Kupletskite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R110176 Piilonen P C, McDonald A M, Lalonde A E The Canadian Mineralogist 41 (2003) 27-54 Insights into astrophyllite-group minerals II: Crystal chemistry Note: sample NOR17, alkali granite Locality: Gjerdingen intrusion, Norway _database_code_amcsd 0005804 CELL PARAMETERS: 5.4070 11.9250 11.7370 113.020 94.780 103.270 SPACE GROUP: P-1 ATOM X Y Z OCCUPANCY ISO(B) Mn 0.84940 0.20507 0.47814 0.898 0.758 Na 0.84940 0.20507 0.47814 0.102 0.758 Mn 0.27970 0.06681 0.48767 0.985 0.845 Mn 0.42220 0.35156 0.48427 1.000 0.845 Mn 0.00000 0.50000 0.50000 0.500 0.766 Ti 0.08010 0.08649 0.19765 0.900 0.671 Nb 0.08010 0.08649 0.19765 0.100 0.671 Si 0.67880 0.27190 0.23130 1.000 0.750 Si 0.81410 0.54670 0.25460 1.000 0.805 Si 0.37980 0.67580 0.25660 1.000 0.805 Si 0.50740 0.93180 0.23530 1.000 0.734 K 0.13320 0.26160 0.99540 0.871 3.561 Na 0.09700 0.18900 0.99700 0.129 3.561 Na 0.50000 0.00000 0.00000 0.441 1.082 Ca 0.50000 0.00000 0.00000 0.059 1.082 O 0.72830 0.31870 0.38320 1.000 0.947 O 0.14840 0.15990 0.36860 1.000 1.019 O 0.12860 0.39220 0.59360 1.000 0.916 OH 0.29720 0.46240 0.39900 1.000 1.026 OH 0.99270 0.11850 0.59380 1.000 1.082 O 0.55720 0.25790 0.59130 1.000 0.963 O 0.57470 0.01400 0.38780 1.000 0.971 O 0.07440 0.59190 0.20270 1.000 1.232 O 0.24670 0.03990 0.82730 1.000 2.590 O 0.42840 0.41340 0.79830 1.000 1.216 O 0.12620 0.80770 0.83050 1.000 2.621 O 0.26310 0.95720 0.17170 1.000 2.511 O 0.26820 0.60660 0.80630 1.000 1.737 O 0.57200 0.22150 0.80200 1.000 1.721 O 0.38220 0.19050 0.16830 1.000 2.550 F 0.00000 0.00000 0.00000 0.500 1.287 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 4 +/- 9 +/- 9 MAX. ABS. INTENSITY / VOLUME**2: 27.25051026 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 8.34 100.00 10.5988 0 0 1 8.41 17.14 10.5176 0 1 0 9.00 6.38 9.8273 0 -1 1 15.32 4.65 5.7844 0 -2 1 20.12 4.08 4.4140 -1 -1 1 20.37 1.97 4.3595 -1 2 0 20.52 3.47 4.3272 1 -2 1 20.54 2.42 4.3245 1 0 1 21.81 3.18 4.0744 0 2 1 23.11 1.80 3.8490 0 -3 1 23.48 1.81 3.7896 -1 2 1 23.64 2.33 3.7641 1 -1 2 23.67 2.85 3.7595 0 -2 3 23.88 3.66 3.7268 1 -2 2 23.99 2.51 3.7093 -1 1 2 25.21 22.74 3.5329 0 0 3 25.29 6.27 3.5218 1 1 1 25.41 1.18 3.5059 0 3 0 27.23 6.83 3.2748 -1 -1 3 28.52 1.60 3.1293 0 2 2 28.85 5.21 3.0942 -1 2 2 29.41 4.03 3.0374 1 -2 3 29.89 2.28 2.9891 0 1 3 31.02 2.66 2.8831 1 -3 3 31.13 1.29 2.8733 0 -1 4 31.24 1.84 2.8632 1 1 2 31.74 1.83 2.8188 1 2 1 32.16 13.14 2.7834 1 -4 2 32.22 11.91 2.7786 -1 -3 1 33.58 11.72 2.6689 -2 1 1 33.83 8.09 2.6497 0 0 4 34.53 2.00 2.5976 -1 -2 4 34.78 13.50 2.5794 1 -4 3 34.80 14.02 2.5782 1 3 0 35.25 1.33 2.5457 -1 3 2 35.99 11.31 2.4957 -2 1 2 37.32 3.41 2.4096 -1 4 1 37.47 3.32 2.4002 -1 -3 4 38.91 1.80 2.3143 2 -1 2 39.18 4.83 2.2992 1 3 1 39.20 4.44 2.2982 1 -4 4 40.18 6.13 2.2443 -2 1 3 42.62 2.50 2.1213 -1 4 2 42.65 1.78 2.1198 0 0 5 42.79 2.36 2.1135 -1 -3 5 44.16 3.83 2.0509 2 -1 3 44.93 1.70 2.0174 1 3 2 44.98 1.74 2.0156 1 -4 5 51.71 3.96 1.7677 1 3 3 51.78 3.99 1.7656 1 -4 6 52.39 4.52 1.7464 -2 1 5 55.41 5.84 1.6581 0 -7 3 56.12 1.39 1.6388 0 -7 2 56.17 1.09 1.6375 0 -7 4 56.39 1.55 1.6316 -1 4 4 56.57 1.66 1.6268 -1 -3 7 57.82 1.40 1.5947 2 -1 5 58.19 4.74 1.5854 3 -5 1 58.34 4.71 1.5816 -3 -2 2 58.82 1.24 1.5700 -3 5 0 58.98 1.26 1.5660 3 -5 2 58.99 1.07 1.5657 -3 -2 3 59.11 1.37 1.5628 -3 -2 1 64.49 1.66 1.4448 -1 4 5 64.69 1.46 1.4410 -1 -3 8 65.90 1.79 1.4175 2 -1 6 66.26 1.19 1.4105 2 -8 2 66.48 1.38 1.4063 -2 -6 4 67.73 1.54 1.3834 2 -8 1 68.00 1.30 1.3787 -2 -6 5 69.89 1.68 1.3459 -4 2 0 71.48 1.52 1.3198 4 -2 1 72.83 1.05 1.2986 -4 2 3 83.55 1.22 1.1572 4 -2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.