Lillianite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R110141 Takagi J, Takeuchi Y Acta Crystallographica B28 (1972) 649-651 The crystal structure of lillianite Locality: Tsubakihara mine, Gifu Prefecture, Japan _database_code_amcsd 0018399 CELL PARAMETERS: 13.5170 20.0270 4.0997 90.000 90.000 90.000 SPACE GROUP: Bbmm ATOM X Y Z OCCUPANCY ISO(B) Pb 0.08960 0.13380 0.50000 0.500 1.580 Bi 0.08960 0.13380 0.50000 0.500 1.580 Pb 0.36350 0.04950 0.50000 0.500 1.190 Bi 0.36350 0.04950 0.50000 0.500 1.190 Pb 0.32390 0.25000 0.00000 1.000 3.020 S 0.23860 0.09560 0.00000 1.000 2.020 S 0.00000 0.00000 0.50000 1.000 2.160 S 0.18220 0.25000 0.50000 1.000 1.620 S 0.45610 0.16300 0.50000 1.000 1.420 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 12 +/- 18 +/- 3 MAX. ABS. INTENSITY / VOLUME**2: 163.3162867 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 8.83 4.97 10.0135 0 2 0 15.82 1.64 5.6019 2 2 0 17.71 1.49 5.0068 0 4 0 22.10 17.12 4.0231 2 4 0 22.66 4.08 3.9232 1 0 1 23.10 3.12 3.8500 1 1 1 24.37 29.77 3.6529 1 2 1 25.86 100.00 3.4457 2 5 0 26.35 57.98 3.3824 1 3 1 26.37 23.45 3.3793 4 0 0 26.71 2.10 3.3378 0 6 0 26.75 17.65 3.3321 4 1 0 27.86 4.34 3.2018 4 2 0 28.91 13.31 3.0881 1 4 1 29.63 1.07 3.0150 4 3 0 29.80 45.55 2.9981 3 1 1 29.85 13.32 2.9927 2 6 0 30.81 60.26 2.9022 3 2 1 32.43 33.28 2.7608 3 3 1 34.03 10.38 2.6347 2 7 0 35.87 2.36 2.5034 0 8 0 37.19 2.17 2.4176 3 5 1 38.96 13.85 2.3116 1 7 1 40.21 1.13 2.2427 5 1 1 41.35 1.64 2.1835 4 7 0 42.27 11.36 2.1380 5 3 1 42.34 3.69 2.1346 6 3 0 42.85 32.28 2.1103 1 8 1 44.01 27.29 2.0575 5 4 1 44.08 16.68 2.0544 6 4 0 44.18 23.00 2.0498 0 0 2 45.28 9.62 2.0027 0 10 0 46.17 11.30 1.9662 5 5 1 46.23 6.30 1.9636 6 5 0 46.94 2.73 1.9356 1 9 1 47.07 12.61 1.9305 3 8 1 48.70 4.22 1.8696 5 6 1 48.77 2.19 1.8673 6 6 0 49.02 5.56 1.8585 4 9 0 49.93 3.35 1.8264 2 4 2 50.90 8.36 1.7940 3 9 1 51.58 5.61 1.7719 5 7 1 51.64 2.10 1.7700 6 7 0 51.90 26.24 1.7617 2 5 2 52.02 2.12 1.7580 2 11 0 52.19 6.82 1.7526 4 0 2 52.37 6.58 1.7469 7 0 1 52.41 4.80 1.7459 4 1 2 52.59 3.87 1.7403 7 1 1 53.05 1.55 1.7264 4 2 2 53.16 7.56 1.7229 4 10 0 53.23 2.82 1.7209 7 2 1 54.24 3.60 1.6912 2 6 2 54.50 4.29 1.6836 8 1 0 54.76 2.88 1.6763 5 8 1 54.82 1.26 1.6746 6 8 0 55.13 4.47 1.6661 8 2 0 56.15 1.91 1.6380 8 3 0 56.92 4.42 1.6179 2 7 2 62.02 3.38 1.4964 4 12 0 62.85 1.98 1.4785 6 3 2 63.64 3.99 1.4621 3 12 1 64.18 8.80 1.4511 6 4 2 65.04 7.11 1.4339 1 13 1 65.12 5.53 1.4325 0 10 2 65.87 3.92 1.4180 6 5 2 66.80 1.87 1.4005 8 8 0 67.90 1.30 1.3804 6 6 2 68.10 3.36 1.3768 4 9 2 68.26 3.41 1.3741 7 9 1 68.29 3.37 1.3735 3 13 1 69.21 1.20 1.3574 9 4 1 69.81 1.22 1.3473 1 2 3 69.90 1.89 1.3457 8 9 0 70.01 1.15 1.3439 1 14 1 70.13 1.25 1.3419 5 12 1 70.26 1.47 1.3397 6 7 2 70.58 1.37 1.3344 2 11 2 70.71 2.70 1.3323 1 3 3 70.84 7.84 1.3302 9 5 1 71.17 1.63 1.3248 10 3 0 71.54 5.33 1.3189 4 10 2 71.69 4.24 1.3165 7 10 1 72.11 1.78 1.3098 2 15 0 72.42 2.51 1.3050 3 1 3 72.67 3.02 1.3010 8 1 2 72.80 1.22 1.2990 9 6 1 72.95 1.05 1.2969 6 8 2 72.96 3.35 1.2967 3 2 3 73.21 3.17 1.2929 8 2 2 73.84 2.30 1.2833 3 3 3 74.09 1.52 1.2796 8 3 2 75.10 2.68 1.2649 9 7 1 77.77 1.21 1.2280 1 7 3 79.26 2.96 1.2086 4 12 2 79.29 1.64 1.2082 5 14 1 79.41 3.61 1.2067 7 12 1 79.97 1.22 1.1997 5 3 3 80.37 3.68 1.1948 1 8 3 80.81 1.40 1.1894 10 8 0 81.17 3.09 1.1850 5 4 3 81.83 5.09 1.1771 11 0 1 82.72 1.77 1.1667 5 5 3 83.25 1.57 1.1606 2 17 0 83.38 1.68 1.1591 3 8 3 83.62 1.71 1.1564 8 8 2 86.28 1.38 1.1275 3 9 3 86.52 1.83 1.1249 8 9 2 87.44 1.25 1.1155 7 0 3 87.71 1.61 1.1127 10 3 2 88.61 1.83 1.1037 2 15 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.