R120156 \ CELL PARAMETERS: 12.2377 15.7441 10.5305 90.000 125.156 90.000 SPACE GROUP: C2/m ATOM X Y Z OCCUPANCY ISO(B) Na 0.31534 0.50000 0.39138 1.000 1.412 Na 0.00000 0.50000 0.00000 1.000 2.034 Na 0.00000 0.00000 0.00000 1.000 7.911 Ca 0.50000 0.25510 0.50000 1.000 0.572 Cu 0.20118 0.34440 0.42716 1.000 0.613 Si 0.20211 0.34573 0.13387 1.000 0.470 Si 0.49772 0.39911 0.28102 1.000 0.447 Si -0.09441 0.40322 0.20331 1.000 0.452 Si 0.68566 0.32974 0.21492 1.000 0.474 O 0.55237 0.38132 0.17378 1.000 0.695 O 0.36345 0.34401 0.21609 1.000 0.758 O 0.15105 0.24801 0.09713 1.000 0.782 O 0.00718 0.33634 0.32881 1.000 0.722 O 0.17082 0.39491 0.24121 1.000 0.739 O 0.22694 0.29308 0.61201 1.000 0.722 O 0.39643 0.37356 0.54260 1.000 0.677 O -0.23692 0.40173 0.18387 1.000 0.849 O 0.12893 0.39551 -0.03040 1.000 0.773 O -0.03775 0.50000 0.25995 1.000 0.627 O 0.45602 0.50000 0.25995 1.000 0.887 O 0.29613 0.00000 0.46122 1.000 1.838 H 0.38739 0.00000 0.54765 1.000 4.941 H 0.28373 0.00000 0.35644 1.000 5.552 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 9 +/- 14 +/- 7 MAX. ABS. INTENSITY / VOLUME**2: 5.988245184 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 10.27 76.03 8.6096 0 0 1 10.52 13.63 8.4080 -1 1 1 11.24 33.02 7.8720 0 2 0 14.48 29.39 6.1187 -2 0 1 15.25 31.87 5.8097 0 2 1 17.73 19.49 5.0027 2 0 0 17.84 14.01 4.9724 -2 0 2 17.94 1.70 4.9457 1 1 1 18.02 6.46 4.9237 -1 1 2 18.36 4.19 4.8310 -2 2 1 19.10 1.01 4.6475 1 3 0 20.63 11.56 4.3048 0 0 2 21.04 31.32 4.2222 2 2 0 21.13 21.32 4.2040 -2 2 2 22.59 100.00 3.9360 0 4 0 23.08 6.75 3.8541 -3 1 1 23.55 13.45 3.7770 0 2 2 24.07 6.87 3.6972 1 3 1 25.37 56.31 3.5102 -2 0 3 26.93 8.15 3.3103 -2 4 1 27.33 31.87 3.2627 3 1 0 27.45 22.05 3.2492 1 1 2 27.50 2.55 3.2438 -3 1 3 27.54 12.56 3.2387 -1 1 3 27.69 35.55 3.2221 2 2 1 28.21 15.69 3.1629 -3 3 2 28.86 13.78 3.0934 2 4 0 28.93 57.60 3.0862 -2 4 2 29.19 1.32 3.0594 -4 0 2 29.76 2.15 3.0019 -1 5 1 30.78 28.86 2.9048 0 4 2 30.96 57.41 2.8886 -4 0 1 31.09 1.37 2.8769 -4 0 3 31.16 19.43 2.8699 0 0 3 31.37 4.03 2.8516 -4 2 2 31.79 13.71 2.8148 3 3 0 31.89 6.55 2.8061 1 3 2 31.93 14.25 2.8027 -3 3 3 31.97 43.83 2.7994 -1 3 3 33.03 20.51 2.7118 -4 2 1 33.15 22.82 2.7021 -4 2 3 33.23 7.58 2.6963 0 2 3 33.25 7.83 2.6948 1 5 1 33.29 1.29 2.6912 -1 5 2 34.11 1.32 2.6285 2 4 1 34.17 9.70 2.6240 0 6 0 34.23 24.03 2.6197 -2 4 3 34.43 1.67 2.6047 2 0 2 34.45 3.84 2.6035 3 1 1 34.61 6.34 2.5919 -2 0 4 34.67 1.77 2.5875 -3 1 4 35.77 12.57 2.5100 0 6 1 35.90 6.82 2.5013 4 0 0 36.13 3.84 2.4862 -4 0 4 36.33 1.18 2.4729 2 2 2 36.40 16.14 2.4682 -3 5 1 36.44 16.86 2.4655 -3 5 2 37.29 28.15 2.4116 -2 6 1 37.52 6.17 2.3970 -5 1 2 37.69 4.19 2.3867 1 1 3 37.95 1.86 2.3708 -4 2 4 38.16 6.39 2.3583 3 3 1 38.36 27.22 2.3464 -3 3 4 38.66 3.14 2.3288 -4 4 1 38.75 25.16 2.3238 2 6 0 38.77 1.87 2.3226 -4 4 3 38.80 2.68 2.3207 -2 6 2 38.83 8.14 2.3189 0 4 3 39.35 15.13 2.2896 3 5 0 39.44 1.20 2.2849 1 5 2 39.50 4.73 2.2813 -1 5 3 40.38 14.89 2.2338 -5 1 1 40.99 4.43 2.2016 -5 3 2 41.15 4.72 2.1938 -1 7 1 41.15 2.53 2.1936 1 3 3 41.24 14.83 2.1891 -1 3 4 41.73 15.00 2.1647 -2 4 4 41.98 2.21 2.1524 0 0 4 42.94 3.70 2.1062 2 6 1 43.04 16.02 2.1017 -2 6 3 43.37 11.46 2.0864 -4 0 5 43.59 3.18 2.0762 0 2 4 43.66 13.21 2.0731 -5 3 1 43.84 8.91 2.0650 -5 3 4 43.84 11.86 2.0649 1 7 1 44.42 3.75 2.0396 -6 0 3 44.66 1.59 2.0289 4 2 1 44.72 6.34 2.0264 -2 0 5 45.54 1.74 1.9918 -4 6 2 45.78 1.18 1.9818 -6 0 4 45.97 6.05 1.9744 -6 2 3 46.08 2.93 1.9698 2 2 3 46.12 9.63 1.9680 0 8 0 46.33 5.65 1.9597 3 3 2 46.57 3.28 1.9501 -3 3 5 47.30 1.30 1.9218 -6 2 4 47.53 1.65 1.9131 -1 5 4 48.56 1.80 1.8750 -1 1 5 48.70 10.35 1.8698 5 3 0 48.91 3.21 1.8622 1 7 2 48.94 1.99 1.8612 -3 7 3 48.97 12.32 1.8602 -1 7 3 48.98 1.12 1.8599 -5 3 5 49.18 3.47 1.8527 4 4 1 49.29 1.04 1.8486 2 6 2 49.32 1.25 1.8478 -6 0 1 49.43 3.87 1.8440 -2 6 4 49.44 5.14 1.8434 -4 4 5 49.71 1.32 1.8342 -5 5 1 49.79 3.21 1.8314 2 8 0 50.39 11.96 1.8109 -6 4 3 50.40 1.51 1.8105 4 6 0 50.75 1.46 1.7989 -6 2 1 51.03 1.31 1.7898 0 8 2 51.51 3.42 1.7742 -6 4 2 51.64 3.94 1.7701 -6 4 4 52.11 1.21 1.7551 -4 0 6 52.14 6.63 1.7543 3 5 2 52.36 1.39 1.7474 -3 5 5 52.93 4.04 1.7299 -7 1 3 53.06 1.94 1.7260 3 1 3 53.15 1.13 1.7232 1 9 0 53.19 3.52 1.7219 0 0 5 53.29 1.16 1.7191 -5 1 6 53.34 1.04 1.7176 -3 1 6 53.49 1.30 1.7130 -4 2 6 53.53 1.33 1.7120 3 7 1 53.68 6.33 1.7074 -3 7 4 54.32 2.51 1.6889 5 5 0 54.89 6.74 1.6726 -6 4 1 55.07 3.89 1.6676 6 0 0 55.19 2.44 1.6642 0 6 4 55.33 7.12 1.6603 2 0 4 55.40 6.28 1.6583 1 9 1 55.63 2.92 1.6521 5 3 1 55.64 7.31 1.6519 -7 3 3 55.76 3.21 1.6486 3 3 3 55.79 1.19 1.6478 -5 7 3 55.86 2.26 1.6458 1 7 3 55.93 4.37 1.6439 -1 7 4 55.98 2.71 1.6426 -5 3 6 56.03 10.16 1.6412 -3 3 6 56.10 3.91 1.6395 4 6 1 56.85 3.21 1.6195 -1 5 5 56.86 2.27 1.6194 -2 2 6 57.18 4.15 1.6110 4 4 2 57.21 1.18 1.6103 -6 6 3 57.30 1.73 1.6079 2 6 3 57.49 1.00 1.6029 -4 4 6 57.56 1.44 1.6012 -3 9 1 57.59 2.53 1.6004 -3 9 2 57.77 1.90 1.5960 -7 3 2 57.89 1.11 1.5930 -5 7 1 58.35 6.45 1.5814 -6 6 4 58.51 4.18 1.5776 0 4 5 58.92 1.87 1.5674 -2 8 4 59.43 3.90 1.5553 -7 1 1 59.69 1.19 1.5492 3 9 0 59.71 1.86 1.5487 0 10 1 59.77 1.15 1.5473 -7 1 6 59.77 1.57 1.5471 -3 9 3 59.80 6.87 1.5466 -1 9 3 60.09 3.96 1.5398 3 7 2 60.53 2.08 1.5297 -8 0 4 60.62 1.63 1.5276 -6 4 6 60.74 1.21 1.5247 -2 10 1 60.81 2.66 1.5232 -7 5 3 60.88 2.14 1.5217 -7 5 4 61.36 2.64 1.5108 -6 6 1 61.59 9.03 1.5058 -6 6 5 61.62 3.04 1.5051 5 1 2 61.65 4.52 1.5044 -8 0 5 61.77 3.39 1.5018 2 10 0 61.78 1.14 1.5016 -8 2 4 61.95 1.12 1.4979 -7 3 1 62.02 4.22 1.4965 -4 0 7 62.04 2.23 1.4959 -5 1 7 62.08 6.77 1.4950 5 7 0 62.42 5.22 1.4878 -1 3 6 62.54 2.39 1.4853 6 0 1 62.83 6.05 1.4790 -7 5 2 62.85 4.82 1.4786 0 10 2 62.89 1.04 1.4777 -8 2 5 63.03 2.21 1.4749 -7 5 5 63.83 1.10 1.4583 3 1 4 63.97 4.93 1.4554 -3 9 4 64.09 2.34 1.4530 5 3 2 64.13 3.98 1.4521 -3 1 7 64.21 1.72 1.4505 -6 2 7 64.34 1.33 1.4479 1 7 4 64.50 5.33 1.4446 -5 3 7 64.76 2.67 1.4396 0 6 5 64.81 7.05 1.4385 -8 0 6 64.84 2.83 1.4380 2 10 1 64.91 2.34 1.4365 -2 10 3 65.58 2.01 1.4235 7 1 0 65.94 2.50 1.4166 1 9 3 66.00 3.76 1.4154 -1 9 4 66.03 1.04 1.4149 -7 1 7 66.53 1.99 1.4055 4 4 3 66.55 8.82 1.4051 -3 3 7 66.66 1.64 1.4030 2 6 4 66.83 3.12 1.3999 -4 10 2 66.84 1.44 1.3997 -2 6 6 66.88 2.97 1.3990 2 0 5 66.89 4.05 1.3988 -4 4 7 67.39 4.02 1.3896 6 4 1 67.79 1.25 1.3824 -4 10 1 67.86 10.82 1.3811 -4 10 3 67.90 1.64 1.3803 0 10 3 67.91 2.42 1.3802 -5 9 4 67.92 1.06 1.3801 1 11 1 67.97 2.95 1.3791 7 3 0 68.07 1.36 1.3774 2 2 5 68.12 4.40 1.3764 -7 7 3 68.23 4.39 1.3745 3 7 3 68.28 1.60 1.3736 -2 2 7 68.41 1.95 1.3713 -7 3 7 68.47 1.94 1.3702 -3 7 6 68.89 1.17 1.3631 5 5 2 69.29 1.27 1.3562 -5 5 7 69.58 1.62 1.3511 -8 4 6 69.66 1.68 1.3498 -9 1 5 69.80 6.29 1.3474 3 9 2 70.03 2.07 1.3436 -7 7 2 70.03 1.66 1.3435 -6 8 5 70.84 1.23 1.3301 -4 10 4 70.97 1.95 1.3280 3 5 4 71.03 2.58 1.3270 -8 2 7 71.37 1.21 1.3215 -8 6 4 71.45 3.60 1.3203 -9 1 3 71.65 3.33 1.3170 5 9 0 71.68 1.27 1.3166 -9 1 6 71.97 4.65 1.3120 0 12 0 72.01 1.87 1.3114 -1 1 7 72.40 1.16 1.3053 4 6 3 73.75 2.39 1.2847 -9 -3 3 73.98 1.27 1.2812 -9 -3 6 74.20 2.06 1.2781 1 3 6 74.70 1.64 1.2707 0 10 4 75.52 1.30 1.2590 0 6 6 76.19 1.83 1.2495 -5 7 7 77.14 4.69 1.2364 4 4 4 77.33 1.53 1.2339 5 9 1 77.34 2.28 1.2338 -7 9 3 77.42 2.99 1.2327 -6 10 4 77.44 1.24 1.2324 3 9 3 77.67 2.30 1.2293 -3 9 6 77.70 2.09 1.2290 -2 12 3 78.10 1.15 1.2236 -3 7 7 78.83 3.23 1.2142 -1 5 7 79.16 1.62 1.2100 -7 9 2 79.34 1.42 1.2077 -7 9 5 79.37 3.03 1.2073 2 0 6 79.86 1.52 1.2011 -7 7 7 80.38 3.90 1.1946 -4 12 1 81.62 1.20 1.1796 1 13 1 82.26 1.45 1.1720 -4 10 6 82.73 2.38 1.1666 4 6 4 82.88 1.20 1.1648 5 1 4 82.94 1.81 1.1641 5 11 0 83.14 1.04 1.1618 1 9 5 83.27 2.56 1.1604 -4 12 4 85.04 1.07 1.1406 -2 10 6 85.09 2.02 1.1402 5 3 4 85.11 1.64 1.1399 -5 9 7 85.35 1.73 1.1373 -1 13 3 86.13 3.92 1.1290 8 6 0 86.71 1.30 1.1230 3 9 4 87.61 1.12 1.1137 0 6 7 87.91 1.09 1.1107 -4 12 5 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.