Baotite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from the powder pattern for R060414 Nekrasov Yu V, Ponomarev V I, Simonov V I, Kheiker D M Soviet Physics - Crystallography 14 (1969) 508-514 Refinement of the atomic structure of baotite and the isomorphic relationships in this mineral CELL PARAMETERS: 19.99332 19.99332 5.893003 90.00000 90.00000 90.00000 ALTERNATE SETTING FOR SPACE GROUP: I4_1/a X-RAY WAVELENGTH: 1.541838 2-THETA INTENSITY D-SPACING H K L 8.91 8.65 9.9967 2 0 0 15.74 51.00 5.6526 1 0 1 17.80 14.02 4.9983 4 0 0 22.07 20.90 4.0384 3 2 1 22.07 62.49 4.0384 2 3 1 23.82 6.00 3.7444 4 1 1 23.82 17.10 3.7444 1 4 1 25.25 100.00 3.5344 4 4 0 26.81 7.80 3.3322 6 0 0 27.00 38.18 3.3088 5 0 1 27.00 1.01 3.3088 4 3 1 27.00 41.59 3.3088 3 4 1 28.28 55.83 3.1612 6 2 0 28.28 43.65 3.1612 2 6 0 28.46 38.35 3.1412 5 2 1 28.46 23.25 3.1412 2 5 1 31.05 45.32 2.8845 1 1 2 31.21 87.59 2.8706 6 1 1 31.21 5.78 2.8706 1 6 1 32.34 52.18 2.7726 4 6 0 32.50 1.40 2.7591 4 5 1 33.60 35.16 2.6707 3 1 2 33.60 15.30 2.6707 1 3 2 33.75 7.69 2.6596 6 3 1 34.95 17.38 2.5702 7 0 1 35.99 66.17 2.4983 3 3 2 35.98 4.36 2.4992 8 0 0 36.13 24.01 2.4893 7 2 1 36.13 1.67 2.4893 2 7 1 37.12 1.26 2.4245 2 8 0 38.25 5.18 2.3555 1 5 2 38.24 13.64 2.3562 6 6 0 38.38 1.92 2.3479 5 6 1 39.46 8.07 2.2857 4 7 1 39.46 7.51 2.2857 8 1 1 40.40 10.45 2.2347 5 3 2 40.40 64.91 2.2347 3 5 2 40.39 12.58 2.2353 4 8 0 40.39 2.21 2.2353 8 4 0 41.56 1.10 2.1749 3 8 1 43.58 2.90 2.0787 9 0 1 44.44 22.45 2.0401 7 1 2 44.44 2.72 2.0401 1 7 2 44.44 5.99 2.0401 5 5 2 44.55 4.40 2.0352 2 9 1 44.55 12.39 2.0352 6 7 1 45.40 2.20 1.9993 10 0 0 45.40 2.52 1.9993 6 8 0 45.40 11.96 1.9993 8 6 0 45.52 8.04 1.9942 8 5 1 45.52 18.16 1.9942 5 8 1 46.35 2.46 1.9601 3 7 2 46.34 8.20 1.9605 10 2 0 46.34 23.74 1.9605 2 10 0 46.48 4.08 1.9549 1 0 3 47.40 15.28 1.9193 9 4 1 48.32 2.49 1.8849 10 1 1 48.32 6.14 1.8849 1 10 1 49.11 1.64 1.8563 10 4 0 49.11 3.82 1.8563 4 10 0 49.24 3.76 1.8516 3 2 3 49.24 7.33 1.8516 2 3 3 50.01 18.51 1.8248 7 5 2 50.01 8.42 1.8248 5 7 2 50.13 1.96 1.8206 1 4 3 50.12 1.11 1.8213 10 3 1 50.12 3.35 1.8213 3 10 1 51.00 1.68 1.7918 8 7 1 51.77 1.50 1.7669 9 1 2 51.77 48.27 1.7669 1 9 2 51.89 3.84 1.7631 5 0 3 51.89 6.24 1.7631 3 4 3 51.87 4.62 1.7637 9 6 1 51.87 1.31 1.7637 6 9 1 52.75 4.84 1.7363 5 2 3 52.75 3.71 1.7363 2 5 3 52.73 3.79 1.7368 11 0 1 53.48 11.25 1.7141 3 9 2 53.47 7.68 1.7144 10 6 0 53.47 10.58 1.7144 6 10 0 53.58 4.73 1.7112 2 11 1 53.58 4.27 1.7112 10 5 1 54.44 16.43 1.6862 6 1 3 55.16 30.86 1.6659 7 7 2 55.97 11.45 1.6434 12 2 0 56.10 1.24 1.6401 6 3 3 56.08 1.57 1.6406 4 11 1 56.80 4.21 1.6214 9 5 2 56.80 5.21 1.6214 5 9 2 56.91 4.02 1.6185 7 0 3 57.72 5.41 1.5977 7 2 3 57.71 1.12 1.5981 9 8 1 57.71 1.22 1.5981 1 12 1 58.41 2.82 1.5806 4 12 0 58.41 2.60 1.5806 12 4 0 58.51 1.40 1.5781 10 7 1 58.51 3.58 1.5781 7 10 1 59.20 3.37 1.5612 8 10 0 59.20 5.98 1.5612 10 8 0 59.30 4.99 1.5588 12 3 1 60.00 2.68 1.5423 11 1 2 60.11 3.29 1.5398 8 1 3 60.11 2.45 1.5398 4 7 3 60.09 2.87 1.5402 6 11 1 61.56 4.49 1.5069 9 7 2 61.56 4.03 1.5069 3 11 2 62.32 6.44 1.4902 6 12 0 62.32 1.30 1.4902 12 6 0 63.12 21.54 1.4733 0 0 4 63.19 1.78 1.4719 13 2 1 63.96 1.93 1.4559 2 9 3 63.96 3.57 1.4559 6 7 3 64.61 2.55 1.4427 11 5 2 64.72 3.32 1.4407 8 5 3 64.72 5.63 1.4407 5 8 3 64.70 1.85 1.4410 10 9 1 65.36 1.72 1.4281 14 0 0 65.45 3.39 1.4262 11 8 1 65.45 3.42 1.4262 8 11 1 65.45 5.71 1.4262 4 13 1 66.10 1.29 1.4137 14 2 0 66.21 5.51 1.4116 9 4 3 66.96 2.34 1.3978 1 10 3 66.94 1.44 1.3981 12 7 1 66.94 1.38 1.3981 7 12 1 68.32 4.16 1.3731 4 14 0 68.43 1.45 1.3712 3 10 3 69.08 9.77 1.3598 4 4 4 69.06 8.48 1.3602 7 11 2 69.06 4.77 1.3602 13 1 2 69.14 8.14 1.3588 3 14 1 69.81 1.32 1.3474 6 0 4 69.89 2.14 1.3461 9 6 3 70.53 7.60 1.3354 6 2 4 70.53 5.08 1.3354 2 6 4 70.51 38.51 1.3357 13 3 2 70.61 1.41 1.3341 11 0 3 71.33 1.84 1.3224 2 11 3 71.33 1.93 1.3224 10 5 3 72.03 1.88 1.3112 5 14 1 72.03 3.23 1.3112 11 10 1 72.68 8.01 1.3010 4 6 4 72.74 2.64 1.3000 15 0 1 72.74 6.52 1.3000 12 9 1 72.74 3.35 1.3000 9 12 1 73.37 2.42 1.2904 13 5 2 73.37 5.24 1.2904 5 13 2 74.07 1.06 1.2799 12 10 0 74.16 1.15 1.2786 8 13 1 74.16 2.78 1.2786 13 8 1 74.79 10.15 1.2695 11 9 2 75.59 1.38 1.2580 7 10 3 75.57 2.49 1.2582 4 15 1 76.22 2.74 1.2492 6 6 4 76.19 2.99 1.2496 16 0 0 76.29 1.98 1.2481 12 3 3 76.89 1.05 1.2399 16 2 0 76.89 1.95 1.2399 8 14 0 76.99 1.17 1.2385 6 11 3 77.61 3.78 1.2301 4 8 4 77.59 1.12 1.2304 7 13 2 78.37 1.25 1.2201 1 16 1 78.98 1.94 1.2122 15 1 2 79.06 3.35 1.2111 15 6 1 80.37 1.94 1.1947 3 15 2 81.08 1.06 1.1860 10 0 4 81.08 3.08 1.1860 8 6 4 81.08 1.30 1.1860 6 8 4 81.15 1.12 1.1851 10 9 3 81.76 2.40 1.1778 10 2 4 81.76 6.92 1.1778 2 10 4 81.84 1.62 1.1769 8 11 3 81.84 1.95 1.1769 11 8 3 81.84 2.82 1.1769 4 13 3 82.42 5.50 1.1700 16 6 0 83.12 2.13 1.1620 15 5 2 83.12 1.43 1.1620 13 9 2 83.11 1.15 1.1621 10 14 0 83.82 1.08 1.1540 4 10 4 83.92 1.33 1.1528 2 3 5 83.88 1.46 1.1533 17 0 1 85.26 4.87 1.1381 3 14 3 85.97 1.53 1.1305 5 0 5 85.97 1.60 1.1305 3 4 5 86.66 1.10 1.1234 2 5 5 86.66 1.52 1.1234 5 2 5 86.61 1.14 1.1238 16 7 1 87.24 3.74 1.1174 6 10 4 87.24 3.55 1.1174 10 6 4 87.21 1.42 1.1177 8 16 0 88.02 4.07 1.1094 6 1 5 87.89 1.41 1.1107 18 0 0 87.99 1.92 1.1097 11 10 3 87.97 1.54 1.1099 13 12 1 88.67 3.73 1.1029 12 9 3 88.67 1.73 1.1029 9 12 3 88.67 1.51 1.1029 15 0 3 89.28 6.09 1.0970 12 2 4 89.94 4.53 1.0907 1 17 2 89.94 2.30 1.0907 11 13 2 90.03 1.85 1.0898 13 8 3 90.03 1.85 1.0898 13 8 3 XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.