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 *** *********************** HINGGANITE_Y 1, t-datolite, s-gadolinite, DN [Y(0.51)TR(0.36)Ca(0.13)]Fe(0.065)Be[SiO(4)](OH) Monoclinic P 2(1)/a Z = 4 P2(1)/a 13 .4 .1989 Ref.Str.: O.V. Yakubovich, E.N. Matvienko, A.V. Voloshin, M.A. Simonov (1983) * Kristallogr., 28, 457-460 Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 9.888 alpha = 90.0 b = 7.607 beta = 90.45 c = 4.74 gamma = 90.0 Unit cell volume (cub. angs.) = 356.52 Molar volume ( cub.cm/mol.) = 53.69 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.333 0.1089 0.9987 0.8 Y = 0.51, Yb = 0.23, Ca = 0.13 2 0.0791 0.2763 0.519 0.33 Si = 1.00 3 0.335 0.413 0.448 0.1 Be = 1.00 4 0.0 0.0 0.0 0.9 Fe = 0.13, Fe = 0.0 5 0.195 0.347 0.3 0.5 O = 1.00 6 0.1485 0.109 0.687 0.6 O = 1.00 7 0.0332 0.412 0.764 0.5 O = 1.00 8 0.4499 0.284 0.326 0.5 O = 1.00 9 0.3305 0.412 0.786 0.5 O = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.333 0.1089 0.9987 2 2 0.0791 0.2763 0.519 3 3 0.335 0.413 0.448 4 4 0.0 0.0 0.0 5 5 0.195 0.347 0.3 6 6 0.1485 0.109 0.687 7 7 0.0332 0.412 0.764 8 8 0.4499 0.284 0.326 9 9 0.3305 0.412 0.786 10 1 0.667 0.8911 0.0013 11 2 0.9209 0.7237 0.481 12 3 0.665 0.587 0.552 13 5 0.805 0.653 0.7 14 6 0.8515 0.891 0.313 15 7 0.9668 0.588 0.236 16 8 0.5501 0.716 0.674 17 9 0.6695 0.588 0.214 18 1 0.833 0.3911 0.9987 19 2 0.5791 0.2237 0.519 20 3 0.835 0.087 0.448 21 4 0.5 0.5 0.0 22 5 0.695 0.153 0.3 23 6 0.6485 0.391 0.687 24 7 0.5332 0.088 0.764 25 8 0.9499 0.216 0.326 26 9 0.8305 0.088 0.786 27 1 0.167 0.6089 0.0013 28 2 0.4209 0.7763 0.481 29 3 0.165 0.913 0.552 30 5 0.305 0.847 0.7 31 6 0.3515 0.609 0.313 32 7 0.4668 0.912 0.236 33 8 0.0501 0.784 0.674 34 9 0.1695 0.912 0.214 X-ray density (g/cm cub.) = 3.93 MU (1/cm) = 432.902 Mass attenuation coefficient (cm**2/g) = 110.122 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Y ,Yb ,Ca 2.88 8 2.6857 5 2.3386 6 2.3428 8 2.5165 9 2.2838 7 2.4585 5 2.2881 7 2.4341 9 2 Si 2.1 4 1.6428 5 1.6481 6 1.6213 7 1.6313 8 3 Be 2.04 4 1.6264 5 1.612 8 1.6031 9 1.6312 6 4 Fe ,Fe 2.592 6 2.2537 6 2.2537 6 2.3119 8 2.0638 9 2.3119 8 2.0638 9 5 O 3.264 9 2.6206 6 2.7743 7 3.0323 7 2.5676 8 2.7015 9 2.8331 9 2.9213 7 2.6242 8 2.5237 6 6 O 3.264 9 2.6206 5 2.5985 7 2.9594 9 2.7192 8 3.1869 9 2.5237 5 2.6574 8 2.919 9 2.7061 9 7 O 3.264 11 3.0323 5 2.7743 5 2.5985 6 2.9407 9 2.9213 5 2.693 7 2.9088 7 3.1674 8 2.6805 8 3.179 9 2.8668 8 8 O 3.264 10 2.5676 5 2.6714 9 2.9742 9 3.2191 9 2.6242 5 2.7192 6 2.6805 7 3.1674 7 2.6574 6 2.8668 7 9 O 3.264 11 2.8331 5 2.7015 5 2.9594 6 2.9407 7 2.9742 8 2.6714 8 3.2191 8 3.1869 6 3.179 7 2.919 6 2.7061 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 1 1 0 8.532 17.063 0.083 87.93 4 49.5 677.4 2 2 0 0 10.424 20.847 0.101 58.19 2 40.4 149.6 3 0 0 1 10.878 21.755 0.105 53.26 2 62.9 331.3 4 2 1 0 12.461 24.922 0.121 40.09 4 32.8 135.7 5 0 1 1 12.847 25.694 0.124 37.59 4 3.4 1.4 6 0 2 0 13.602 27.203 0.131 33.32 2 9.0 4.2 7 1 1 -1 13.856 27.712 0.134 32.03 4 58.2 342.0 8 1 1 1 13.922 27.844 0.134 31.71 4 39.6 156.8 9 1 2 0 14.594 29.188 0.141 28.68 4 66.6 399.9 10 2 0 -1 15.094 30.188 0.146 26.69 2 96.9 394.0 11 2 0 1 15.216 30.431 0.147 26.23 2 64.9 174.0 12 2 1 -1 16.602 33.204 0.16 21.73 4 104.2 742.1 13 2 1 1 16.714 33.427 0.161 21.42 4 107.0 771.9 14 3 1 0 17.203 34.407 0.165 20.11 4 55.3 193.5 15 2 2 0 17.26 34.52 0.166 19.97 4 39.5 98.0 16 0 2 1 17.549 35.098 0.169 19.26 4 79.6 383.8 17 1 2 -1 18.323 36.646 0.176 17.52 4 113.1 705.1 18 1 2 1 18.374 36.749 0.176 17.41 4 117.4 755.3 19 3 1 -1 20.468 40.937 0.195 13.71 4 110.7 528.5 20 2 2 -1 20.541 41.082 0.196 13.6 4 29.1 36.2 21 3 1 1 20.609 41.217 0.197 13.5 4 94.0 375.5 22 2 2 1 20.634 41.268 0.197 13.47 4 11.0 5.2 23 3 2 0 21.045 42.09 0.201 12.88 4 13.4 7.3 24 4 0 0 21.214 42.427 0.202 12.66 2 76.2 115.5 25 1 3 0 21.356 42.713 0.204 12.47 4 37.9 56.5 26 0 0 2 22.174 44.348 0.211 11.46 2 81.5 119.7 27 4 1 0 22.363 44.726 0.213 11.24 4 76.1 204.8 28 0 1 2 23.286 46.571 0.221 10.26 4 18.8 11.5 29 2 3 0 23.356 46.712 0.222 10.19 4 101.5 330.4 30 0 3 1 23.582 47.163 0.224 9.97 4 60.8 115.8 31 3 2 -1 23.871 47.741 0.226 9.7 4 58.2 103.4 32 1 1 -2 23.883 47.766 0.226 9.69 4 13.8 5.8 33 1 1 2 23.966 47.932 0.227 9.61 4 63.8 123.2 34 3 2 1 23.995 47.99 0.227 9.58 4 74.0 165.1 35 4 0 -1 24.003 48.006 0.227 9.58 2 92.7 129.6 36 4 0 1 24.168 48.336 0.229 9.43 2 28.5 12.1 37 1 3 -1 24.194 48.388 0.229 9.41 4 47.0 65.4 38 1 3 1 24.235 48.47 0.229 9.37 4 3.3 0.3 39 2 0 -2 24.662 49.324 0.233 9.0 2 3.8 0.2 40 2 0 2 24.824 49.647 0.235 8.87 2 71.7 71.8 41 4 1 -1 25.052 50.104 0.237 8.69 4 29.7 24.1 42 4 1 1 25.212 50.423 0.238 8.56 4 62.0 103.6 43 4 2 0 25.566 51.132 0.241 8.3 4 2.6 0.2 44 2 1 -2 25.691 51.381 0.242 8.2 4 41.0 43.4 45 2 1 2 25.848 51.695 0.244 8.09 4 42.5 46.0 46 2 3 -1 26.005 52.011 0.245 7.98 4 51.8 67.3 47 2 3 1 26.083 52.166 0.246 7.93 4 83.9 175.6 48 0 2 2 26.404 52.807 0.249 7.71 4 5.9 0.8 49 3 3 0 26.428 52.855 0.249 7.69 4 56.1 76.1 50 1 2 -2 26.95 53.899 0.253 7.36 4 103.6 248.4 51 1 2 2 27.026 54.051 0.254 7.31 4 105.4 255.8 52 5 1 0 27.862 55.724 0.261 6.82 4 40.9 35.9 53 4 2 -1 28.026 56.052 0.263 6.73 4 1.5 0.1 54 0 4 0 28.056 56.112 0.263 6.71 2 111.8 132.0 55 4 2 1 28.174 56.347 0.264 6.65 4 26.7 14.9 56 3 1 -2 28.543 57.087 0.267 6.46 4 111.0 250.3 57 1 4 0 28.617 57.234 0.268 6.42 4 46.5 43.7 58 2 2 -2 28.618 57.236 0.268 6.42 4 28.5 16.4 59 3 1 2 28.762 57.525 0.269 6.35 4 105.2 220.9 60 2 2 2 28.764 57.528 0.269 6.35 4 18.6 6.9 61 3 3 -1 28.855 57.709 0.27 6.3 4 43.0 36.6 62 3 3 1 28.963 57.927 0.271 6.25 4 41.1 33.3 63 5 1 -1 30.177 60.354 0.281 5.7 4 25.8 11.9 64 2 4 0 30.261 60.521 0.282 5.66 4 87.9 137.6 65 5 1 1 30.354 60.707 0.282 5.62 4 53.0 49.6 66 4 3 0 30.354 60.708 0.282 5.62 4 87.3 135.0 67 0 4 1 30.45 60.899 0.283 5.58 4 111.9 219.9 68 5 2 0 30.65 61.3 0.285 5.5 4 109.7 208.4 69 1 4 -1 30.966 61.932 0.288 5.38 4 25.6 11.1 70 1 4 1 31.001 62.002 0.288 5.37 4 15.8 4.2 71 0 3 2 31.105 62.21 0.289 5.33 4 3.9 0.3 72 3 2 -2 31.293 62.586 0.29 5.26 4 1.1 0.0 73 4 0 -2 31.386 62.772 0.291 5.22 2 53.3 23.3 74 3 2 2 31.5 63.001 0.292 5.18 4 21.3 7.4 75 1 3 -2 31.598 63.196 0.293 5.15 4 30.3 14.9 76 4 0 2 31.662 63.324 0.293 5.12 2 71.2 40.9 77 1 3 2 31.667 63.333 0.293 5.12 4 57.6 53.4 78 4 1 -2 32.27 64.54 0.298 4.92 4 107.8 179.6 79 2 4 -1 32.521 65.042 0.301 4.83 4 21.3 6.9 80 4 1 2 32.542 65.084 0.301 4.83 4 83.7 106.4 81 4 3 -1 32.577 65.154 0.301 4.82 4 98.7 147.7 82 2 4 1 32.589 65.178 0.301 4.81 4 33.4 16.9 83 4 3 1 32.712 65.424 0.302 4.77 4 102.2 156.9 84 5 2 -1 32.845 65.689 0.303 4.73 4 60.3 54.1 85 6 0 0 32.873 65.745 0.303 4.72 2 114.2 96.9 86 3 4 0 32.889 65.778 0.304 4.72 4 18.8 5.3 87 5 2 1 33.013 66.026 0.305 4.68 4 87.1 111.7 88 2 3 -2 33.12 66.239 0.305 4.65 4 120.7 213.2 89 2 3 2 33.254 66.508 0.307 4.61 4 106.0 162.8 90 6 1 0 33.736 67.471 0.31 4.47 4 1.9 0.1 91 0 0 3 34.481 68.962 0.316 4.27 2 95.7 61.6 92 4 2 -2 34.85 69.701 0.319 4.18 4 18.5 4.5 93 6 0 -1 34.976 69.953 0.32 4.15 2 119.8 93.7 94 5 3 0 35.002 70.003 0.321 4.14 4 29.0 10.9 95 3 4 -1 35.042 70.083 0.321 4.13 4 32.7 13.9 96 4 2 2 35.112 70.224 0.322 4.12 4 33.3 14.4 97 3 4 1 35.14 70.279 0.322 4.11 4 12.6 2.1 98 6 0 1 35.172 70.345 0.322 4.1 2 128.3 106.3 99 0 1 3 35.325 70.65 0.323 4.07 4 1.6 0.0 100 3 3 -2 35.603 71.207 0.325 4.01 4 33.0 13.7 101 1 1 -3 35.772 71.544 0.327 3.97 4 32.1 12.8 102 3 3 2 35.798 71.596 0.327 3.96 4 33.4 13.9 103 6 1 -1 35.815 71.631 0.327 3.96 4 10.1 1.3 104 1 1 3 35.869 71.738 0.328 3.95 4 17.1 3.6 105 6 1 1 36.009 72.019 0.329 3.92 4 10.4 1.3 106 6 2 0 36.265 72.531 0.331 3.86 4 66.3 53.4 107 2 0 -3 36.369 72.738 0.331 3.84 2 72.4 31.7 108 4 4 0 36.4 72.8 0.332 3.84 4 48.4 28.3 109 1 5 0 36.501 73.002 0.333 3.82 4 36.1 15.7 110 2 0 3 36.562 73.124 0.333 3.8 2 43.2 11.1 111 5 1 -2 36.761 73.522 0.335 3.77 4 32.2 12.3 112 5 3 -1 37.066 74.132 0.337 3.71 4 31.0 11.2 113 5 1 2 37.081 74.162 0.337 3.7 4 10.3 1.2 114 0 4 2 37.088 74.176 0.337 3.7 4 35.0 14.3 115 2 1 -3 37.195 74.39 0.338 3.68 4 64.0 47.5 116 5 3 1 37.226 74.451 0.338 3.68 4 35.0 14.2 117 2 1 3 37.386 74.772 0.339 3.65 4 64.4 47.6 118 1 4 -2 37.543 75.085 0.341 3.62 4 25.6 7.5 119 1 4 2 37.606 75.212 0.341 3.61 4 46.5 24.6 120 0 2 3 37.809 75.618 0.343 3.58 4 28.3 9.0 121 2 5 0 37.961 75.922 0.344 3.55 4 18.8 4.0 122 0 5 1 38.131 76.262 0.345 3.52 4 14.6 2.4 123 1 2 -3 38.245 76.489 0.346 3.5 4 86.6 82.7 124 6 2 -1 38.287 76.574 0.346 3.5 4 5.1 0.3 125 1 2 3 38.339 76.679 0.347 3.49 4 95.2 99.5 126 4 4 -1 38.451 76.902 0.348 3.47 4 54.4 32.3 127 6 2 1 38.477 76.953 0.348 3.47 4 12.0 1.6 128 4 4 1 38.577 77.154 0.349 3.45 4 42.9 19.9 129 1 5 -1 38.597 77.194 0.349 3.45 4 62.5 42.4 130 1 5 1 38.629 77.257 0.349 3.44 4 71.5 55.4 131 2 4 -2 38.958 77.915 0.351 3.4 4 49.1 25.8 132 4 3 -2 38.978 77.956 0.352 3.39 4 31.3 10.4 133 2 4 2 39.083 78.167 0.352 3.38 4 51.2 27.9 134 5 2 -2 39.211 78.422 0.353 3.36 4 72.5 55.5 135 4 3 2 39.229 78.458 0.354 3.36 4 34.5 12.6 136 5 2 2 39.525 79.049 0.356 3.32 4 60.7 38.5 137 3 1 -3 39.557 79.113 0.356 3.31 4 79.4 65.7 138 2 2 -3 39.636 79.273 0.357 3.3 4 9.0 0.8 139 2 2 3 39.824 79.648 0.358 3.28 4 3.9 0.2 140 3 1 3 39.838 79.676 0.358 3.28 4 88.7 81.1 141 2 5 -1 40.016 80.033 0.359 3.25 4 2.7 0.1 142 2 5 1 40.079 80.158 0.36 3.24 4 20.9 4.5 143 7 1 0 40.095 80.19 0.36 3.24 4 7.3 0.6 144 6 3 0 40.341 80.681 0.362 3.21 4 11.4 1.3 145 3 5 0 40.356 80.712 0.362 3.21 4 38.6 15.1 146 5 4 0 40.733 81.466 0.365 3.17 4 11.9 1.4 147 6 0 -2 41.198 82.395 0.368 3.12 2 42.2 8.7 148 3 4 -2 41.306 82.612 0.369 3.11 4 5.9 0.3 149 3 4 2 41.492 82.983 0.37 3.09 4 33.5 10.9 150 6 0 2 41.569 83.139 0.371 3.08 2 47.7 11.0 151 0 3 3 41.839 83.678 0.373 3.05 4 36.6 12.9 152 3 2 -3 41.96 83.92 0.374 3.04 4 47.3 21.4 153 6 1 -2 41.995 83.991 0.374 3.04 4 9.5 0.9 154 4 0 -3 42.028 84.056 0.374 3.04 2 13.0 0.8 155 7 1 -1 42.047 84.093 0.374 3.03 4 31.7 9.6 156 3 2 3 42.238 84.476 0.376 3.02 4 19.6 3.7 157 7 1 1 42.263 84.526 0.376 3.01 4 48.5 22.4 158 1 3 -3 42.264 84.528 0.376 3.01 4 2.7 0.1 159 6 3 -1 42.305 84.611 0.376 3.01 4 21.2 4.3 160 1 3 3 42.356 84.713 0.377 3.01 4 14.4 2.0 161 6 1 2 42.366 84.732 0.377 3.01 4 6.8 0.4 162 3 5 -1 42.367 84.734 0.377 3.01 4 94.8 85.0 163 4 0 3 42.398 84.797 0.377 3.0 2 45.7 9.9 164 3 5 1 42.459 84.919 0.377 3.0 4 80.9 61.7 165 6 3 1 42.49 84.981 0.378 3.0 4 19.4 3.5 166 7 2 0 42.492 84.985 0.378 2.99 4 42.7 17.2 167 5 4 -1 42.71 85.42 0.379 2.98 4 54.4 27.7 168 4 1 -3 42.823 85.647 0.38 2.97 4 6.3 0.4 169 5 4 1 42.864 85.728 0.38 2.96 4 35.6 11.8 170 4 1 3 43.193 86.386 0.383 2.94 4 3.7 0.1 171 5 3 -2 43.21 86.42 0.383 2.94 4 4.8 0.2 172 5 3 2 43.518 87.036 0.385 2.92 4 2.9 0.1 173 2 3 -3 43.628 87.256 0.386 2.91 4 32.1 9.4 174 4 5 0 43.658 87.316 0.386 2.91 4 13.7 1.7 175 2 3 3 43.813 87.625 0.387 2.9 4 12.3 1.4 176 0 5 2 44.318 88.636 0.391 2.87 4 0.7 0.0 177 6 2 -2 44.377 88.755 0.391 2.86 4 31.0 8.7 178 7 2 -1 44.428 88.857 0.391 2.86 4 81.7 60.1 179 4 4 -2 44.567 89.135 0.392 2.85 4 46.1 19.1 180 7 2 1 44.643 89.287 0.393 2.85 4 65.5 38.4 181 6 2 2 44.746 89.492 0.394 2.84 4 48.3 20.9 182 1 5 -2 44.756 89.512 0.394 2.84 4 6.1 0.3 183 4 4 2 44.813 89.627 0.394 2.84 4 14.0 1.7 184 1 5 2 44.818 89.635 0.394 2.84 4 29.1 7.5 185 0 6 0 44.87 89.74 0.394 2.83 2 87.8 34.4 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 1 1 0 8.532 17.063 6.02917 677.4 87.8 88.9 5.6 2 2 0 0 10.424 20.847 4.94385 149.6 19.4 19.6 5.6 3 0 0 1 10.878 21.755 4.73985 331.3 42.9 43.3 5.6 4 2 1 0 12.461 24.922 4.14531 135.7 17.6 17.7 5.6 5 1 1 -1 13.856 27.712 3.73494 342.0 44.3 44.5 5.6 6 1 1 1 13.922 27.844 3.7176 156.8 20.3 20.4 5.6 7 1 2 0 14.594 29.188 3.54991 399.9 51.8 52.0 5.6 8 2 0 -1 15.094 30.188 3.43493 394.0 51.0 51.2 5.6 9 2 0 1 15.216 30.431 3.40808 174.0 22.5 22.6 5.6 10 2 1 -1 16.602 33.204 3.13057 742.1 96.1 96.2 5.6 11 2 1 1 16.714 33.427 3.1102 771.9 100.0 100.0 5.7 12 3 1 0 17.203 34.407 3.02424 193.5 25.1 25.0 5.7 13 2 2 0 17.26 34.52 3.01459 98.0 12.7 12.7 5.7 14 0 2 1 17.549 35.098 2.96648 383.8 49.7 49.6 5.7 15 1 2 -1 18.323 36.646 2.84522 705.1 91.3 91.1 5.7 16 1 2 1 18.374 36.749 2.83753 755.3 97.8 97.6 5.7 17 3 1 -1 20.468 40.937 2.55786 528.5 68.5 68.0 5.7 18 2 2 -1 20.541 41.082 2.54923 36.2 4.7 4.7 5.7 19 3 1 1 20.609 41.217 2.5412 380.6 49.3 48.9 5.7 20 4 0 0 21.214 42.427 2.47192 115.5 15.0 14.8 5.7 21 1 3 0 21.356 42.713 2.45619 56.5 7.3 7.2 5.7 22 0 0 2 22.174 44.348 2.36993 119.7 15.5 15.3 5.7 23 4 1 0 22.363 44.726 2.35092 204.8 26.5 26.2 5.7 24 0 1 2 23.286 46.571 2.26266 11.5 1.5 1.5 5.7 25 2 3 0 23.356 46.712 2.25621 330.4 42.8 42.2 5.7 26 0 3 1 23.582 47.163 2.23583 115.8 15.0 14.8 5.7 27 3 2 -1 23.871 47.741 2.21032 109.2 14.1 13.9 5.7 28 1 1 2 23.966 47.932 2.20206 123.2 16.0 15.7 5.7 29 3 2 1 23.995 47.99 2.19954 294.7 38.2 37.6 5.7 30 1 3 -1 24.194 48.388 2.18252 77.5 10.0 9.9 5.7 31 2 0 2 24.824 49.647 2.13056 71.8 9.3 9.2 5.7 32 4 1 -1 25.052 50.104 2.11238 24.1 3.1 3.1 5.7 33 4 1 1 25.212 50.423 2.09986 103.6 13.4 13.2 5.8 34 2 1 -2 25.691 51.381 2.06328 43.4 5.6 5.5 5.8 35 2 1 2 25.848 51.695 2.05161 46.0 6.0 5.8 5.8 36 2 3 -1 26.005 52.011 2.04003 67.3 8.7 8.6 5.8 37 2 3 1 26.083 52.166 2.03436 175.6 22.7 22.3 5.8 38 3 3 0 26.428 52.855 2.00972 76.1 9.9 9.7 5.8 39 1 2 -2 26.95 53.899 1.97362 248.4 32.2 31.5 5.8 40 1 2 2 27.026 54.051 1.96849 255.8 33.1 32.4 5.8 41 5 1 0 27.862 55.724 1.91392 35.9 4.6 4.5 5.8 42 0 4 0 28.056 56.112 1.90175 132.0 17.1 16.7 5.8 43 4 2 1 28.174 56.347 1.89446 14.9 1.9 1.9 5.8 44 3 1 -2 28.543 57.087 1.87195 250.3 32.4 31.6 5.8 45 1 4 0 28.617 57.234 1.86752 60.2 7.8 7.6 5.8 46 3 1 2 28.762 57.525 1.8589 227.8 29.5 28.7 5.8 47 3 3 -1 28.855 57.709 1.85347 36.6 4.7 4.6 5.8 48 3 3 1 28.963 57.927 1.8471 33.3 4.3 4.2 5.8 49 5 1 -1 30.177 60.354 1.7794 11.9 1.5 1.5 5.8 50 2 4 0 30.261 60.521 1.77496 137.6 17.8 17.3 5.8 51 4 3 0 30.354 60.708 1.77002 184.6 23.9 23.2 5.8 52 0 4 1 30.45 60.899 1.76498 219.9 28.5 27.6 5.8 53 5 2 0 30.65 61.3 1.75456 208.4 27.0 26.1 5.8 54 1 4 -1 30.966 61.932 1.7384 11.1 1.4 1.4 5.8 55 4 0 -2 31.386 62.772 1.71746 23.3 3.0 2.9 5.9 56 1 3 -2 31.598 63.196 1.70714 14.9 1.9 1.9 5.9 57 1 3 2 31.667 63.333 1.70381 94.3 12.2 11.8 5.9 58 4 1 -2 32.27 64.54 1.6753 179.6 23.3 22.4 5.9 59 4 1 2 32.542 65.084 1.66283 113.4 14.7 14.1 5.9 60 4 3 -1 32.577 65.154 1.66124 164.5 21.3 20.5 5.9 61 4 3 1 32.712 65.424 1.65513 156.9 20.3 19.6 5.9 62 6 0 0 32.873 65.745 1.64795 156.3 20.2 19.5 5.9 63 5 2 1 33.013 66.026 1.64172 111.7 14.5 13.9 5.9 64 2 3 -2 33.12 66.239 1.63704 213.2 27.6 26.5 5.9 65 2 3 2 33.254 66.508 1.63119 162.8 21.1 20.3 5.9 66 0 0 3 34.481 68.962 1.57995 61.6 8.0 7.6 5.9 67 6 0 -1 34.976 69.953 1.56036 104.7 13.6 12.9 5.9 68 3 4 -1 35.042 70.083 1.55783 13.9 1.8 1.7 5.9 69 4 2 2 35.112 70.224 1.5551 16.4 2.1 2.0 5.9 70 6 0 1 35.172 70.345 1.55278 106.3 13.8 13.1 5.9 71 3 3 -2 35.603 71.207 1.53642 13.7 1.8 1.7 5.9 72 3 3 2 35.798 71.596 1.52918 28.0 3.6 3.5 5.9 73 6 2 0 36.265 72.531 1.51212 53.4 6.9 6.6 5.9 74 2 0 -3 36.369 72.738 1.50841 31.7 4.1 3.9 6.0 75 4 4 0 36.4 72.8 1.50729 28.3 3.7 3.5 6.0 76 1 5 0 36.501 73.002 1.5037 15.7 2.0 1.9 6.0 77 2 0 3 36.562 73.124 1.50155 11.1 1.4 1.4 6.0 78 5 1 -2 36.761 73.522 1.49456 12.3 1.6 1.5 6.0 79 0 4 2 37.088 74.176 1.48324 26.7 3.5 3.3 6.0 80 2 1 -3 37.195 74.39 1.4796 47.5 6.2 5.8 6.0 81 5 3 1 37.226 74.451 1.47856 14.2 1.8 1.7 6.0 82 2 1 3 37.386 74.772 1.47313 47.6 6.2 5.8 6.0 83 1 4 2 37.606 75.212 1.46577 24.6 3.2 3.0 6.0 84 0 2 3 37.809 75.618 1.45907 9.0 1.2 1.1 6.0 85 1 2 -3 38.245 76.489 1.44496 82.7 10.7 10.1 6.0 86 1 2 3 38.339 76.679 1.44193 99.5 12.9 12.1 6.0 87 4 4 -1 38.451 76.902 1.4384 33.9 4.4 4.1 6.0 88 1 5 -1 38.597 77.194 1.4338 62.3 8.1 7.6 6.0 89 1 5 1 38.629 77.257 1.43281 55.4 7.2 6.8 6.0 90 2 4 -2 38.958 77.915 1.42261 36.2 4.7 4.4 6.0 91 2 4 2 39.083 78.167 1.41876 27.9 3.6 3.4 6.0 92 5 2 -2 39.211 78.422 1.41488 68.1 8.8 8.3 6.0 93 5 2 2 39.525 79.049 1.40548 38.5 5.0 4.7 6.0 94 3 1 -3 39.557 79.113 1.40452 65.7 8.5 8.0 6.0 95 3 1 3 39.838 79.676 1.39624 81.1 10.5 9.8 6.0 96 3 5 0 40.356 80.712 1.38133 16.4 2.1 2.0 6.1 97 6 0 -2 41.198 82.395 1.358 8.7 1.1 1.1 6.1 98 3 4 2 41.492 82.983 1.35011 10.9 1.4 1.3 6.1 99 6 0 2 41.569 83.139 1.34804 11.0 1.4 1.3 6.1 100 0 3 3 41.839 83.678 1.34095 12.9 1.7 1.5 6.1 101 3 2 -3 41.96 83.92 1.33778 21.4 2.8 2.6 6.1 102 7 1 -1 42.047 84.093 1.33554 9.6 1.2 1.2 6.1 103 7 1 1 42.263 84.526 1.32999 26.1 3.4 3.1 6.1 104 3 5 -1 42.367 84.734 1.32734 87.4 11.3 10.5 6.1 105 4 0 3 42.398 84.797 1.32654 9.9 1.3 1.2 6.1 106 3 5 1 42.459 84.919 1.32499 61.7 8.0 7.4 6.1 107 7 2 0 42.492 84.985 1.32416 20.7 2.7 2.5 6.1 108 5 4 -1 42.71 85.42 1.31871 27.7 3.6 3.3 6.1 109 5 4 1 42.864 85.728 1.31488 11.8 1.5 1.4 6.1 110 2 3 -3 43.628 87.256 1.29637 11.2 1.4 1.3 6.2 111 6 2 -2 44.377 88.755 1.27893 8.7 1.1 1.0 6.2 112 7 2 -1 44.428 88.857 1.27777 60.1 7.8 7.1 6.2 113 4 4 -2 44.567 89.135 1.27462 19.1 2.5 2.3 6.2 114 7 2 1 44.643 89.287 1.2729 38.4 5.0 4.5 6.2 115 6 2 2 44.746 89.492 1.2706 21.2 2.7 2.5 6.2 116 1 5 2 44.818 89.635 1.26901 9.3 1.2 1.1 6.2 117 0 6 0 44.87 89.74 1.26783 34.4 4.5 4.1 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) |