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 *** *********************** FAIRFIELDITE 4, t-fairfieldite, analogue K(2)Mn[SeO(4)](2).2H(2)O Triclinic P 1(-) Z = 1 P1(-) 24 .2 .14 Ref.Str.: Fleck M., Kolitsch U. (2003) * Z. Kristallogr., 218, 553-567 R: In original - synthetic compounds with krohnkite-type chains. N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 5.674 alpha = 110.31 b = 6.608 beta = 95.69 c = 7.523 gamma = 108.35 Unit cell volume (cub. angs.) = 244.1 Molar volume ( cub.cm/mol.) = 147.03 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.6835 0.3077 0.7433 0.0 K = 1.00 2 0.0 0.0 0.0 0.0 Mn = 1.00 3 0.655 0.322 0.2305 0.0 Se = 1.00 4 0.6153 0.1539 0.3481 0.0 O = 1.00 5 0.7511 0.5953 0.3763 0.0 O = 1.00 6 0.3879 0.2571 0.0784 0.0 O = 1.00 7 0.8685 0.2902 0.101 0.0 O = 1.00 8 0.9579 0.0074 0.7117 0.0 H(2)O = 1.00 9 0.06 0.018 0.709 0.0 H = 1.00 10 0.897 0.911 0.651 0.0 H = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.6835 0.3077 0.7433 2 2 0.0 0.0 0.0 3 3 0.655 0.322 0.2305 4 4 0.6153 0.1539 0.3481 5 5 0.7511 0.5953 0.3763 6 6 0.3879 0.2571 0.0784 7 7 0.8685 0.2902 0.101 8 8 0.9579 0.0074 0.7117 9 9 0.06 0.018 0.709 10 10 0.897 0.911 0.651 11 1 0.3165 0.6923 0.2567 12 3 0.345 0.678 0.7695 13 4 0.3847 0.8461 0.6519 14 5 0.2489 0.4047 0.6237 15 6 0.6121 0.7429 0.9216 16 7 0.1315 0.7098 0.899 17 8 0.0421 0.9926 0.2883 18 9 0.94 0.982 0.291 19 10 0.103 0.089 0.349 X-ray density (g/cm cub.) = 3.12 MU (1/cm) = 293.519 Mass attenuation coefficient (cm**2/g) = 94.011 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 K 3.396 9 2.7295 4 3.2171 6 2.8439 7 2.8477 8 2.7764 4 3.3452 5 2.8736 5 2.8977 6 2.8088 7 2 Mn 2.892 6 2.1843 6 2.1939 7 2.1776 8 2.1843 6 2.1939 7 2.1776 8 3 Se 2.628 4 1.6223 4 1.6272 5 1.6421 6 1.647 7 4 O 3.432 6 2.6961 5 2.6911 6 2.6848 7 3.4028 6 2.9515 8 3.0184 8 5 O 3.432 5 2.6961 4 2.6403 6 2.6492 7 2.7911 8 2.9582 8 6 O 3.432 8 2.6911 4 2.6403 5 2.6494 7 3.04 7 3.0424 8 3.4028 4 3.1507 7 3.1256 8 7 O 3.432 7 2.6848 4 2.6492 5 3.04 6 2.6494 6 3.069 8 3.1507 6 3.113 8 8 H(2)O 3.6 9 2.7911 5 3.0424 6 3.069 7 2.9515 4 3.0184 4 2.9582 5 3.1256 6 3.113 7 3.2401 8 9 H 1.8 1 0.5645 8 10 H 1.8 1 0.6016 8 X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.): No H K L Theta 2*Theta S LPG MF F I int. ( degree ) *100 1 0 0 1 6.448 12.896 0.073 155.62 2 30.2 475.8 2 0 1 0 7.703 15.406 0.087 108.38 2 7.2 18.6 3 0 -1 1 7.821 15.642 0.088 105.05 2 57.6 1171.0 4 1 0 0 8.46 16.92 0.095 89.47 2 21.3 136.3 5 -1 1 0 9.07 18.14 0.102 77.55 2 24.4 154.6 6 -1 0 1 9.372 18.744 0.106 72.49 2 16.6 67.0 7 1 -1 1 10.489 20.978 0.118 57.44 2 28.7 158.7 8 -1 1 1 11.795 23.59 0.133 44.98 2 57.3 496.4 9 1 0 1 11.825 23.649 0.133 44.75 2 50.6 384.9 10 0 1 1 11.916 23.833 0.134 44.03 2 25.5 95.8 11 0 -1 2 12.149 24.299 0.137 42.28 2 74.5 787.7 12 -1 -1 1 12.546 25.092 0.141 39.52 2 20.9 58.1 13 0 0 2 12.979 25.959 0.146 36.79 2 72.7 652.7 14 1 1 0 13.484 26.968 0.151 33.94 2 115.0 1506.1 15 -1 0 2 13.765 27.53 0.154 32.49 2 54.2 320.6 16 1 -2 1 14.205 28.41 0.159 30.38 2 34.0 117.7 17 0 -2 1 14.222 28.443 0.159 30.31 2 17.6 31.7 18 -1 2 0 14.653 29.305 0.164 28.44 2 106.6 1085.6 19 -1 -1 2 14.797 29.593 0.166 27.85 2 79.3 587.2 20 1 -1 2 14.962 29.923 0.168 27.2 2 60.7 335.8 21 0 2 0 15.549 31.099 0.174 25.04 2 45.3 172.6 22 0 -2 2 15.793 31.586 0.177 24.21 2 12.7 13.1 23 -2 1 0 15.897 31.793 0.178 23.87 2 110.3 974.1 24 1 -2 2 16.606 33.211 0.186 21.72 2 63.9 297.4 25 -2 0 1 16.818 33.636 0.188 21.13 2 53.5 202.8 26 -1 1 2 16.841 33.682 0.188 21.07 2 59.8 253.1 27 -2 1 1 16.87 33.74 0.188 20.99 2 17.8 22.4 28 2 0 0 17.112 34.224 0.191 20.35 2 18.1 22.3 29 1 1 1 17.132 34.264 0.191 20.3 2 27.9 53.2 30 1 0 2 17.212 34.424 0.192 20.09 2 46.0 142.9 31 2 -1 1 17.562 35.125 0.196 19.23 2 3.8 0.9 32 0 1 2 17.709 35.418 0.197 18.88 2 5.0 1.6 33 -1 2 1 17.754 35.507 0.198 18.78 2 38.8 94.9 34 0 -1 3 17.98 35.961 0.2 18.26 2 37.9 88.1 35 -2 2 0 18.378 36.755 0.205 17.41 2 14.8 12.7 36 2 -2 1 18.754 37.509 0.209 16.65 2 10.5 6.2 37 -1 -2 1 18.793 37.586 0.209 16.57 2 16.9 15.9 38 -2 0 2 19.007 38.015 0.211 16.16 2 26.4 37.7 39 -1 -1 3 19.23 38.461 0.214 15.75 2 13.6 9.8 40 0 2 1 19.24 38.48 0.214 15.73 2 4.4 1.0 41 -1 -2 2 19.348 38.696 0.215 15.54 2 49.0 125.4 42 -1 0 3 19.546 39.092 0.217 15.19 2 26.9 36.8 43 0 -2 3 19.644 39.288 0.218 15.02 2 60.6 185.1 44 0 0 3 19.688 39.376 0.219 14.95 2 27.1 36.8 45 2 0 1 19.793 39.585 0.22 14.77 2 7.7 3.0 46 -2 1 2 20.147 40.295 0.224 14.2 2 75.9 274.9 47 -2 -1 1 20.192 40.384 0.224 14.13 2 31.6 47.5 48 -2 2 1 20.326 40.651 0.225 13.93 2 15.5 11.2 49 1 2 0 20.533 41.066 0.228 13.61 2 22.9 23.9 50 1 -3 1 20.551 41.102 0.228 13.59 2 17.5 13.9 51 1 -1 3 20.738 41.476 0.23 13.31 2 44.3 87.7 52 1 -2 3 20.993 41.986 0.233 12.96 2 5.0 1.1 53 -2 -1 2 21.087 42.173 0.234 12.83 2 42.1 76.2 54 2 -1 2 21.329 42.659 0.236 12.5 2 74.7 234.2 55 2 -2 2 21.351 42.703 0.236 12.47 2 34.7 50.3 56 1 -3 2 21.357 42.714 0.236 12.47 2 47.2 93.0 57 2 1 0 21.478 42.956 0.238 12.31 2 2.1 0.2 58 0 -3 1 21.817 43.635 0.241 11.88 2 17.2 11.8 59 -1 3 0 21.895 43.789 0.242 11.79 2 29.0 33.4 60 0 -3 2 21.955 43.91 0.243 11.72 2 66.6 174.3 61 -1 -2 3 22.052 44.104 0.244 11.6 2 20.6 16.6 62 1 1 2 22.334 44.668 0.247 11.27 2 65.7 163.2 63 -1 2 2 22.56 45.121 0.249 11.02 2 59.1 129.3 64 -1 1 3 22.892 45.784 0.253 10.66 2 14.5 7.6 65 2 -3 1 22.916 45.832 0.253 10.64 2 8.9 2.8 66 -2 0 3 23.078 46.157 0.254 10.47 2 20.0 14.1 67 1 0 3 23.449 46.899 0.258 10.1 2 19.0 12.2 68 -2 3 0 23.556 47.111 0.259 9.99 2 9.4 3.0 69 0 3 0 23.71 47.42 0.261 9.85 2 95.6 301.8 70 -2 -1 3 23.964 47.927 0.264 9.61 2 45.8 67.6 71 0 -3 3 24.095 48.189 0.265 9.49 2 22.1 15.6 72 -2 2 2 24.131 48.261 0.265 9.46 2 26.2 21.9 73 1 -3 3 24.139 48.278 0.265 9.45 2 29.1 26.9 74 1 2 1 24.158 48.316 0.266 9.44 2 15.0 7.1 75 0 1 3 24.17 48.339 0.266 9.43 2 30.9 30.2 76 2 0 2 24.195 48.389 0.266 9.41 2 57.4 104.0 77 -3 1 0 24.234 48.468 0.266 9.37 2 11.7 4.3 78 2 -3 2 24.255 48.509 0.267 9.35 2 44.6 62.5 79 -3 1 1 24.346 48.691 0.268 9.27 2 5.0 0.8 80 0 2 2 24.391 48.782 0.268 9.23 2 79.5 196.1 81 0 -1 4 24.465 48.93 0.269 9.17 2 5.2 0.8 82 2 1 1 24.669 49.338 0.271 9.0 2 22.8 15.7 83 -1 -1 4 24.877 49.754 0.273 8.83 2 85.2 215.2 84 0 -2 4 24.893 49.785 0.273 8.82 2 8.7 2.2 85 -3 2 0 24.962 49.925 0.274 8.76 2 16.3 7.8 86 -2 1 3 24.975 49.951 0.274 8.75 2 31.0 28.3 87 -1 3 1 25.112 50.224 0.275 8.64 2 10.6 3.3 88 -3 0 1 25.416 50.831 0.279 8.41 2 4.0 0.5 89 2 -2 3 25.62 51.24 0.281 8.26 2 3.1 0.3 90 -2 -2 2 25.75 51.499 0.282 8.16 2 37.5 38.5 91 3 -2 1 25.828 51.656 0.283 8.11 2 22.3 13.5 92 -1 -3 2 25.859 51.718 0.283 8.08 2 44.6 54.0 93 -2 -2 1 25.878 51.756 0.283 8.07 2 15.1 6.2 94 -3 2 1 25.96 51.92 0.284 8.01 2 50.5 68.6 95 3 -1 1 26.006 52.011 0.285 7.98 2 34.7 32.3 96 -1 0 4 26.022 52.045 0.285 7.97 2 12.7 4.3 97 -2 3 1 26.062 52.124 0.285 7.94 2 42.1 47.3 98 3 0 0 26.19 52.381 0.286 7.85 2 91.2 219.0 99 -1 -3 1 26.3 52.599 0.288 7.78 2 0.2 0.0 100 -3 1 2 26.323 52.645 0.288 7.76 2 47.2 58.0 101 -1 -2 4 26.378 52.755 0.288 7.73 2 36.6 34.7 102 2 -1 3 26.477 52.954 0.289 7.66 2 13.9 5.0 103 -3 0 2 26.48 52.961 0.289 7.66 2 62.0 98.8 104 1 -2 4 26.583 53.165 0.29 7.59 2 87.3 194.1 105 0 0 4 26.692 53.384 0.292 7.52 2 57.7 84.2 106 1 -1 4 27.228 54.457 0.297 7.19 2 4.1 0.4 107 -1 -3 3 27.231 54.461 0.297 7.19 2 45.8 50.5 108 0 3 1 27.308 54.616 0.298 7.14 2 38.0 34.6 109 2 -3 3 27.352 54.705 0.298 7.11 2 70.3 118.1 110 -2 -2 3 27.429 54.859 0.299 7.07 2 15.0 5.3 111 2 2 0 27.797 55.594 0.303 6.86 2 71.7 118.3 112 0 -3 4 27.887 55.774 0.304 6.81 2 73.9 124.8 113 1 -4 2 27.938 55.876 0.304 6.78 2 53.1 64.1 114 1 -4 1 28.122 56.244 0.306 6.68 2 28.1 17.7 115 3 -3 1 28.2 56.399 0.307 6.64 2 28.4 18.0 116 -3 3 0 28.224 56.448 0.307 6.62 2 60.0 80.1 117 -2 -1 4 28.365 56.73 0.308 6.55 2 1.2 0.0 118 -2 0 4 28.417 56.833 0.309 6.52 2 28.5 17.7 119 -1 2 3 28.428 56.856 0.309 6.52 2 6.7 1.0 120 3 -2 2 28.435 56.871 0.309 6.51 2 49.7 54.0 121 1 -3 4 28.459 56.918 0.309 6.5 2 34.0 25.3 122 1 1 3 28.471 56.942 0.309 6.5 2 2.7 0.2 123 1 3 0 28.495 56.99 0.31 6.48 2 23.4 12.0 124 -3 2 2 28.683 57.365 0.312 6.39 2 53.2 60.7 125 3 0 1 28.7 57.4 0.312 6.38 2 24.6 13.0 126 -3 -1 1 28.955 57.911 0.314 6.25 2 28.8 17.4 127 2 -4 1 29.051 58.103 0.315 6.21 2 23.9 11.9 128 -3 -1 2 29.128 58.257 0.316 6.17 2 43.1 38.5 129 1 2 2 29.144 58.288 0.316 6.16 2 10.6 2.3 130 -3 0 3 29.244 58.488 0.317 6.11 2 30.3 18.9 131 -2 2 3 29.255 58.511 0.317 6.11 2 59.6 72.8 132 2 1 2 29.305 58.61 0.318 6.09 2 73.8 111.4 133 2 -4 2 29.393 58.785 0.319 6.04 2 38.1 29.4 134 3 -1 2 29.416 58.833 0.319 6.03 2 37.2 28.1 135 0 -4 2 29.429 58.859 0.319 6.03 2 41.9 35.5 136 1 -4 3 29.472 58.944 0.319 6.01 2 55.3 61.7 137 -1 1 4 29.596 59.192 0.321 5.95 2 25.0 12.5 138 -1 3 2 29.76 59.519 0.322 5.88 2 1.3 0.0 139 2 0 3 29.768 59.535 0.322 5.87 2 56.4 62.6 140 3 -3 2 29.879 59.757 0.323 5.83 2 37.7 27.7 141 -3 1 3 29.903 59.805 0.324 5.82 2 26.2 13.4 142 -3 3 1 29.949 59.898 0.324 5.8 2 13.5 3.5 143 -1 4 0 30.004 60.007 0.325 5.77 2 32.2 20.1 144 -2 3 2 30.103 60.206 0.326 5.73 2 74.5 106.8 145 0 -4 1 30.121 60.241 0.326 5.72 2 51.7 51.3 146 -1 -3 4 30.247 60.494 0.327 5.67 2 3.1 0.2 147 1 0 4 30.288 60.576 0.327 5.65 2 29.2 16.2 148 -2 4 0 30.392 60.784 0.328 5.61 2 70.9 94.5 149 0 -4 3 30.412 60.823 0.329 5.6 2 6.7 0.8 150 3 1 0 30.463 60.927 0.329 5.58 2 7.6 1.1 151 0 2 3 30.508 61.015 0.33 5.56 2 7.2 1.0 152 -2 -2 4 30.715 61.431 0.332 5.48 2 105.8 206.0 153 -2 1 4 30.862 61.724 0.333 5.42 2 78.8 113.0 154 -3 -1 3 30.965 61.931 0.334 5.38 2 3.8 0.3 155 0 -2 5 31.084 62.168 0.335 5.34 2 17.0 5.1 156 2 -2 4 31.087 62.174 0.335 5.33 2 38.9 27.1 157 0 1 4 31.176 62.352 0.336 5.3 2 5.7 0.6 158 2 2 1 31.285 62.571 0.337 5.26 2 24.6 10.7 159 -1 -1 5 31.35 62.7 0.338 5.24 2 18.8 6.2 160 2 -4 3 31.382 62.764 0.338 5.22 2 7.1 0.9 161 0 -1 5 31.497 62.993 0.339 5.18 2 7.8 1.1 162 2 -3 4 31.864 63.728 0.343 5.05 2 7.4 0.9 163 -1 -2 5 31.886 63.773 0.343 5.04 2 23.5 9.4 164 -2 -3 2 32.201 64.401 0.346 4.94 2 19.2 6.1 165 1 3 1 32.211 64.422 0.346 4.94 2 28.5 13.5 166 0 3 2 32.233 64.467 0.346 4.93 2 38.2 24.1 167 0 4 0 32.421 64.842 0.348 4.87 2 13.9 3.1 168 3 -2 3 32.512 65.024 0.349 4.84 2 50.7 41.8 169 1 -4 4 32.573 65.146 0.349 4.82 2 11.5 2.1 170 2 -1 4 32.612 65.224 0.35 4.8 2 64.3 66.8 171 3 0 2 32.687 65.375 0.351 4.78 2 45.8 33.7 172 3 -4 1 32.754 65.509 0.351 4.76 2 11.8 2.2 173 -3 2 3 32.855 65.71 0.352 4.73 2 17.2 4.7 174 -2 -3 3 32.921 65.842 0.353 4.71 2 6.1 0.6 175 0 -3 5 32.966 65.932 0.353 4.69 2 22.5 8.0 176 0 -4 4 32.979 65.957 0.353 4.69 2 6.6 0.7 177 1 -2 5 33.046 66.092 0.354 4.67 2 33.4 17.5 178 -2 -3 1 33.072 66.144 0.354 4.66 2 23.1 8.4 179 -1 0 5 33.101 66.202 0.354 4.65 2 2.1 0.1 180 3 -3 3 33.102 66.204 0.355 4.65 2 17.0 4.5 181 -4 1 1 33.145 66.291 0.355 4.64 2 69.6 75.5 182 -3 3 2 33.213 66.425 0.356 4.62 2 56.6 49.6 183 -4 2 0 33.217 66.433 0.356 4.62 2 91.7 130.4 184 -2 4 1 33.293 66.587 0.356 4.6 2 0.3 0.0 185 -1 4 1 33.408 66.817 0.357 4.56 2 32.7 16.4 186 -3 0 4 33.444 66.888 0.358 4.55 2 77.9 92.8 187 3 1 1 33.518 67.035 0.358 4.53 2 19.4 5.7 188 -3 4 0 33.531 67.062 0.359 4.53 2 12.3 2.3 189 -4 1 0 33.537 67.074 0.359 4.53 2 21.2 6.8 190 3 -4 2 33.556 67.112 0.359 4.52 2 27.1 11.2 191 -4 2 1 33.577 67.154 0.359 4.52 2 7.9 0.9 192 -1 -4 2 33.624 67.248 0.359 4.5 2 60.9 56.1 193 -3 -2 2 33.895 67.79 0.362 4.43 2 31.3 14.6 194 -2 -1 5 33.937 67.874 0.362 4.42 2 26.9 10.7 195 1 -3 5 33.966 67.932 0.363 4.41 2 17.5 4.5 196 -1 -4 3 34.063 68.126 0.364 4.38 2 20.4 6.1 197 0 0 5 34.159 68.319 0.364 4.36 2 18.6 5.1 198 3 -1 3 34.169 68.339 0.365 4.35 2 19.4 5.5 199 -3 -1 4 34.311 68.622 0.366 4.32 2 32.4 15.2 200 -4 1 2 34.321 68.642 0.366 4.31 2 49.9 36.0 201 1 -1 5 34.359 68.718 0.366 4.3 2 9.9 1.4 202 4 -2 1 34.421 68.842 0.367 4.29 2 38.2 21.1 203 -3 -2 1 34.48 68.96 0.367 4.27 2 13.2 2.5 204 -1 -3 5 34.654 69.308 0.369 4.23 2 23.6 7.9 205 -2 0 5 34.725 69.45 0.37 4.21 2 3.3 0.2 206 -1 -4 1 34.742 69.484 0.37 4.21 2 19.9 5.6 207 -3 1 4 34.796 69.593 0.37 4.19 2 16.9 4.0 208 2 -4 4 34.86 69.719 0.371 4.18 2 81.1 92.3 209 -3 -2 3 34.862 69.724 0.371 4.18 2 31.6 14.0 210 -4 0 1 34.938 69.875 0.372 4.16 2 4.0 0.2 211 2 1 3 35.071 70.142 0.373 4.13 2 8.6 1.0 212 -4 3 0 35.115 70.231 0.373 4.12 2 4.4 0.3 213 -1 2 4 35.14 70.28 0.374 4.11 2 79.8 87.8 214 -2 -3 4 35.183 70.367 0.374 4.1 2 11.8 1.9 215 1 2 3 35.188 70.377 0.374 4.1 2 55.9 43.0 216 -2 -2 5 35.354 70.707 0.376 4.06 2 31.1 13.2 217 -4 0 2 35.357 70.713 0.376 4.06 2 24.4 8.1 218 -2 3 3 35.385 70.77 0.376 4.05 2 16.4 3.6 219 1 1 4 35.385 70.771 0.376 4.05 2 75.0 76.6 220 -2 2 4 35.411 70.823 0.376 4.05 2 23.2 7.3 221 4 -1 1 35.471 70.941 0.377 4.04 2 31.3 13.3 222 2 3 0 35.476 70.952 0.377 4.03 2 7.7 0.8 223 -4 2 2 35.479 70.959 0.377 4.03 2 43.5 25.6 224 -1 3 3 35.54 71.079 0.377 4.02 2 37.9 19.4 225 4 -3 1 35.564 71.127 0.378 4.01 2 11.3 1.7 226 1 -5 2 35.809 71.617 0.38 3.96 2 62.2 51.4 227 -3 4 1 35.836 71.672 0.38 3.95 2 2.9 0.1 228 3 -4 3 35.884 71.768 0.38 3.94 2 12.3 2.0 229 -1 -4 4 36.032 72.064 0.382 3.91 2 74.7 73.3 230 4 0 0 36.049 72.098 0.382 3.91 2 27.5 9.9 231 2 2 2 36.097 72.193 0.382 3.9 2 62.3 50.8 232 0 4 1 36.168 72.337 0.383 3.88 2 3.3 0.1 233 -4 3 1 36.194 72.389 0.383 3.88 2 8.2 0.9 234 2 -5 2 36.207 72.414 0.383 3.88 2 15.7 3.2 235 2 0 4 36.286 72.572 0.384 3.86 2 18.8 4.6 236 1 -5 3 36.44 72.881 0.386 3.83 2 7.7 0.8 237 3 2 0 36.584 73.167 0.387 3.8 2 25.7 8.4 238 2 -5 1 36.626 73.251 0.387 3.79 2 23.3 6.9 239 1 -5 1 36.693 73.386 0.388 3.78 2 19.6 4.8 240 0 -4 5 36.963 73.926 0.39 3.73 2 3.3 0.1 241 -1 1 5 36.974 73.947 0.39 3.72 2 16.9 3.6 242 -4 1 3 36.993 73.986 0.391 3.72 2 5.1 0.3 243 1 -4 5 37.04 74.08 0.391 3.71 2 23.0 6.6 244 4 -2 2 37.12 74.24 0.392 3.7 2 33.0 13.5 245 1 3 2 37.22 74.44 0.393 3.68 2 60.5 45.2 246 -4 0 3 37.285 74.569 0.393 3.67 2 26.5 8.6 247 2 -5 3 37.297 74.593 0.393 3.67 2 9.3 1.1 248 -3 -2 4 37.327 74.655 0.394 3.66 2 0.3 0.0 249 1 4 0 37.354 74.707 0.394 3.66 2 77.7 74.2 250 0 2 4 37.471 74.943 0.395 3.63 2 30.4 11.3 251 4 -3 2 37.517 75.033 0.395 3.63 2 48.9 29.1 252 2 -2 5 37.552 75.104 0.396 3.62 2 3.7 0.2 253 2 -3 5 37.553 75.106 0.396 3.62 2 43.1 22.6 254 -2 4 2 37.579 75.157 0.396 3.62 2 49.3 29.6 255 -2 1 5 37.656 75.313 0.397 3.6 2 31.0 11.6 256 3 -3 4 37.677 75.353 0.397 3.6 2 69.9 59.0 257 1 0 5 37.797 75.594 0.398 3.58 2 6.3 0.5 258 -3 3 3 37.823 75.646 0.398 3.57 2 4.7 0.3 259 3 -2 4 37.836 75.671 0.398 3.57 2 2.9 0.1 260 3 0 3 37.934 75.868 0.399 3.55 2 6.5 0.5 261 3 1 2 37.94 75.879 0.399 3.55 2 13.4 2.1 262 0 -5 2 37.997 75.995 0.4 3.54 2 59.6 42.2 263 0 -2 6 38.125 76.251 0.401 3.52 2 39.3 18.3 264 -1 4 2 38.145 76.289 0.401 3.52 2 46.4 25.5 265 0 -5 3 38.161 76.321 0.401 3.52 2 56.7 38.0 266 -3 2 4 38.264 76.527 0.402 3.5 2 40.7 19.5 267 0 3 3 38.276 76.551 0.402 3.5 2 13.4 2.1 268 -1 -2 6 38.405 76.809 0.403 3.48 2 53.0 32.8 269 -4 -1 2 38.513 77.025 0.404 3.46 2 48.9 27.8 270 -2 5 0 38.535 77.07 0.404 3.46 2 5.1 0.3 271 1 -5 4 38.56 77.12 0.405 3.45 2 62.0 44.6 272 -1 -1 6 38.622 77.244 0.405 3.45 2 40.1 18.6 273 4 0 1 38.637 77.274 0.405 3.44 2 0.5 0.0 274 -4 3 2 38.75 77.5 0.406 3.43 2 4.4 0.2 275 -4 -1 1 38.816 77.632 0.407 3.42 2 1.9 0.0 276 4 -4 1 38.817 77.635 0.407 3.42 2 30.7 10.8 277 -4 2 3 38.828 77.655 0.407 3.41 2 15.5 2.8 278 4 -1 2 38.848 77.696 0.407 3.41 2 29.8 10.1 279 0 1 5 38.853 77.706 0.407 3.41 2 15.9 2.9 280 -2 -3 5 38.872 77.743 0.407 3.41 2 27.3 8.5 281 -3 0 5 38.882 77.763 0.407 3.41 2 21.0 5.0 282 -3 -1 5 38.996 77.992 0.408 3.39 2 29.8 10.1 283 -1 5 0 39.055 78.11 0.409 3.38 2 70.0 55.7 284 -4 4 0 39.091 78.183 0.409 3.38 2 32.0 11.6 285 3 -5 1 39.119 78.238 0.41 3.37 2 30.0 10.2 286 0 -3 6 39.152 78.304 0.41 3.37 2 51.2 29.7 287 3 -5 2 39.163 78.326 0.41 3.37 2 54.2 33.2 288 0 -1 6 39.209 78.418 0.41 3.36 2 59.9 40.4 289 2 3 1 39.294 78.589 0.411 3.35 2 13.9 2.2 290 0 -5 1 39.317 78.633 0.411 3.34 2 24.9 7.0 291 -1 -4 5 39.439 78.879 0.412 3.33 2 16.3 3.0 292 -3 4 2 39.56 79.12 0.413 3.31 2 10.4 1.2 293 3 -4 4 39.63 79.26 0.414 3.3 2 26.5 7.8 294 2 -1 5 39.662 79.325 0.414 3.3 2 48.1 25.7 295 2 -4 5 39.665 79.331 0.414 3.3 2 45.9 23.3 296 -4 -1 3 39.686 79.372 0.415 3.29 2 4.7 0.2 297 0 -5 4 39.8 79.601 0.416 3.28 2 15.4 2.6 298 2 -5 4 39.852 79.703 0.416 3.27 2 0.7 0.0 299 4 -4 2 40.018 80.035 0.417 3.25 2 23.3 5.9 300 -2 -4 3 40.075 80.151 0.418 3.25 2 25.4 7.0 301 3 -1 4 40.098 80.197 0.418 3.24 2 19.8 4.3 302 -2 -4 2 40.113 80.227 0.418 3.24 2 47.4 24.4 303 3 2 1 40.115 80.229 0.418 3.24 2 8.2 0.7 304 -1 -3 6 40.289 80.577 0.42 3.22 2 31.2 10.5 305 1 -2 6 40.38 80.759 0.421 3.21 2 35.0 13.2 306 -3 -3 2 40.454 80.908 0.421 3.2 2 54.3 31.6 307 1 -3 6 40.537 81.075 0.422 3.19 2 52.8 29.9 308 -3 5 0 40.544 81.088 0.422 3.19 2 14.3 2.2 309 -2 -1 6 40.563 81.126 0.422 3.19 2 4.4 0.2 310 4 1 0 40.588 81.176 0.422 3.18 2 61.3 40.2 311 -4 0 4 40.646 81.291 0.423 3.18 2 12.1 1.6 312 -3 -3 3 40.667 81.334 0.423 3.18 2 19.3 4.0 313 3 -5 3 40.675 81.35 0.423 3.17 2 51.4 28.1 314 -4 4 1 40.832 81.663 0.424 3.16 2 38.1 15.4 315 -3 1 5 40.861 81.721 0.425 3.15 2 7.3 0.6 316 4 -3 3 40.901 81.802 0.425 3.15 2 26.4 7.4 317 -1 0 6 40.931 81.863 0.425 3.15 2 1.2 0.0 318 -4 1 4 41.06 82.121 0.426 3.13 2 10.2 1.1 319 -3 -2 5 41.199 82.398 0.428 3.12 2 23.5 5.8 320 -2 -2 6 41.204 82.407 0.428 3.12 2 52.3 28.6 321 4 -2 3 41.212 82.424 0.428 3.12 2 3.8 0.1 322 0 4 2 41.228 82.456 0.428 3.11 2 2.8 0.1 323 1 4 1 41.364 82.728 0.429 3.1 2 5.3 0.3 324 -2 -4 4 41.499 82.998 0.43 3.09 2 33.9 11.9 325 -2 -4 1 41.611 83.223 0.431 3.08 2 12.3 1.6 326 -3 -3 1 41.7 83.401 0.432 3.07 2 6.7 0.5 327 -2 3 4 41.802 83.603 0.433 3.06 2 43.8 19.6 328 -2 5 1 41.874 83.748 0.433 3.05 2 1.7 0.0 329 2 1 4 41.898 83.796 0.433 3.05 2 44.9 20.6 330 -2 0 6 42.0 84.0 0.434 3.04 2 62.7 40.0 331 0 5 0 42.081 84.161 0.435 3.03 2 29.2 8.7 332 1 -5 5 42.101 84.202 0.435 3.03 2 20.8 4.4 333 2 2 3 42.116 84.231 0.435 3.03 2 13.8 1.9 334 0 -4 6 42.248 84.497 0.436 3.02 2 33.2 11.1 335 1 2 4 42.258 84.516 0.437 3.02 2 15.4 2.4 336 1 -1 6 42.299 84.597 0.437 3.01 2 2.0 0.0 337 -4 -1 4 42.307 84.613 0.437 3.01 2 66.6 44.9 338 -3 -3 4 42.335 84.67 0.437 3.01 2 72.0 52.4 339 -1 -5 3 42.36 84.72 0.437 3.01 2 7.0 0.5 340 0 0 6 42.361 84.722 0.437 3.01 2 38.9 15.3 341 -1 3 4 42.394 84.789 0.438 3.0 2 12.9 1.7 342 -2 2 5 42.585 85.17 0.439 2.99 2 13.1 1.7 343 4 0 2 42.628 85.255 0.44 2.98 2 46.3 21.5 344 -1 -5 2 42.646 85.292 0.44 2.98 2 19.4 3.8 345 4 -4 3 42.662 85.325 0.44 2.98 2 51.9 26.9 346 -4 3 3 42.71 85.419 0.44 2.98 2 32.7 10.7 347 1 -4 6 42.768 85.535 0.441 2.97 2 30.1 9.0 348 -1 2 5 42.773 85.545 0.441 2.97 2 8.2 0.7 349 -1 5 1 42.829 85.659 0.441 2.97 2 6.1 0.4 350 0 -5 5 42.876 85.751 0.442 2.96 2 2.4 0.1 351 -5 2 1 42.902 85.804 0.442 2.96 2 5.2 0.3 352 -5 2 0 43.014 86.028 0.443 2.95 2 15.7 2.5 353 -2 4 3 43.15 86.3 0.444 2.94 2 3.3 0.1 354 1 1 5 43.201 86.402 0.444 2.94 2 24.5 5.9 355 -5 1 1 43.352 86.704 0.446 2.93 2 4.5 0.2 356 -3 5 1 43.409 86.817 0.446 2.92 2 53.2 27.8 357 1 3 3 43.443 86.887 0.446 2.92 2 12.7 1.6 358 3 -3 5 43.516 87.032 0.447 2.92 2 40.0 15.7 359 -1 -5 4 43.523 87.047 0.447 2.92 2 2.3 0.1 360 -4 2 4 43.541 87.082 0.447 2.91 2 54.0 28.6 361 4 -1 3 43.59 87.18 0.448 2.91 2 23.7 5.5 362 3 -5 4 43.624 87.249 0.448 2.91 2 21.6 4.5 363 3 1 3 43.644 87.288 0.448 2.91 2 46.6 21.2 364 -4 -2 2 43.656 87.312 0.448 2.91 2 38.1 14.1 365 -3 3 4 43.698 87.397 0.448 2.9 2 71.5 49.8 366 4 1 1 43.792 87.584 0.449 2.9 2 45.8 20.4 367 2 0 5 43.809 87.618 0.449 2.9 2 9.5 0.9 368 2 -5 5 43.814 87.628 0.449 2.9 2 13.2 1.7 369 -2 -3 6 43.907 87.814 0.45 2.89 2 56.8 31.3 370 -5 3 0 43.934 87.868 0.45 2.89 2 20.2 3.9 371 -5 1 2 43.995 87.99 0.451 2.88 2 46.4 20.8 372 -4 4 2 44.004 88.008 0.451 2.88 2 57.2 31.7 373 4 -5 1 44.056 88.112 0.451 2.88 2 26.2 6.6 374 -4 -2 3 44.114 88.229 0.452 2.88 2 2.9 0.1 375 -1 4 3 44.143 88.286 0.452 2.88 2 4.4 0.2 376 -5 1 0 44.156 88.312 0.452 2.87 2 70.7 48.2 377 -1 -4 6 44.215 88.431 0.453 2.87 2 32.7 10.3 378 -5 2 2 44.237 88.473 0.453 2.87 2 19.7 3.8 379 -2 -4 5 44.36 88.721 0.454 2.86 2 13.0 1.6 380 3 -2 5 44.361 88.722 0.454 2.86 2 14.6 2.1 381 -1 -5 1 44.379 88.757 0.454 2.86 2 26.5 6.7 382 3 3 0 44.388 88.775 0.454 2.86 2 68.2 44.7 383 3 0 4 44.393 88.787 0.454 2.86 2 55.9 30.1 384 2 -3 6 44.399 88.797 0.454 2.86 2 21.6 4.5 385 2 3 2 44.459 88.918 0.455 2.86 2 9.3 0.8 386 -5 3 1 44.513 89.026 0.455 2.85 2 43.9 18.5 387 4 -5 2 44.542 89.085 0.455 2.85 2 37.5 13.5 388 2 4 0 44.547 89.094 0.455 2.85 2 14.6 2.0 389 5 -2 1 44.573 89.146 0.456 2.85 2 19.6 3.7 390 2 -6 2 44.594 89.188 0.456 2.85 2 46.7 20.9 391 -3 4 3 44.639 89.278 0.456 2.85 2 40.8 15.9 392 -4 -2 1 44.644 89.287 0.456 2.85 2 43.8 18.3 393 3 -4 5 44.731 89.461 0.457 2.84 2 12.0 1.4 394 5 -3 1 44.801 89.601 0.457 2.84 2 29.8 8.5 395 -3 2 5 44.881 89.761 0.458 2.83 2 21.6 4.4 396 2 -6 3 44.948 89.896 0.459 2.83 2 44.1 18.5 397 -3 -1 6 44.967 89.934 0.459 2.83 2 54.6 28.3 398 1 -6 3 44.972 89.943 0.459 2.83 2 1.0 0.0 X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (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 0 1 6.448 12.896 6.85916 475.8 31.6 31.9 5.6 2 0 1 0 7.703 15.406 5.74686 18.6 1.2 1.2 5.6 3 0 -1 1 7.821 15.642 5.66042 1171.0 77.7 78.4 5.6 4 1 0 0 8.46 16.92 5.23578 136.3 9.0 9.1 5.6 5 -1 1 0 9.07 18.14 4.88633 154.6 10.3 10.3 5.6 6 -1 0 1 9.372 18.744 4.73016 67.0 4.5 4.5 5.6 7 1 -1 1 10.489 20.978 4.23129 158.7 10.5 10.6 5.6 8 -1 1 1 11.795 23.59 3.76832 496.4 33.0 33.0 5.6 9 1 0 1 11.825 23.649 3.75895 384.9 25.6 25.6 5.6 10 0 1 1 11.916 23.833 3.73049 95.8 6.4 6.4 5.6 11 0 -1 2 12.149 24.299 3.65998 787.7 52.3 52.4 5.6 12 -1 -1 1 12.546 25.092 3.54609 58.1 3.9 3.9 5.6 13 0 0 2 12.979 25.959 3.42958 652.7 43.3 43.4 5.6 14 1 1 0 13.484 26.968 3.30352 1506.1 100.0 100.0 5.6 15 -1 0 2 13.765 27.53 3.2373 320.6 21.3 21.3 5.6 16 1 -2 1 14.205 28.41 3.13894 149.3 9.9 9.9 5.6 17 -1 2 0 14.653 29.305 3.0451 1085.6 72.1 71.9 5.6 18 -1 -1 2 14.797 29.593 3.01612 587.2 39.0 38.9 5.6 19 1 -1 2 14.962 29.923 2.98361 335.8 22.3 22.2 5.6 20 0 2 0 15.549 31.099 2.87343 172.6 11.5 11.4 5.6 21 -2 1 0 15.897 31.793 2.81223 974.1 64.7 64.4 5.6 22 1 -2 2 16.606 33.211 2.69532 297.4 19.7 19.6 5.6 23 -1 1 2 16.841 33.682 2.6587 456.0 30.3 30.1 5.7 24 -2 1 1 16.87 33.74 2.65426 22.4 1.5 1.5 5.7 25 1 1 1 17.132 34.264 2.61489 75.5 5.0 5.0 5.7 26 1 0 2 17.212 34.424 2.6031 142.9 9.5 9.4 5.7 27 -1 2 1 17.754 35.507 2.52614 94.9 6.3 6.3 5.7 28 0 -1 3 17.98 35.961 2.4953 88.1 5.8 5.8 5.7 29 -1 -2 1 18.793 37.586 2.39106 15.9 1.1 1.0 5.7 30 -2 0 2 19.007 38.015 2.36508 37.7 2.5 2.5 5.7 31 -1 -2 2 19.348 38.696 2.32501 125.4 8.3 8.2 5.7 32 -1 0 3 19.546 39.092 2.30233 36.8 2.4 2.4 5.7 33 0 -2 3 19.644 39.288 2.29132 185.1 12.3 12.2 5.7 34 0 0 3 19.688 39.376 2.28639 36.8 2.4 2.4 5.7 35 -2 1 2 20.147 40.295 2.23634 274.9 18.3 18.0 5.7 36 -2 -1 1 20.192 40.384 2.23164 47.5 3.2 3.1 5.7 37 1 2 0 20.533 41.066 2.19612 37.8 2.5 2.5 5.7 38 1 -1 3 20.738 41.476 2.17532 87.7 5.8 5.7 5.7 39 -2 -1 2 21.087 42.173 2.14099 76.2 5.1 5.0 5.7 40 2 -1 2 21.329 42.659 2.11774 377.5 25.1 24.7 5.7 41 -1 3 0 21.895 43.789 2.06564 33.4 2.2 2.2 5.7 42 0 -3 2 21.955 43.91 2.06026 174.3 11.6 11.4 5.7 43 -1 -2 3 22.052 44.104 2.05161 16.6 1.1 1.1 5.7 44 1 1 2 22.334 44.668 2.02703 163.2 10.8 10.7 5.7 45 -1 2 2 22.56 45.121 2.00774 129.3 8.6 8.4 5.7 46 0 3 0 23.71 47.42 1.91562 301.8 20.0 19.7 5.7 47 -2 -1 3 23.964 47.927 1.89651 67.6 4.5 4.4 5.7 48 0 -3 3 24.095 48.189 1.88681 15.6 1.0 1.0 5.7 49 1 -3 3 24.139 48.278 1.88355 55.9 3.7 3.6 5.7 50 2 0 2 24.195 48.389 1.87948 134.2 8.9 8.7 5.7 51 2 -3 2 24.255 48.509 1.8751 66.8 4.4 4.3 5.7 52 0 2 2 24.391 48.782 1.86525 196.1 13.0 12.8 5.7 53 2 1 1 24.669 49.338 1.84554 15.7 1.0 1.0 5.7 54 -1 -1 4 24.877 49.754 1.83106 217.4 14.4 14.1 5.7 55 -2 1 3 24.975 49.951 1.82431 36.1 2.4 2.3 5.7 56 -2 -2 2 25.75 51.499 1.77305 38.5 2.6 2.5 5.8 57 -1 -3 2 25.859 51.718 1.76607 60.2 4.0 3.9 5.8 58 -3 2 1 25.96 51.92 1.75966 68.6 4.6 4.4 5.8 59 3 -1 1 26.006 52.011 1.75679 36.6 2.4 2.4 5.8 60 -2 3 1 26.062 52.124 1.75325 47.3 3.1 3.1 5.8 61 3 0 0 26.19 52.381 1.74526 219.0 14.5 14.2 5.8 62 -3 1 2 26.323 52.645 1.73712 58.0 3.8 3.7 5.8 63 -1 -2 4 26.378 52.755 1.73375 34.7 2.3 2.2 5.8 64 -3 0 2 26.48 52.961 1.72751 103.7 6.9 6.7 5.8 65 1 -2 4 26.583 53.165 1.72134 194.1 12.9 12.6 5.8 66 0 0 4 26.692 53.384 1.71479 84.2 5.6 5.4 5.8 67 -1 -3 3 27.231 54.461 1.6834 50.5 3.4 3.3 5.8 68 0 3 1 27.308 54.616 1.67899 34.6 2.3 2.2 5.8 69 2 -3 3 27.352 54.705 1.67648 118.1 7.8 7.6 5.8 70 2 2 0 27.797 55.594 1.65176 118.3 7.9 7.6 5.8 71 0 -3 4 27.887 55.774 1.64686 124.8 8.3 8.0 5.8 72 1 -4 2 27.938 55.876 1.64409 64.1 4.3 4.1 5.8 73 1 -4 1 28.122 56.244 1.63421 17.7 1.2 1.1 5.8 74 -3 3 0 28.224 56.448 1.62878 98.1 6.5 6.3 5.8 75 3 -2 2 28.435 56.871 1.61767 98.1 6.5 6.3 5.8 76 -3 2 2 28.683 57.365 1.60489 73.7 4.9 4.7 5.8 77 -3 -1 1 28.955 57.911 1.59107 17.4 1.2 1.1 5.8 78 -3 -1 2 29.128 58.257 1.58243 40.8 2.7 2.6 5.8 79 -2 2 3 29.255 58.511 1.57617 91.7 6.1 5.9 5.8 80 2 1 2 29.305 58.61 1.57375 111.4 7.4 7.1 5.8 81 2 -4 2 29.393 58.785 1.56947 57.5 3.8 3.7 5.8 82 0 -4 2 29.429 58.859 1.56768 35.5 2.4 2.3 5.8 83 1 -4 3 29.472 58.944 1.56561 61.7 4.1 4.0 5.8 84 2 0 3 29.768 59.535 1.55147 62.6 4.2 4.0 5.8 85 3 -3 2 29.879 59.757 1.54624 41.1 2.7 2.6 5.8 86 -1 4 0 30.004 60.007 1.54039 20.1 1.3 1.3 5.8 87 -2 3 2 30.103 60.206 1.53578 158.0 10.5 10.1 5.8 88 1 0 4 30.288 60.576 1.52727 16.2 1.1 1.0 5.8 89 -2 4 0 30.392 60.784 1.52255 95.4 6.3 6.1 5.8 90 -2 -2 4 30.715 61.431 1.50806 206.0 13.7 13.2 5.8 91 -2 1 4 30.862 61.724 1.5016 113.0 7.5 7.2 5.8 92 2 -2 4 31.087 62.174 1.49181 32.2 2.1 2.1 5.8 93 0 3 2 32.233 64.467 1.44418 43.7 2.9 2.8 5.9 94 3 -2 3 32.512 65.024 1.43313 41.8 2.8 2.7 5.9 95 2 -1 4 32.612 65.224 1.42924 66.8 4.4 4.2 5.9 96 3 0 2 32.687 65.375 1.4263 33.7 2.2 2.1 5.9 97 1 -2 5 33.046 66.092 1.41254 25.8 1.7 1.6 5.9 98 -4 1 1 33.145 66.291 1.40879 75.5 5.0 4.8 5.9 99 -4 2 0 33.217 66.433 1.40612 180.0 12.0 11.4 5.9 100 -1 4 1 33.408 66.817 1.39898 16.4 1.1 1.0 5.9 101 -3 0 4 33.444 66.888 1.39766 92.8 6.2 5.9 5.9 102 -4 1 0 33.537 67.074 1.39423 27.0 1.8 1.7 5.9 103 -1 -4 2 33.624 67.248 1.39104 56.1 3.7 3.6 5.9 104 -2 -1 5 33.937 67.874 1.37973 15.2 1.0 1.0 5.9 105 -4 1 2 34.321 68.642 1.36617 51.2 3.4 3.2 5.9 106 4 -2 1 34.421 68.842 1.36267 21.1 1.4 1.3 5.9 107 2 -4 4 34.86 69.719 1.34766 106.3 7.1 6.7 5.9 108 -1 2 4 35.14 70.28 1.33828 87.8 5.8 5.5 5.9 109 1 2 3 35.188 70.377 1.33667 44.9 3.0 2.8 5.9 110 -2 -2 5 35.354 70.707 1.33124 21.3 1.4 1.3 5.9 111 -2 2 4 35.411 70.823 1.32935 87.6 5.8 5.5 5.9 112 -4 2 2 35.479 70.959 1.32713 39.7 2.6 2.5 5.9 113 -1 3 3 35.54 71.079 1.32518 21.1 1.4 1.3 5.9 114 1 -5 2 35.809 71.617 1.31654 51.5 3.4 3.2 5.9 115 -1 -4 4 36.032 72.064 1.30947 83.2 5.5 5.2 5.9 116 2 2 2 36.097 72.193 1.30744 50.8 3.4 3.2 5.9 117 1 3 2 37.22 74.44 1.27345 45.2 3.0 2.8 6.0 118 1 4 0 37.354 74.707 1.26955 74.2 4.9 4.6 6.0 119 4 -3 2 37.517 75.033 1.26484 29.1 1.9 1.8 6.0 120 -2 4 2 37.579 75.157 1.26307 52.2 3.5 3.3 6.0 121 3 -3 4 37.677 75.353 1.26026 70.6 4.7 4.4 6.0 122 0 -5 2 37.997 75.995 1.25121 42.2 2.8 2.6 6.0 123 -1 4 2 38.145 76.289 1.24711 81.7 5.4 5.1 6.0 124 -3 2 4 38.264 76.527 1.24383 21.6 1.4 1.3 6.0 125 -1 -2 6 38.405 76.809 1.23996 32.8 2.2 2.0 6.0 126 -4 -1 2 38.513 77.025 1.23703 28.1 1.9 1.7 6.0 127 1 -5 4 38.56 77.12 1.23575 44.6 3.0 2.8 6.0 128 -1 -1 6 38.622 77.244 1.23407 18.6 1.2 1.2 6.0 129 4 -1 2 38.848 77.696 1.22801 21.6 1.4 1.3 6.0 130 -1 5 0 39.055 78.11 1.22254 55.7 3.7 3.5 6.0 131 -4 4 0 39.091 78.183 1.22158 21.7 1.4 1.3 6.0 132 3 -5 2 39.163 78.326 1.21971 62.9 4.2 3.9 6.0 133 0 -1 6 39.209 78.418 1.2185 40.4 2.7 2.5 6.0 134 2 -1 5 39.662 79.325 1.20684 49.2 3.3 3.0 6.0 135 -2 -4 2 40.113 80.227 1.19553 25.2 1.7 1.6 6.0 136 -3 -3 2 40.454 80.908 1.18717 31.6 2.1 1.9 6.1 137 1 -3 6 40.537 81.075 1.18515 32.3 2.1 2.0 6.1 138 4 1 0 40.588 81.176 1.18392 40.2 2.7 2.5 6.1 139 3 -5 3 40.675 81.35 1.18183 33.7 2.2 2.1 6.1 140 -4 4 1 40.832 81.663 1.17809 16.0 1.1 1.0 6.1 141 -2 -2 6 41.204 82.407 1.16933 34.6 2.3 2.1 6.1 142 -2 3 4 41.802 83.603 1.15561 19.6 1.3 1.2 6.1 143 2 1 4 41.898 83.796 1.15345 20.6 1.4 1.3 6.1 144 -2 0 6 42.0 84.0 1.15116 40.0 2.7 2.4 6.1 145 -3 -3 4 42.335 84.67 1.14376 112.5 7.5 6.9 6.1 146 4 0 2 42.628 85.255 1.1374 25.2 1.7 1.5 6.1 147 4 -4 3 42.662 85.325 1.13665 26.9 1.8 1.6 6.1 148 -3 5 1 43.409 86.817 1.1209 27.8 1.8 1.7 6.1 149 -4 2 4 43.541 87.082 1.11817 44.3 2.9 2.7 6.1 150 3 1 3 43.644 87.288 1.11606 39.9 2.6 2.4 6.2 151 -3 3 4 43.698 87.397 1.11495 49.8 3.3 3.0 6.2 152 4 1 1 43.792 87.584 1.11306 22.9 1.5 1.4 6.2 153 -2 -3 6 43.907 87.814 1.11073 35.2 2.3 2.1 6.2 154 -4 4 2 44.004 88.008 1.10878 52.5 3.5 3.2 6.2 155 -5 1 0 44.156 88.312 1.10575 48.2 3.2 2.9 6.2 156 3 3 0 44.388 88.775 1.10117 89.7 6.0 5.4 6.2 157 -5 3 1 44.513 89.026 1.09872 31.9 2.1 1.9 6.2 158 2 -6 2 44.594 89.188 1.09714 26.6 1.8 1.6 6.2 159 -4 -2 1 44.644 89.287 1.09618 34.3 2.3 2.1 6.2 160 -3 -1 6 44.967 89.934 1.08996 46.8 3.1 2.8 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) |