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 *** *********************** DIOPSIDE 41, td-diopside, Di(80)En(20), at 25'C, f-pyroxenes, s-diopside, DF Ca(0.8)Mg(1.2)Si(2)O(6) Monoclinic C 2/c Z = 4 R =0.041 NR =873 12 .1 .1993 Ref.Str.: Benna P., Tribaudino M., Zanini G.,Bruno E. (1990) * Z. Kristallogr., 192, 183-199 Reserv: In original - clinopyroxene analogue. Dokina T.N. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 9.727 alpha = 90.0 b = 8.912 beta = 106.36 c = 5.245 gamma = 90.0 Unit cell volume (cub. angs.) = 436.26 Molar volume ( cub.cm/mol.) = 65.69 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.0 0.9071 0.25 0.01 Mg = 1.00 2 0.0 0.3012 0.25 0.01 Ca = 0.8 , Ca = 0.0 3 0.0 0.2602 0.25 0.01 Mg = 0.2 , Mg = 0.0 4 0.2882 0.0929 0.2342 0.01 Si = 1.00 5 0.1164 0.0881 0.1432 0.01 O = 1.00 6 0.3637 0.2493 0.3263 0.01 O = 1.00 7 0.3513 0.0194 0.9983 0.01 O = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.0 0.9071 0.25 2 2 0.0 0.3012 0.25 3 3 0.0 0.2602 0.25 4 4 0.2882 0.0929 0.2342 5 5 0.1164 0.0881 0.1432 6 6 0.3637 0.2493 0.3263 7 7 0.3513 0.0194 0.9983 8 1 0.0 0.0929 0.75 9 2 0.0 0.6988 0.75 10 3 0.0 0.7398 0.75 11 4 0.7118 0.9071 0.7658 12 5 0.8836 0.9119 0.8568 13 6 0.6363 0.7507 0.6737 14 7 0.6487 0.9806 0.0017 15 4 0.2882 0.9071 0.7342 16 5 0.1164 0.9119 0.6432 17 6 0.3637 0.7507 0.8263 18 7 0.3513 0.9806 0.4983 19 4 0.7118 0.0929 0.2658 20 5 0.8836 0.0881 0.3568 21 6 0.6363 0.2493 0.1737 22 7 0.6487 0.0194 0.5017 23 1 0.5 0.5929 0.75 24 2 0.5 0.1988 0.75 25 3 0.5 0.2398 0.75 26 4 0.7882 0.4071 0.7342 27 5 0.6164 0.4119 0.6432 28 6 0.8637 0.2507 0.8263 29 7 0.8513 0.4806 0.4983 30 1 0.5 0.4071 0.25 31 2 0.5 0.8012 0.25 32 3 0.5 0.7602 0.25 33 4 0.2118 0.5929 0.2658 34 5 0.3836 0.5881 0.3568 35 6 0.1363 0.7493 0.1737 36 7 0.1487 0.5194 0.5017 37 4 0.7882 0.5929 0.2342 38 5 0.6164 0.5881 0.1432 39 6 0.8637 0.7493 0.3263 40 7 0.8513 0.5194 0.9983 41 4 0.2118 0.4071 0.7658 42 5 0.3836 0.4119 0.8568 43 6 0.1363 0.2507 0.6737 44 7 0.1487 0.4806 0.0017 X-ray density (g/cm cub.) = 3.25 MU (1/cm) = 164.806 Mass attenuation coefficient (cm**2/g) = 50.742 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Mg 2.52 6 2.1342 5 2.0546 5 2.0546 5 2.1342 5 2.048 6 2.048 6 2 Ca ,Ca 2.88 8 2.3579 5 2.3579 5 2.2889 6 2.7213 7 2.5575 7 2.5575 7 2.2889 6 2.7213 7 3 Mg ,Mg 2.52 4 2.0749 5 2.0749 5 2.2458 6 2.2458 6 4 Si 2.1 4 1.604 5 1.5861 6 1.6627 7 1.6787 7 5 O 3.264 11 2.7333 6 2.6742 7 2.8167 5 3.0567 5 3.0567 5 2.6852 7 2.795 5 2.9331 6 3.0269 6 3.0945 6 2.9103 6 6 O 3.264 10 2.7333 5 2.6562 7 2.5737 7 2.9778 6 2.9331 5 3.0269 5 3.0945 5 2.9103 5 3.2378 6 3.0847 7 7 O 3.264 8 2.6742 5 2.6562 6 2.9085 7 2.6852 5 2.5737 6 2.6452 7 2.6452 7 3.0847 6 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 1 1 0 6.864 13.727 0.078 137.08 4 0.3 0.0 2 2 0 0 9.501 19.002 0.107 70.48 2 1.0 0.1 3 0 2 0 9.954 19.909 0.112 64.01 2 25.4 43.4 4 1 1 -1 10.073 20.146 0.114 62.46 4 6.4 5.4 5 1 1 1 12.223 24.446 0.137 41.74 4 12.6 14.0 6 0 2 1 13.349 26.698 0.15 34.67 4 50.1 182.9 7 2 2 0 13.828 27.657 0.155 32.17 4 68.6 318.5 8 2 2 -1 14.924 29.847 0.167 27.34 4 143.3 1179.5 9 3 1 0 15.203 30.407 0.17 26.28 4 83.3 383.1 10 3 1 -1 15.437 30.874 0.173 25.43 4 89.6 429.0 11 1 3 0 15.79 31.58 0.177 24.22 4 8.9 4.0 12 1 3 -1 17.493 34.986 0.195 19.39 4 90.3 332.4 13 2 0 -2 17.705 35.41 0.197 18.89 2 43.5 37.5 14 0 0 2 17.825 35.65 0.199 18.61 2 158.9 494.1 15 1 1 -2 17.83 35.66 0.199 18.6 4 4.8 0.9 16 2 2 1 17.931 35.862 0.2 18.37 4 111.5 480.0 17 1 3 1 18.869 37.737 0.21 16.42 4 19.0 12.5 18 4 0 0 19.276 38.553 0.214 15.67 2 11.8 2.3 19 3 1 1 19.692 39.385 0.219 14.94 4 79.5 198.4 20 0 4 0 20.226 40.452 0.224 14.08 2 3.1 0.1 21 3 1 -2 20.249 40.497 0.225 14.04 4 7.5 1.7 22 1 1 2 20.463 40.926 0.227 13.72 4 64.2 118.9 23 2 2 -2 20.476 40.952 0.227 13.7 4 21.5 13.4 24 0 2 2 20.582 41.164 0.228 13.54 4 60.0 102.4 25 3 3 0 21.009 42.019 0.233 12.93 4 60.5 99.4 26 3 3 -1 21.187 42.373 0.235 12.69 4 95.9 245.2 27 4 2 -1 21.458 42.917 0.237 12.34 4 62.7 101.9 28 4 2 0 21.879 43.758 0.242 11.81 4 22.8 12.9 29 0 4 1 22.216 44.431 0.245 11.41 4 95.7 219.6 30 4 0 -2 22.444 44.889 0.248 11.15 2 115.4 155.9 31 2 4 0 22.526 45.053 0.249 11.06 4 22.2 11.5 32 2 0 2 22.74 45.479 0.251 10.82 2 91.1 94.3 33 1 3 -2 23.067 46.135 0.254 10.48 4 59.1 76.9 34 2 4 -1 23.261 46.523 0.256 10.28 4 23.9 12.3 35 5 1 -1 24.013 48.026 0.264 9.57 4 14.5 4.2 36 3 3 1 24.602 49.203 0.27 9.06 4 32.8 20.4 37 4 2 -2 24.778 49.555 0.272 8.91 4 18.8 6.6 38 5 1 0 24.936 49.873 0.274 8.78 4 66.6 81.9 39 2 2 2 25.052 50.103 0.275 8.69 4 52.2 49.7 40 3 3 -2 25.07 50.14 0.275 8.67 4 9.9 1.8 41 1 3 2 25.252 50.503 0.277 8.53 4 46.4 38.6 42 2 4 1 25.433 50.866 0.279 8.4 4 25.4 11.4 43 4 2 1 25.897 51.794 0.284 8.06 4 27.2 12.5 44 1 5 0 26.102 52.204 0.286 7.91 4 97.6 158.3 45 5 1 -2 26.587 53.173 0.291 7.59 4 37.5 22.5 46 1 1 -3 26.834 53.668 0.293 7.43 4 16.3 4.1 47 3 1 2 26.934 53.868 0.294 7.37 4 28.5 12.6 48 1 5 -1 27.267 54.533 0.297 7.16 4 28.4 12.2 49 2 4 -2 27.416 54.832 0.299 7.08 4 29.5 12.9 50 0 4 2 27.501 55.003 0.3 7.03 4 65.2 62.7 51 3 1 -3 27.664 55.329 0.301 6.93 4 72.1 75.8 52 4 4 -1 28.212 56.423 0.307 6.63 4 8.9 1.1 53 1 5 1 28.256 56.512 0.307 6.61 4 7.7 0.8 54 2 2 -3 28.335 56.67 0.308 6.57 4 130.3 234.4 55 5 3 -1 28.342 56.683 0.308 6.56 4 119.8 197.9 56 4 4 0 28.557 57.113 0.31 6.45 4 66.3 59.6 57 5 1 1 29.116 58.233 0.316 6.17 4 2.8 0.1 58 5 3 0 29.167 58.334 0.316 6.15 4 41.2 21.9 59 0 2 3 29.382 58.764 0.318 6.05 4 3.8 0.2 60 6 0 0 29.682 59.364 0.321 5.91 2 90.8 51.2 61 1 1 3 29.766 59.532 0.322 5.88 4 2.7 0.1 62 3 5 0 29.872 59.744 0.323 5.83 4 68.7 57.8 63 3 5 -1 30.009 60.019 0.325 5.77 4 22.0 5.9 64 6 0 -2 30.233 60.465 0.327 5.67 2 108.6 70.3 65 6 2 -1 30.384 60.768 0.328 5.61 4 46.5 25.6 66 4 0 2 30.632 61.265 0.331 5.51 2 119.0 82.0 67 5 3 -2 30.662 61.323 0.331 5.5 4 35.1 14.2 68 1 3 -3 30.888 61.775 0.333 5.41 4 126.1 180.9 69 4 2 -3 30.938 61.876 0.334 5.39 4 20.7 4.9 70 3 3 2 30.979 61.958 0.334 5.38 4 8.2 0.8 71 4 4 -2 31.001 62.003 0.334 5.37 4 2.1 0.0 72 0 6 0 31.238 62.476 0.337 5.28 2 116.5 75.3 73 2 4 2 31.238 62.476 0.337 5.28 4 50.9 28.8 74 1 5 -2 31.503 63.005 0.339 5.18 4 10.8 1.3 75 6 2 0 31.634 63.268 0.34 5.13 4 20.5 4.6 76 3 3 -3 31.649 63.299 0.341 5.13 4 29.1 9.2 77 4 4 1 31.974 63.947 0.344 5.02 4 38.9 16.0 78 5 1 -3 32.066 64.132 0.345 4.98 4 26.9 7.6 79 6 2 -2 32.165 64.33 0.346 4.95 4 59.7 37.1 80 4 2 2 32.551 65.102 0.349 4.82 4 39.8 16.1 81 0 6 1 32.732 65.463 0.351 4.77 4 50.9 25.9 82 3 5 1 32.762 65.523 0.351 4.76 4 25.6 6.6 83 2 6 0 32.972 65.944 0.353 4.69 4 28.6 8.1 84 5 3 1 32.993 65.987 0.353 4.69 4 167.8 277.4 85 3 5 -2 33.153 66.306 0.355 4.64 4 109.4 116.6 86 1 5 2 33.305 66.611 0.356 4.59 4 69.4 46.6 87 2 6 -1 33.546 67.092 0.359 4.52 4 13.7 1.8 88 1 3 3 33.599 67.199 0.359 4.51 4 25.8 6.3 89 2 2 3 33.874 67.748 0.362 4.43 4 75.9 53.6 90 7 1 -1 34.133 68.265 0.364 4.36 4 41.7 15.9 91 2 4 -3 34.137 68.274 0.364 4.36 4 49.8 22.8 92 0 4 3 35.084 70.168 0.373 4.12 4 48.3 20.2 93 2 6 1 35.295 70.59 0.375 4.08 4 23.6 4.8 94 7 1 -2 35.384 70.769 0.376 4.05 4 107.3 98.2 95 6 2 1 35.742 71.484 0.379 3.97 4 73.4 45.1 96 7 1 0 35.743 71.486 0.379 3.97 4 45.8 17.5 97 5 3 -3 35.766 71.532 0.379 3.97 4 76.5 48.8 98 5 1 2 35.827 71.654 0.38 3.96 4 47.1 18.5 99 3 1 3 35.889 71.779 0.381 3.94 4 37.5 11.6 100 5 5 -1 35.964 71.928 0.381 3.93 4 5.2 0.2 101 2 0 -4 35.979 71.958 0.381 3.92 2 17.3 1.2 102 6 4 -1 35.999 71.997 0.382 3.92 4 11.7 1.1 103 4 4 -3 36.508 73.017 0.386 3.81 4 38.4 11.8 104 5 5 0 36.694 73.387 0.388 3.78 4 16.8 2.3 105 6 2 -3 36.741 73.482 0.388 3.77 4 8.4 0.6 106 3 1 -4 36.763 73.525 0.388 3.77 4 83.2 54.8 107 1 1 -4 36.908 73.816 0.39 3.74 4 55.2 23.9 108 2 6 -2 36.955 73.91 0.39 3.73 4 77.2 46.7 109 0 6 2 37.027 74.055 0.391 3.71 4 111.6 97.2 110 6 4 0 37.152 74.305 0.392 3.69 4 34.0 9.0 111 4 0 -4 37.462 74.924 0.395 3.64 2 88.9 30.2 112 1 7 0 37.635 75.27 0.396 3.61 4 2.1 0.0 113 4 6 -1 37.636 75.272 0.396 3.61 4 39.1 11.6 114 6 4 -2 37.646 75.292 0.396 3.6 4 11.6 1.0 115 7 3 -1 37.738 75.476 0.397 3.59 4 52.7 20.9 116 0 0 4 37.751 75.502 0.397 3.59 2 112.3 47.5 117 2 2 -4 37.763 75.525 0.398 3.58 4 26.1 5.1 118 4 6 0 37.934 75.868 0.399 3.55 4 17.3 2.2 119 4 4 2 38.006 76.013 0.4 3.54 4 34.8 9.0 120 5 5 -2 38.033 76.065 0.4 3.54 4 9.1 0.6 121 1 5 -3 38.237 76.475 0.402 3.51 4 10.1 0.7 122 3 5 2 38.32 76.64 0.402 3.49 4 120.9 107.2 123 1 7 -1 38.597 77.194 0.405 3.45 4 40.3 11.8 124 3 5 -3 38.93 77.861 0.408 3.4 4 25.3 4.6 125 7 3 -2 38.943 77.886 0.408 3.4 4 32.3 7.4 126 4 2 -4 39.222 78.443 0.41 3.36 4 40.8 11.8 127 2 4 3 39.25 78.499 0.411 3.35 4 1.9 0.0 128 7 3 0 39.29 78.579 0.411 3.35 4 10.0 0.7 129 5 3 2 39.371 78.742 0.412 3.34 4 31.9 7.2 130 7 1 -3 39.385 78.77 0.412 3.34 4 50.0 17.5 131 1 7 1 39.431 78.861 0.412 3.33 4 62.7 27.5 132 3 3 3 39.431 78.863 0.412 3.33 4 7.1 0.4 133 0 2 4 39.506 79.013 0.413 3.32 4 22.3 3.5 134 5 1 -4 39.83 79.66 0.416 3.28 4 16.7 1.9 135 7 1 1 40.075 80.151 0.418 3.25 4 33.9 7.8 136 4 6 -2 40.088 80.177 0.418 3.24 4 6.5 0.3 137 8 0 -2 40.151 80.303 0.419 3.24 2 36.5 4.5 138 5 5 1 40.167 80.335 0.419 3.23 4 16.8 1.9 139 1 1 4 40.255 80.511 0.419 3.22 4 2.4 0.0 140 3 3 -4 40.278 80.557 0.42 3.22 4 32.4 7.1 141 2 6 2 40.301 80.602 0.42 3.22 4 1.7 0.0 142 1 3 -4 40.42 80.84 0.421 3.2 4 16.4 1.8 143 6 0 2 40.647 81.293 0.423 3.18 2 11.3 0.4 144 1 5 3 40.731 81.461 0.424 3.17 4 28.7 5.5 145 3 7 0 40.823 81.646 0.424 3.16 4 13.0 1.1 146 3 7 -1 40.943 81.887 0.425 3.14 4 13.4 1.2 147 4 6 1 40.965 81.93 0.426 3.14 4 24.7 4.0 148 6 4 1 41.026 82.052 0.426 3.14 4 4.8 0.2 149 8 2 -1 41.11 82.22 0.427 3.13 4 39.3 10.1 150 4 2 3 41.271 82.542 0.428 3.11 4 9.6 0.6 151 8 0 0 41.319 82.638 0.429 3.1 2 87.8 25.1 152 8 2 -2 41.88 83.761 0.433 3.05 4 34.7 7.7 153 6 4 -3 41.986 83.971 0.434 3.04 4 44.2 12.5 154 6 0 -4 42.087 84.174 0.435 3.03 2 122.1 47.5 155 1 7 -2 42.265 84.53 0.437 3.01 4 42.5 11.4 156 6 2 2 42.372 84.744 0.437 3.01 4 42.4 11.4 157 2 0 4 42.648 85.296 0.44 2.98 2 23.7 1.8 158 5 5 -3 42.771 85.543 0.441 2.97 4 38.8 9.4 159 7 3 -3 42.843 85.687 0.441 2.97 4 31.3 6.1 160 2 6 -3 42.954 85.908 0.442 2.96 4 18.4 2.1 161 2 4 -4 42.974 85.948 0.442 2.96 4 4.6 0.1 162 8 2 0 43.04 86.08 0.443 2.95 4 28.7 5.1 163 5 3 -4 43.281 86.563 0.445 2.93 4 31.4 6.1 164 3 7 1 43.402 86.805 0.446 2.92 4 0.8 0.0 165 7 3 1 43.523 87.046 0.447 2.92 4 22.7 3.2 166 1 3 4 43.701 87.402 0.448 2.9 4 9.2 0.5 167 0 8 0 43.745 87.491 0.449 2.9 2 3.1 0.0 168 3 7 -2 43.76 87.52 0.449 2.9 4 13.6 1.1 169 6 2 -4 43.804 87.608 0.449 2.9 4 6.5 0.3 170 0 6 3 43.841 87.682 0.45 2.89 4 38.0 8.8 171 1 7 2 43.9 87.8 0.45 2.89 4 8.6 0.5 172 2 2 4 44.363 88.726 0.454 2.86 4 65.3 25.6 173 4 4 -4 44.397 88.794 0.454 2.86 4 24.6 3.6 174 7 5 -1 44.664 89.328 0.456 2.85 4 6.7 0.3 175 0 4 4 44.676 89.353 0.456 2.85 4 15.6 1.5 176 6 6 -1 44.707 89.413 0.457 2.84 4 30.4 5.5 177 5 1 3 44.733 89.466 0.457 2.84 4 17.9 1.9 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 2 0 9.954 19.909 4.456 43.4 3.7 3.7 5.6 2 1 1 1 12.223 24.446 3.63824 14.0 1.2 1.2 5.6 3 0 2 1 13.349 26.698 3.33619 182.9 15.5 15.5 5.6 4 2 2 0 13.828 27.657 3.22274 318.5 27.0 27.1 5.6 5 2 2 -1 14.924 29.847 2.99103 1179.5 100.0 100.0 5.6 6 3 1 0 15.203 30.407 2.93723 383.1 32.5 32.5 5.6 7 3 1 -1 15.437 30.874 2.89384 429.0 36.4 36.3 5.6 8 1 3 -1 17.493 34.986 2.56254 332.4 28.2 28.1 5.7 9 2 0 -2 17.705 35.41 2.53284 37.5 3.2 3.2 5.7 10 0 0 2 17.825 35.65 2.51632 495.0 42.0 41.8 5.7 11 2 2 1 17.931 35.862 2.50193 480.0 40.7 40.5 5.7 12 1 3 1 18.869 37.737 2.38181 12.5 1.1 1.1 5.7 13 3 1 1 19.692 39.385 2.2859 198.4 16.8 16.7 5.7 14 1 1 2 20.463 40.926 2.20332 132.2 11.2 11.1 5.7 15 0 2 2 20.582 41.164 2.19109 102.4 8.7 8.6 5.7 16 3 3 0 21.009 42.019 2.14849 99.4 8.4 8.3 5.7 17 3 3 -1 21.187 42.373 2.13134 245.2 20.8 20.5 5.7 18 4 2 -1 21.458 42.917 2.10561 101.9 8.6 8.5 5.7 19 4 2 0 21.879 43.758 2.06706 12.9 1.1 1.1 5.7 20 0 4 1 22.216 44.431 2.03728 219.6 18.6 18.4 5.7 21 4 0 -2 22.444 44.889 2.01758 155.9 13.2 13.0 5.7 22 2 0 2 22.74 45.479 1.99274 94.3 8.0 7.9 5.7 23 1 3 -2 23.067 46.135 1.96593 76.9 6.5 6.4 5.7 24 2 4 -1 23.261 46.523 1.95044 12.3 1.0 1.0 5.7 25 3 3 1 24.602 49.203 1.85027 20.4 1.7 1.7 5.7 26 5 1 0 24.936 49.873 1.82699 81.9 6.9 6.8 5.7 27 2 2 2 25.052 50.103 1.81912 51.5 4.4 4.3 5.7 28 1 3 2 25.252 50.503 1.80565 38.6 3.3 3.2 5.8 29 4 2 1 25.897 51.794 1.76364 12.5 1.1 1.0 5.8 30 1 5 0 26.102 52.204 1.75076 158.3 13.4 13.1 5.8 31 5 1 -2 26.587 53.173 1.7211 22.5 1.9 1.9 5.8 32 3 1 2 26.934 53.868 1.70053 12.6 1.1 1.0 5.8 33 1 5 -1 27.267 54.533 1.68136 12.2 1.0 1.0 5.8 34 2 4 -2 27.416 54.832 1.67289 12.9 1.1 1.1 5.8 35 0 4 2 27.501 55.003 1.6681 62.7 5.3 5.2 5.8 36 3 1 -3 27.664 55.329 1.65905 75.8 6.4 6.3 5.8 37 2 2 -3 28.335 56.67 1.62292 432.3 36.7 35.6 5.8 38 4 4 0 28.557 57.113 1.61137 59.6 5.0 4.9 5.8 39 5 3 0 29.167 58.334 1.58051 21.9 1.9 1.8 5.8 40 6 0 0 29.682 59.364 1.55553 51.2 4.3 4.2 5.8 41 3 5 0 29.872 59.744 1.54656 57.8 4.9 4.7 5.8 42 6 0 -2 30.233 60.465 1.52982 70.3 6.0 5.8 5.8 43 6 2 -1 30.384 60.768 1.52292 25.6 2.2 2.1 5.8 44 4 0 2 30.632 61.265 1.51175 96.2 8.2 7.9 5.8 45 1 3 -3 30.888 61.775 1.50048 180.9 15.3 14.8 5.8 46 0 6 0 31.238 62.476 1.48533 104.0 8.8 8.5 5.8 47 3 3 -3 31.649 63.299 1.46799 13.7 1.2 1.1 5.9 48 4 4 1 31.974 63.947 1.45465 16.0 1.4 1.3 5.9 49 6 2 -2 32.165 64.33 1.44692 37.1 3.1 3.0 5.9 50 4 2 2 32.551 65.102 1.43161 16.1 1.4 1.3 5.9 51 0 6 1 32.732 65.463 1.42458 25.9 2.2 2.1 5.9 52 5 3 1 32.993 65.987 1.41454 285.5 24.2 23.2 5.9 53 3 5 -2 33.153 66.306 1.40851 116.6 9.9 9.5 5.9 54 1 5 2 33.305 66.611 1.4028 46.6 3.9 3.8 5.9 55 2 2 3 33.874 67.748 1.38199 53.6 4.5 4.3 5.9 56 2 4 -3 34.137 68.274 1.37263 38.7 3.3 3.1 5.9 57 0 4 3 35.084 70.168 1.34014 20.2 1.7 1.6 5.9 58 7 1 -2 35.384 70.769 1.33022 98.2 8.3 7.9 5.9 59 5 3 -3 35.766 71.532 1.31789 111.4 9.4 9.0 5.9 60 5 1 2 35.827 71.654 1.31595 18.5 1.6 1.5 5.9 61 4 4 -3 36.508 73.017 1.29472 11.8 1.0 0.9 6.0 62 3 1 -4 36.763 73.525 1.28702 54.8 4.6 4.4 6.0 63 1 1 -4 36.908 73.816 1.28266 23.9 2.0 1.9 6.0 64 2 6 -2 36.955 73.91 1.28127 46.7 4.0 3.7 6.0 65 0 6 2 37.027 74.055 1.27911 97.2 8.2 7.8 6.0 66 4 0 -4 37.462 74.924 1.26642 30.2 2.6 2.4 6.0 67 4 6 -1 37.636 75.272 1.26143 12.6 1.1 1.0 6.0 68 0 0 4 37.751 75.502 1.25816 73.5 6.2 5.9 6.0 69 3 5 2 38.32 76.64 1.24228 107.2 9.1 8.5 6.0 70 7 3 -2 38.943 77.886 1.22549 12.0 1.0 1.0 6.0 71 7 1 -3 39.385 78.77 1.21394 24.7 2.1 2.0 6.0 72 1 7 1 39.431 78.861 1.21277 27.9 2.4 2.2 6.0 73 8 0 0 41.319 82.638 1.16665 25.1 2.1 2.0 6.1 74 6 4 -3 41.986 83.971 1.15149 12.5 1.1 1.0 6.1 75 6 0 -4 42.087 84.174 1.14923 47.5 4.0 3.7 6.1 76 2 2 4 44.363 88.726 1.10166 25.6 2.2 2.0 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) |