Institute of Experimental Mineralogy Russian Academy of Sciences ------------------------------------------------- 142432, Chernogolovka, Moscow district A.V. Chichagov +7(496)52-22320 *** *** W W W - X R A Y P O L *** *********************** FERROGLAUCOPHANE 1, f-amphiboles, sf-glaucophane, s-glaucophane (Na,Ca)(2)(Mg,Fe'')(3)(Al,Fe''')(2)Si(8)O(22)(OH)(2) Monoclinic C 2/m Z = 2 R =0.032 NR =1015 7 .9 .1990 Ref.Str.: Hawthorne F.C. (1979) * Canad. Mineral., 17, 1-10 Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 9.587 alpha = 90.0 b = 17.832 beta = 103.47 c = 5.315 gamma = 90.0 Unit cell volume (cub. angs.) = 883.63 Molar volume ( cub.cm/mol.) = 266.12 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.1089 0.0947 0.2016 0.65 O = 1.00 2 0.1178 0.173 0.7478 0.59 O = 1.00 3 0.1129 0.0 0.7077 0.85 O = 1.00 4 0.3695 0.252 0.8064 0.69 O = 1.00 5 0.355 0.1307 0.0884 0.74 O = 1.00 6 0.3398 0.1224 0.5793 0.75 O = 1.00 7 0.3288 0.0 0.3022 0.86 O = 1.00 8 0.2824 0.0873 0.2922 0.45 Si = 1.00 9 0.2926 0.1727 0.8079 0.45 Si = 1.00 10 0.0 0.0918 0.5 0.6 Fe = 0.58, Mg = 0.35, Al = 0.07 11 0.0 0.1817 0.0 0.58 Fe = 0.16, Al = 0.84 12 0.0 0.0 0.0 0.61 Fe = 0.8 , Mg = 0.2 13 0.0 0.2772 0.5 1.27 Na = 0.86, Ca = 0.08, Mg = 0.06 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.1089 0.0947 0.2016 2 2 0.1178 0.173 0.7478 3 3 0.1129 0.0 0.7077 4 4 0.3695 0.252 0.8064 5 5 0.355 0.1307 0.0884 6 6 0.3398 0.1224 0.5793 7 7 0.3288 0.0 0.3022 8 8 0.2824 0.0873 0.2922 9 9 0.2926 0.1727 0.8079 10 10 0.0 0.0918 0.5 11 11 0.0 0.1817 0.0 12 12 0.0 0.0 0.0 13 13 0.0 0.2772 0.5 14 1 0.8911 0.9053 0.7984 15 2 0.8822 0.827 0.2522 16 3 0.8871 0.0 0.2923 17 4 0.6305 0.748 0.1936 18 5 0.645 0.8693 0.9116 19 6 0.6602 0.8776 0.4207 20 7 0.6712 0.0 0.6978 21 8 0.7176 0.9127 0.7078 22 9 0.7074 0.8273 0.1921 23 10 0.0 0.9082 0.5 24 11 0.0 0.8183 0.0 25 13 0.0 0.7228 0.5 26 1 0.1089 0.9053 0.2016 27 2 0.1178 0.827 0.7478 28 4 0.3695 0.748 0.8064 29 5 0.355 0.8693 0.0884 30 6 0.3398 0.8776 0.5793 31 8 0.2824 0.9127 0.2922 32 9 0.2926 0.8273 0.8079 33 1 0.8911 0.0947 0.7984 34 2 0.8822 0.173 0.2522 35 4 0.6305 0.252 0.1936 36 5 0.645 0.1307 0.9116 37 6 0.6602 0.1224 0.4207 38 8 0.7176 0.0873 0.7078 39 9 0.7074 0.1727 0.1921 40 1 0.6089 0.4053 0.2016 41 2 0.6178 0.327 0.7478 42 3 0.6129 0.5 0.7077 43 4 0.8695 0.248 0.8064 44 5 0.855 0.3693 0.0884 45 6 0.8398 0.3776 0.5793 46 7 0.8288 0.5 0.3022 47 8 0.7824 0.4127 0.2922 48 9 0.7926 0.3273 0.8079 49 10 0.5 0.4082 0.5 50 11 0.5 0.3183 0.0 51 12 0.5 0.5 0.0 52 13 0.5 0.2228 0.5 53 1 0.3911 0.5947 0.7984 54 2 0.3822 0.673 0.2522 55 3 0.3871 0.5 0.2923 56 4 0.1305 0.752 0.1936 57 5 0.145 0.6307 0.9116 58 6 0.1602 0.6224 0.4207 59 7 0.1712 0.5 0.6978 60 8 0.2176 0.5873 0.7078 61 9 0.2074 0.6727 0.1921 62 10 0.5 0.5918 0.5 63 11 0.5 0.6817 0.0 64 13 0.5 0.7772 0.5 65 1 0.6089 0.5947 0.2016 66 2 0.6178 0.673 0.7478 67 4 0.8695 0.752 0.8064 68 5 0.855 0.6307 0.0884 69 6 0.8398 0.6224 0.5793 70 8 0.7824 0.5873 0.2922 71 9 0.7926 0.6727 0.8079 72 1 0.3911 0.4053 0.7984 73 2 0.3822 0.327 0.2522 74 4 0.1305 0.248 0.1936 75 5 0.145 0.3693 0.9116 76 6 0.1602 0.3776 0.4207 77 8 0.2176 0.4127 0.7078 78 9 0.2074 0.3273 0.1921 X-ray density (g/cm cub.) = 3.21 MU (1/cm) = 161.486 Mass attenuation coefficient (cm**2/g) = 50.234 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 O 3.264 11 3.2045 2 2.8054 2 3.1687 3 3.1291 3 2.6461 5 2.6653 6 2.6565 7 2.8431 3 2.6206 1 2.6491 2 2.7426 4 2 O 3.264 11 2.8054 1 3.2045 1 3.0919 3 2.7485 4 2.6645 5 2.6522 6 2.6491 1 3.0444 2 2.8103 4 2.6987 4 3.263 4 3 O 3.264 11 3.1291 1 3.1687 1 3.0919 2 3.2639 6 2.8431 1 2.7082 3 3.1291 1 3.1687 1 3.0919 2 3.2639 6 2.8431 1 4 O 3.264 9 2.7485 2 2.6536 5 2.5921 6 2.8456 4 2.8103 2 2.7426 1 2.6987 2 3.263 2 3.1434 5 5 O 3.264 9 2.6461 1 2.6645 2 2.6536 4 2.651 6 2.6798 6 2.6304 7 3.1353 5 3.0488 6 3.1434 4 6 O 3.264 8 2.6653 1 2.6522 2 3.2639 3 2.5921 4 2.6798 5 2.651 5 2.6214 7 3.0488 5 7 O 3.264 6 2.6565 1 2.6304 5 2.6214 6 2.6565 1 2.6304 5 2.6214 6 8 Si 2.1 4 1.6257 1 1.6149 5 1.6223 6 1.6165 7 9 Si 2.1 4 1.6313 2 1.5956 4 1.651 5 1.6558 6 10 Fe ,Mg ,Al 2.592 6 2.0927 1 2.1014 2 2.1239 3 2.1239 3 2.0927 1 2.1014 2 11 Fe ,Al 2.592 6 2.0304 1 1.9497 2 2.0304 1 1.9497 2 1.8501 4 1.8501 4 12 Fe ,Mg 2.592 6 2.1374 1 2.0901 3 2.1374 1 2.0901 3 2.1374 1 2.1374 1 13 Na ,Ca ,Mg 2.88 8 2.402 2 2.402 2 2.3319 4 2.8282 5 2.4583 6 2.3319 4 2.8282 5 2.4583 6 X-ray diffraction powder data (II), X-Ray W.L. = 1.78892(angs.): No H K L Theta 2*Theta S LPG MF F I int. ( degree ) *100 1 0 2 0 5.758 11.515 0.056 195.75 2 29.1 42.6 2 1 1 0 6.215 12.43 0.061 167.68 4 114.7 1129.4 3 0 0 1 9.965 19.93 0.097 63.87 2 7.7 1.0 4 1 3 0 10.28 20.56 0.1 59.89 4 29.9 27.5 5 1 1 -1 10.615 21.23 0.103 56.04 4 71.9 148.2 6 2 0 0 11.062 22.125 0.107 51.43 2 1.0 0.0 7 0 2 1 11.539 23.077 0.112 47.1 4 47.9 55.3 8 0 4 0 11.574 23.149 0.112 46.79 2 132.1 209.1 9 2 2 0 12.505 25.009 0.121 39.79 4 0.7 0.0 10 1 1 1 12.842 25.684 0.124 37.62 4 33.5 21.7 11 2 0 -1 13.09 26.18 0.127 36.14 2 5.8 0.3 12 1 3 -1 13.445 26.89 0.13 34.15 4 97.7 167.0 13 2 2 -1 14.342 28.684 0.138 29.77 4 35.0 18.7 14 1 3 1 15.289 30.578 0.147 25.96 4 106.0 149.6 15 0 4 1 15.365 30.729 0.148 25.69 4 42.7 24.0 16 1 5 0 15.577 31.153 0.15 24.94 4 20.6 5.4 17 2 4 0 16.118 32.237 0.155 23.17 4 98.4 115.0 18 2 0 1 16.664 33.328 0.16 21.56 2 14.3 1.1 19 3 1 0 16.987 33.974 0.163 20.68 4 215.9 493.8 20 0 6 0 17.515 35.031 0.168 19.34 2 3.1 0.0 21 2 4 -1 17.612 35.225 0.169 19.11 4 30.2 8.9 22 3 1 -1 17.666 35.333 0.17 18.98 4 37.7 13.8 23 2 2 1 17.686 35.372 0.17 18.93 4 121.3 142.7 24 1 5 -1 17.885 35.771 0.172 18.48 4 19.1 3.5 25 3 3 0 18.952 37.904 0.182 16.26 4 78.4 51.2 26 1 5 1 19.35 38.7 0.185 15.53 4 288.0 660.2 27 3 3 -1 19.573 39.145 0.187 15.15 4 81.0 51.0 28 1 1 -2 19.916 39.832 0.19 14.57 4 52.0 20.2 29 0 0 2 20.249 40.498 0.193 14.04 2 59.5 12.7 30 0 6 1 20.314 40.628 0.194 13.94 4 163.9 191.9 31 2 4 1 20.486 40.973 0.196 13.68 4 37.6 9.9 32 2 0 -2 20.762 41.525 0.198 13.28 2 309.6 326.1 33 2 6 0 20.911 41.823 0.2 13.07 4 9.0 0.5 34 0 2 2 21.121 42.243 0.201 12.78 4 9.9 0.6 35 1 7 0 21.346 42.691 0.203 12.48 4 14.5 1.3 36 2 2 -2 21.618 43.236 0.206 12.13 4 0.5 0.0 37 1 3 -2 21.654 43.309 0.206 12.09 4 32.1 6.4 38 3 1 1 21.849 43.698 0.208 11.84 4 22.2 3.0 39 2 6 -1 22.127 44.254 0.211 11.51 4 3.3 0.1 40 3 5 0 22.443 44.885 0.213 11.15 4 60.4 20.8 41 4 0 -1 22.486 44.972 0.214 11.1 2 40.7 4.7 42 1 1 2 22.543 45.085 0.214 11.04 4 56.4 18.0 43 4 0 0 22.566 45.133 0.215 11.01 2 40.1 4.5 44 3 5 -1 22.985 45.97 0.218 10.57 4 189.3 193.9 45 1 7 -1 23.161 46.323 0.22 10.38 4 67.0 23.9 46 4 2 -1 23.291 46.582 0.221 10.25 4 103.0 55.7 47 4 2 0 23.369 46.738 0.222 10.18 4 26.5 3.7 48 3 3 1 23.471 46.942 0.223 10.08 4 8.2 0.4 49 3 1 -2 23.479 46.958 0.223 10.07 4 170.1 149.2 50 0 4 2 23.581 47.163 0.224 9.97 4 4.6 0.1 51 0 8 0 23.658 47.317 0.224 9.9 2 48.8 6.0 52 2 4 -2 24.037 48.075 0.228 9.55 4 67.0 21.9 53 1 3 2 24.128 48.257 0.229 9.46 4 32.5 5.1 54 1 7 1 24.363 48.726 0.231 9.26 4 97.4 44.9 55 2 6 1 24.564 49.127 0.232 9.09 4 183.8 157.2 56 1 5 -2 24.836 49.672 0.235 8.86 4 51.0 11.8 57 3 3 -2 25.019 50.038 0.236 8.72 4 63.5 18.0 58 4 4 -1 25.588 51.176 0.241 8.28 4 45.8 8.9 59 4 4 0 25.661 51.321 0.242 8.23 4 4.7 0.1 60 2 0 2 25.662 51.324 0.242 8.23 2 199.8 84.1 61 0 8 1 25.913 51.826 0.244 8.05 4 17.8 1.3 62 2 2 2 26.393 52.786 0.248 7.72 4 7.2 0.2 63 2 8 0 26.41 52.821 0.249 7.7 4 22.4 2.0 64 3 5 1 26.485 52.971 0.249 7.65 4 158.2 98.1 65 4 0 -2 26.934 53.868 0.253 7.37 2 144.7 39.5 66 3 7 0 27.001 54.002 0.254 7.33 4 67.2 16.9 67 1 5 2 27.089 54.177 0.255 7.27 4 45.8 7.8 68 4 0 1 27.144 54.289 0.255 7.24 2 37.1 2.6 69 0 6 2 27.3 54.601 0.256 7.14 4 3.5 0.0 70 2 8 -1 27.438 54.875 0.258 7.06 4 24.7 2.2 71 3 7 -1 27.476 54.952 0.258 7.04 4 66.1 15.8 72 1 9 0 27.486 54.971 0.258 7.04 4 10.6 0.4 73 4 2 -2 27.642 55.283 0.259 6.95 4 11.1 0.4 74 2 6 -2 27.711 55.423 0.26 6.91 4 25.4 2.3 75 4 2 1 27.848 55.697 0.261 6.83 4 58.2 11.9 76 3 5 -2 27.911 55.822 0.262 6.79 4 53.2 9.8 77 5 1 -1 28.241 56.481 0.265 6.62 4 33.7 3.8 78 2 4 2 28.508 57.016 0.267 6.48 4 76.0 19.2 79 5 1 0 28.836 57.672 0.27 6.31 4 65.5 13.9 80 1 9 -1 29.012 58.024 0.271 6.22 4 132.3 55.8 81 1 7 -2 29.119 58.238 0.272 6.17 4 39.6 5.0 82 4 6 -1 29.122 58.245 0.272 6.17 4 68.3 14.7 83 4 6 0 29.189 58.378 0.273 6.14 4 14.4 0.7 84 2 8 1 29.552 59.104 0.276 5.97 4 0.8 0.0 85 5 3 -1 29.603 59.206 0.276 5.95 4 3.9 0.0 86 4 4 -2 29.697 59.394 0.277 5.91 4 57.5 10.0 87 4 4 1 29.895 59.789 0.279 5.82 4 52.4 8.2 88 1 9 1 30.045 60.091 0.28 5.75 4 78.0 17.9 89 3 1 2 30.102 60.204 0.28 5.73 4 5.3 0.1 90 0 10 0 30.106 60.212 0.28 5.73 2 149.4 32.7 91 5 3 0 30.182 60.363 0.281 5.7 4 80.3 18.8 92 1 1 -3 30.529 61.057 0.284 5.55 4 33.9 3.3 93 3 7 1 30.61 61.22 0.285 5.52 4 28.8 2.4 94 2 0 -3 30.652 61.305 0.285 5.5 2 4.1 0.0 95 1 7 2 31.161 62.322 0.289 5.31 4 36.0 3.5 96 0 0 3 31.275 62.551 0.29 5.26 2 56.2 4.3 97 2 2 -3 31.306 62.612 0.29 5.25 4 18.0 0.9 98 3 3 2 31.414 62.829 0.291 5.21 4 26.4 1.9 99 5 1 -2 31.632 63.264 0.293 5.13 4 137.0 49.4 100 2 6 2 31.828 63.656 0.295 5.07 4 7.4 0.1 101 1 3 -3 31.831 63.661 0.295 5.06 4 66.1 11.3 102 3 7 -2 31.916 63.833 0.296 5.03 4 42.5 4.7 103 0 2 3 31.921 63.843 0.296 5.03 4 103.9 27.8 104 0 8 2 32.0 64.0 0.296 5.01 4 50.4 6.5 105 0 10 1 32.047 64.094 0.297 4.99 4 43.1 4.7 106 5 5 -1 32.22 64.441 0.298 4.93 4 76.1 14.6 107 3 1 -3 32.283 64.565 0.299 4.91 4 56.4 8.0 108 3 9 0 32.37 64.74 0.299 4.88 4 17.0 0.7 109 2 8 -2 32.374 64.747 0.299 4.88 4 86.3 18.6 110 2 10 0 32.483 64.966 0.3 4.85 4 58.0 8.3 111 5 5 0 32.772 65.544 0.303 4.75 4 7.8 0.1 112 3 9 -1 32.796 65.592 0.303 4.75 4 47.3 5.4 113 5 3 -2 32.909 65.819 0.304 4.71 4 5.9 0.1 114 4 6 -2 32.945 65.89 0.304 4.7 4 7.6 0.1 115 4 6 1 33.131 66.263 0.306 4.65 4 249.4 148.0 116 2 4 -3 33.222 66.445 0.306 4.62 4 42.0 4.2 117 5 1 1 33.288 66.577 0.307 4.6 4 0.7 0.0 118 2 10 -1 33.392 66.784 0.308 4.57 4 18.6 0.8 119 1 1 3 33.488 66.976 0.308 4.54 4 20.7 1.0 120 3 3 -3 33.547 67.094 0.309 4.52 4 34.8 2.8 121 4 8 -1 33.666 67.332 0.31 4.49 4 9.0 0.2 122 4 8 0 33.727 67.455 0.31 4.47 4 112.2 28.9 123 0 4 3 33.819 67.638 0.311 4.45 4 47.3 5.1 124 3 5 2 33.953 67.905 0.312 4.41 4 4.4 0.0 125 1 11 0 34.059 68.118 0.313 4.38 4 174.2 68.1 126 6 0 -1 34.135 68.271 0.314 4.36 2 20.0 0.4 127 1 9 -2 34.285 68.57 0.315 4.32 4 46.2 4.7 128 1 5 -3 34.353 68.705 0.315 4.31 4 240.9 128.0 129 5 3 1 34.534 69.068 0.317 4.26 4 13.8 0.4 130 4 0 -3 34.693 69.387 0.318 4.22 2 8.6 0.1 131 1 3 3 34.73 69.46 0.318 4.21 4 22.1 1.1 132 6 2 -1 34.754 69.507 0.319 4.2 4 44.3 4.2 133 4 0 2 34.996 69.992 0.321 4.15 2 169.5 30.5 134 6 0 0 35.144 70.288 0.322 4.11 2 148.9 23.4 135 2 10 1 35.295 70.59 0.323 4.08 4 52.8 5.8 136 4 2 -3 35.307 70.614 0.323 4.07 4 34.6 2.5 137 5 5 -2 35.393 70.785 0.324 4.05 4 41.4 3.6 138 1 11 -1 35.418 70.836 0.324 4.05 4 7.7 0.1 139 4 2 2 35.608 71.215 0.325 4.0 4 24.9 1.3 140 3 9 1 35.656 71.311 0.326 3.99 4 3.4 0.0 141 6 2 0 35.754 71.508 0.327 3.97 4 10.3 0.2 142 5 7 -1 35.95 71.9 0.328 3.93 4 4.4 0.0 143 3 5 -3 36.009 72.019 0.329 3.92 4 58.0 6.8 144 1 9 2 36.167 72.333 0.33 3.88 4 71.9 10.3 145 2 8 2 36.185 72.37 0.33 3.88 4 20.3 0.8 146 2 6 -3 36.302 72.603 0.331 3.86 4 223.8 98.9 147 1 11 1 36.351 72.702 0.331 3.85 4 8.0 0.1 148 2 0 3 36.436 72.871 0.332 3.83 2 23.5 0.5 149 5 7 0 36.475 72.949 0.332 3.82 4 26.4 1.4 150 6 4 -1 36.58 73.16 0.333 3.8 4 34.8 2.4 151 6 0 -2 36.77 73.539 0.335 3.76 2 232.3 52.0 152 3 9 -2 36.871 73.742 0.335 3.74 4 31.2 1.9 153 0 6 3 36.876 73.751 0.335 3.74 4 79.4 12.1 154 5 5 1 36.967 73.934 0.336 3.73 4 121.6 28.2 155 0 12 0 37.008 74.016 0.336 3.72 2 220.1 46.1 156 2 2 3 37.037 74.074 0.337 3.71 4 68.2 8.8 157 4 4 -3 37.122 74.244 0.337 3.7 4 35.6 2.4 158 1 5 3 37.158 74.315 0.338 3.69 4 65.9 8.2 159 4 8 -2 37.239 74.479 0.338 3.68 4 71.7 9.7 160 6 2 -2 37.369 74.738 0.339 3.65 4 6.8 0.1 161 4 8 1 37.416 74.832 0.34 3.64 4 46.3 4.0 162 4 4 2 37.417 74.833 0.34 3.64 4 82.3 12.7 163 0 10 2 37.548 75.095 0.341 3.62 4 30.9 1.8 164 6 4 0 37.56 75.121 0.341 3.62 4 2.5 0.0 165 3 7 2 37.602 75.205 0.341 3.61 4 43.5 3.5 166 2 10 -2 37.896 75.791 0.343 3.56 4 126.3 29.1 167 1 7 -3 37.986 75.972 0.344 3.55 4 103.1 19.3 168 5 1 -3 38.417 76.835 0.347 3.48 4 15.8 0.4 169 3 11 0 38.486 76.971 0.348 3.47 4 136.7 33.2 170 0 12 1 38.778 77.556 0.35 3.42 4 26.2 1.2 171 2 4 3 38.821 77.643 0.35 3.42 4 36.2 2.3 172 3 11 -1 38.882 77.763 0.351 3.41 4 42.2 3.1 173 5 7 -2 38.988 77.975 0.352 3.39 4 14.8 0.4 174 4 10 -1 39.108 78.215 0.353 3.37 4 55.5 5.3 175 6 4 -2 39.148 78.297 0.353 3.37 4 105.1 19.1 176 4 10 0 39.166 78.331 0.353 3.37 4 96.6 16.1 177 2 12 0 39.181 78.361 0.353 3.36 4 17.6 0.5 178 6 6 -1 39.551 79.102 0.356 3.31 4 284.2 137.0 179 3 7 -3 39.584 79.168 0.356 3.31 4 7.3 0.1 180 5 3 -3 39.596 79.193 0.356 3.31 4 61.6 6.4 181 6 0 1 39.681 79.363 0.357 3.3 2 13.2 0.1 182 2 12 -1 40.025 80.05 0.36 3.25 4 7.9 0.1 183 4 6 -3 40.08 80.16 0.36 3.24 4 60.7 6.1 184 6 2 1 40.267 80.534 0.361 3.22 4 45.8 3.5 185 1 11 -2 40.278 80.557 0.361 3.22 4 37.6 2.3 186 4 6 2 40.368 80.736 0.362 3.21 4 32.0 1.7 187 2 8 -3 40.452 80.904 0.363 3.2 4 40.3 2.7 188 6 6 0 40.508 81.017 0.363 3.19 4 29.3 1.4 189 5 7 1 40.513 81.026 0.363 3.19 4 53.8 4.7 190 3 1 3 40.656 81.313 0.364 3.18 4 11.3 0.2 191 5 9 -1 40.697 81.394 0.364 3.17 4 32.7 1.7 192 1 7 3 40.699 81.398 0.365 3.17 4 0.2 0.0 193 7 1 -1 40.937 81.874 0.366 3.14 4 6.8 0.1 194 5 1 2 40.962 81.923 0.366 3.14 4 207.8 69.5 195 0 8 3 41.008 82.015 0.367 3.14 4 10.3 0.2 196 5 9 0 41.202 82.404 0.368 3.12 4 24.5 1.0 197 1 13 0 41.232 82.463 0.368 3.11 4 17.8 0.5 198 2 10 2 41.505 83.009 0.37 3.09 4 81.8 10.6 199 3 11 1 41.579 83.158 0.371 3.08 4 12.7 0.3 200 2 6 3 41.745 83.491 0.372 3.06 4 150.2 35.4 201 2 12 1 41.816 83.632 0.373 3.06 4 8.6 0.1 202 3 3 3 41.82 83.64 0.373 3.06 4 29.4 1.3 203 5 5 -3 41.929 83.858 0.374 3.04 4 145.8 33.1 204 6 4 1 42.013 84.026 0.374 3.04 4 40.2 2.5 205 6 6 -2 42.067 84.134 0.375 3.03 4 10.1 0.2 206 1 11 2 42.067 84.134 0.375 3.03 4 188.4 55.1 207 7 3 -1 42.099 84.198 0.375 3.03 4 4.3 0.0 208 5 3 2 42.123 84.247 0.375 3.03 4 96.5 14.4 209 3 9 2 42.293 84.587 0.376 3.01 4 28.3 1.2 210 7 1 0 42.333 84.666 0.376 3.01 4 117.2 21.2 211 2 0 -4 42.365 84.731 0.377 3.01 2 54.3 2.3 212 1 13 -1 42.512 85.024 0.378 2.99 4 48.0 3.5 213 4 10 -2 42.521 85.041 0.378 2.99 4 57.0 5.0 214 1 9 -3 42.667 85.333 0.379 2.98 4 77.4 9.1 215 4 10 1 42.692 85.384 0.379 2.98 4 45.5 3.2 216 1 1 -4 42.701 85.403 0.379 2.98 4 165.7 41.9 217 3 11 -2 42.744 85.487 0.379 2.97 4 111.7 19.0 218 6 0 -3 42.8 85.601 0.38 2.97 2 1.6 0.0 219 2 2 -4 42.944 85.888 0.381 2.96 4 3.8 0.0 220 7 1 -2 42.994 85.989 0.381 2.95 4 25.7 1.0 221 3 1 -4 43.377 86.753 0.384 2.93 4 13.8 0.3 222 6 2 -3 43.378 86.757 0.384 2.93 4 44.4 3.0 223 1 13 1 43.401 86.801 0.384 2.92 4 40.7 2.5 224 7 3 0 43.489 86.979 0.385 2.92 4 42.0 2.6 225 6 8 -1 43.62 87.239 0.386 2.91 4 61.0 5.6 226 5 9 -2 43.644 87.288 0.386 2.91 4 39.8 2.4 227 0 0 4 43.805 87.609 0.387 2.9 2 165.1 20.2 228 1 3 -4 43.857 87.713 0.387 2.89 4 95.7 13.6 229 0 12 2 43.974 87.948 0.388 2.89 4 111.4 18.4 230 3 5 3 44.133 88.266 0.389 2.88 4 70.0 7.2 231 4 8 -3 44.14 88.281 0.389 2.88 4 3.4 0.0 232 7 3 -2 44.149 88.298 0.389 2.88 4 57.3 4.8 233 3 9 -3 44.229 88.458 0.39 2.87 4 59.7 5.2 234 2 12 -2 44.311 88.622 0.39 2.87 4 233.2 79.8 235 0 2 4 44.381 88.763 0.391 2.86 4 5.3 0.0 236 7 5 -1 44.41 88.821 0.391 2.86 4 181.1 48.0 237 4 8 2 44.424 88.849 0.391 2.86 4 30.0 1.3 238 5 5 2 44.435 88.87 0.391 2.86 4 43.0 2.7 239 3 3 -4 44.531 89.061 0.392 2.85 4 51.8 3.9 240 6 8 0 44.563 89.127 0.392 2.85 4 49.0 3.5 241 0 14 0 44.607 89.215 0.393 2.85 2 62.1 2.8 242 2 4 -4 44.676 89.351 0.393 2.85 4 44.3 2.9 243 6 6 1 44.902 89.803 0.395 2.83 4 69.3 7.0 X-ray diffraction powder data (I)...X-Ray wave length = 1.78892 (angs.): No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si) ( degree ) (angstrem) *100 *100 1 0 2 0 5.758 11.515 8.916 42.6 3.8 3.8 5.6 2 1 1 0 6.215 12.43 8.26215 1129.4 100.0 100.0 5.6 3 1 3 0 10.28 20.56 5.01204 27.5 2.4 2.4 5.6 4 1 1 -1 10.615 21.23 4.85574 148.2 13.1 13.1 5.6 5 0 2 1 11.539 23.077 4.47171 55.3 4.9 4.9 5.6 6 0 4 0 11.574 23.149 4.458 209.1 18.5 18.4 5.6 7 1 1 1 12.842 25.684 4.02432 21.7 1.9 1.9 5.6 8 1 3 -1 13.445 26.89 3.84699 167.0 14.8 14.6 5.6 9 2 2 -1 14.342 28.684 3.61097 18.7 1.7 1.6 5.6 10 1 3 1 15.289 30.578 3.39216 149.6 13.2 13.1 5.6 11 0 4 1 15.365 30.729 3.37584 24.0 2.1 2.1 5.6 12 2 4 0 16.118 32.237 3.22187 115.0 10.2 10.0 5.6 13 3 1 0 16.987 33.974 3.06161 493.8 43.7 43.0 5.7 14 2 2 1 17.686 35.372 2.94421 156.5 13.9 13.6 5.7 15 3 3 0 18.952 37.904 2.75405 51.2 4.5 4.5 5.7 16 1 5 1 19.35 38.7 2.69952 660.2 58.5 57.3 5.7 17 3 3 -1 19.573 39.145 2.67003 51.0 4.5 4.4 5.7 18 1 1 -2 19.916 39.832 2.62581 20.2 1.8 1.7 5.7 19 0 0 2 20.249 40.498 2.5844 12.7 1.1 1.1 5.7 20 0 6 1 20.314 40.628 2.57646 191.9 17.0 16.6 5.7 21 2 0 -2 20.762 41.525 2.52322 326.1 28.9 28.2 5.7 22 3 5 0 22.443 44.885 2.343 20.8 1.8 1.8 5.7 23 1 1 2 22.543 45.085 2.33314 22.5 2.0 1.9 5.7 24 3 5 -1 22.985 45.97 2.29061 193.9 17.2 16.7 5.7 25 1 7 -1 23.161 46.323 2.27411 23.9 2.1 2.1 5.7 26 4 2 -1 23.291 46.582 2.26218 55.7 4.9 4.8 5.7 27 3 1 -2 23.479 46.958 2.24506 149.2 13.2 12.8 5.7 28 2 4 -2 24.037 48.075 2.19589 21.9 1.9 1.9 5.7 29 1 7 1 24.363 48.726 2.16829 44.9 4.0 3.9 5.7 30 2 6 1 24.564 49.127 2.15167 157.2 13.9 13.5 5.7 31 1 5 -2 24.836 49.672 2.12953 11.8 1.0 1.0 5.7 32 3 3 -2 25.019 50.038 2.11497 18.0 1.6 1.5 5.7 33 2 0 2 25.662 51.324 2.06545 84.1 7.5 7.2 5.8 34 3 5 1 26.485 52.971 2.00565 98.1 8.7 8.4 5.8 35 4 0 -2 26.934 53.868 1.97468 39.5 3.5 3.4 5.8 36 3 7 0 27.001 54.002 1.97013 16.9 1.5 1.4 5.8 37 3 7 -1 27.476 54.952 1.93868 16.2 1.4 1.4 5.8 38 4 2 1 27.848 55.697 1.91478 11.9 1.1 1.0 5.8 39 2 4 2 28.508 57.016 1.87408 19.2 1.7 1.6 5.8 40 5 1 0 28.836 57.672 1.85454 13.9 1.2 1.2 5.8 41 1 9 -1 29.012 58.024 1.84428 55.8 4.9 4.7 5.8 42 4 6 -1 29.122 58.245 1.8379 19.7 1.7 1.7 5.8 43 1 9 1 30.045 60.091 1.78647 17.9 1.6 1.5 5.8 44 0 10 0 30.106 60.212 1.7832 32.7 2.9 2.8 5.8 45 5 3 0 30.182 60.363 1.77917 18.8 1.7 1.6 5.8 46 5 1 -2 31.632 63.264 1.70548 49.4 4.4 4.2 5.9 47 1 3 -3 31.831 63.661 1.69595 11.3 1.0 1.0 5.9 48 0 2 3 31.921 63.843 1.69164 32.5 2.9 2.7 5.9 49 5 5 -1 32.22 64.441 1.6776 14.6 1.3 1.2 5.9 50 2 8 -2 32.374 64.747 1.67053 18.6 1.6 1.6 5.9 51 4 6 1 33.131 66.263 1.63652 148.0 13.1 12.4 5.9 52 4 8 0 33.727 67.455 1.61093 28.9 2.6 2.4 5.9 53 1 11 0 34.059 68.118 1.59713 68.1 6.0 5.7 5.9 54 1 5 -3 34.353 68.705 1.58512 128.0 11.3 10.7 5.9 55 4 0 2 34.996 69.992 1.55959 30.5 2.7 2.5 5.9 56 6 0 0 35.144 70.288 1.55388 23.4 2.1 1.9 5.9 57 2 6 -3 36.302 72.603 1.51082 98.9 8.8 8.2 6.0 58 6 0 -2 36.77 73.539 1.49425 52.0 4.6 4.3 6.0 59 0 6 3 36.876 73.751 1.49057 13.9 1.2 1.2 6.0 60 5 5 1 36.967 73.934 1.48741 28.2 2.5 2.3 6.0 61 0 12 0 37.008 74.016 1.486 55.0 4.9 4.5 6.0 62 4 4 2 37.417 74.833 1.47211 16.6 1.5 1.4 6.0 63 2 10 -2 37.896 75.791 1.45625 29.1 2.6 2.4 6.0 64 1 7 -3 37.986 75.972 1.45329 19.3 1.7 1.6 6.0 65 3 11 0 38.486 76.971 1.4373 33.2 2.9 2.7 6.0 66 6 4 -2 39.148 78.297 1.41679 35.2 3.1 2.9 6.0 67 6 6 -1 39.551 79.102 1.4047 137.0 12.1 11.2 6.0 68 5 1 2 40.962 81.923 1.36444 69.5 6.2 5.6 6.1 69 2 6 3 41.745 83.491 1.34339 35.4 3.1 2.9 6.1 70 5 5 -3 41.929 83.858 1.33859 33.1 2.9 2.7 6.1 71 1 11 2 42.067 84.134 1.33501 55.1 4.9 4.4 6.1 72 5 3 2 42.123 84.247 1.33356 14.4 1.3 1.2 6.1 73 7 1 0 42.333 84.666 1.3282 21.2 1.9 1.7 6.1 74 1 9 -3 42.667 85.333 1.31979 12.3 1.1 1.0 6.1 75 1 1 -4 42.701 85.403 1.31892 41.9 3.7 3.4 6.1 76 3 11 -2 42.744 85.487 1.31786 19.0 1.7 1.5 6.1 77 0 0 4 43.805 87.609 1.2922 20.2 1.8 1.6 6.2 78 1 3 -4 43.857 87.713 1.29097 13.6 1.2 1.1 6.2 79 0 12 2 43.974 87.948 1.28823 18.4 1.6 1.5 6.2 80 3 5 3 44.133 88.266 1.28455 12.1 1.1 1.0 6.2 81 2 12 -2 44.311 88.622 1.28045 79.8 7.1 6.4 6.2 82 7 5 -1 44.41 88.821 1.27818 52.1 4.6 4.2 6.2 Reference: Chichagov A.V. et al. Information-Calculating System on Crystal Structure Data of Minerals (MINCRYST) - Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian) |