82.58 2.26 1.1682 4 2 6 2 84.22 1.58 1.1497 7 -6 6 2 84.35 1.46 1.1483 -5 2 6 2 84.57 1.05 1.1458 -4 -4 6 2 84.81 1.05 1.1432 6 0 6 2 87.71 2.29 1.1127 2 8 0 2 87.98 1.05 1.1100 8 -8 3 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.