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 *** *********************** CLINOFERROSILITE 8, t-pigeonite, at 600'C, f-pyroxenes, sf-Mg-Fe-pyroxenes, s-clinoenstatite Mg(0.31)Fe(0.67)Ca(0.015)SiO(3) Monoclinic P 2(1)/c Z = 8 R =0.034 NR =784 30 .5 .1990 Ref.Str.: J.R.Smyth (1974) * Amer. Mineral., 59, 1069-1082 Reserv: Clinohypersthene. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 9.762 alpha = 90.0 b = 9.046 beta = 109.16 c = 5.268 gamma = 90.0 Unit cell volume (cub. angs.) = 439.43 Molar volume ( cub.cm/mol.) = 33.09 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.2499 0.652 0.2333 1.83 Mg = 0.51, Fe = 0.49 2 0.2534 0.0141 0.2296 2.16 Mg = 0.13, Fe = 0.84, Ca = 0.03 3 0.0435 0.3405 0.2833 1.05 Si = 1.00 4 0.5503 0.8359 0.2444 1.66 Si = 1.00 5 0.8681 0.3431 0.1656 1.3 O = 1.00 6 0.1271 0.4918 0.3394 1.9 O = 1.00 7 0.0997 0.2623 0.5801 2.0 O = 1.00 8 0.3783 0.8325 0.1361 1.9 O = 1.00 9 0.629 0.9825 0.3799 1.9 O = 1.00 10 0.602 0.7116 0.4937 2.3 O = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.2499 0.652 0.2333 2 2 0.2534 0.0141 0.2296 3 3 0.0435 0.3405 0.2833 4 4 0.5503 0.8359 0.2444 5 5 0.8681 0.3431 0.1656 6 6 0.1271 0.4918 0.3394 7 7 0.0997 0.2623 0.5801 8 8 0.3783 0.8325 0.1361 9 9 0.629 0.9825 0.3799 10 10 0.602 0.7116 0.4937 11 1 0.7501 0.152 0.2667 12 2 0.7466 0.5141 0.2704 13 3 0.9565 0.8405 0.2167 14 4 0.4497 0.3359 0.2556 15 5 0.1319 0.8431 0.3344 16 6 0.8729 0.9918 0.1606 17 7 0.9003 0.7623 0.9199 18 8 0.6217 0.3325 0.3639 19 9 0.371 0.4825 0.1201 20 10 0.398 0.2116 0.0063 21 1 0.2499 0.848 0.7333 22 2 0.2534 0.4859 0.7296 23 3 0.0435 0.1595 0.7833 24 4 0.5503 0.6641 0.7444 25 5 0.8681 0.1569 0.6656 26 6 0.1271 0.0082 0.8394 27 7 0.0997 0.2377 0.0801 28 8 0.3783 0.6675 0.6361 29 9 0.629 0.5175 0.8799 30 10 0.602 0.7884 0.9937 31 1 0.7501 0.348 0.7667 32 2 0.7466 0.9859 0.7704 33 3 0.9565 0.6595 0.7167 34 4 0.4497 0.1641 0.7556 35 5 0.1319 0.6569 0.8344 36 6 0.8729 0.5082 0.6606 37 7 0.9003 0.7377 0.4199 38 8 0.6217 0.1675 0.8639 39 9 0.371 0.0175 0.6201 40 10 0.398 0.2884 0.5063 X-ray density (g/cm cub.) = 3.68 MU (1/cm) = 182.967 Mass attenuation coefficient (cm**2/g) = 49.769 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Mg ,Fe 2.592 6 2.0711 6 2.2183 8 2.2364 5 2.137 9 2.0851 8 2.0386 5 2 Mg ,Fe ,Ca 2.88 6 2.1959 8 2.1294 5 2.7674 10 2.0211 6 2.4874 7 2.0001 9 3 Si 2.1 4 1.6186 5 1.5711 6 1.638 7 1.6423 7 4 Si 2.1 4 1.5865 8 1.5806 9 1.6759 10 1.619 10 5 O 3.264 11 2.7424 6 2.6783 7 3.1784 6 2.9216 8 3.1265 5 3.1265 5 2.6253 7 2.81 9 2.9921 6 3.0646 6 2.8854 8 6 O 3.264 10 2.7424 5 2.4924 7 3.1784 5 2.9692 9 2.6422 7 2.9097 8 2.9921 5 3.0646 5 3.2628 7 3.1025 10 7 O 3.264 9 2.6783 5 2.4924 6 3.0724 10 2.6253 5 2.6422 6 2.6434 7 2.6434 7 3.2628 6 3.0708 10 8 O 3.264 11 2.7234 9 2.6102 10 2.9216 5 3.1674 9 2.9097 6 3.0275 8 3.0275 8 2.5624 10 2.8854 5 3.0702 9 3.173 9 9 O 3.264 10 2.7234 8 2.5569 10 2.9692 6 3.1674 8 3.2156 10 2.81 5 2.6343 10 3.0702 8 3.173 8 3.1838 9 10 O 3.264 10 2.6102 8 2.5569 9 3.0724 7 3.2156 9 2.5624 8 2.6343 9 2.7241 10 2.7241 10 3.1025 6 3.0708 7 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 0 0 5.566 11.133 0.054 209.59 2 2.0 0.9 2 1 1 0 7.962 15.924 0.077 101.3 4 22.2 103.6 3 2 0 0 11.186 22.373 0.108 50.25 2 58.3 176.6 4 0 2 0 11.406 22.812 0.111 48.25 2 3.3 0.6 5 1 1 -1 11.544 23.089 0.112 47.05 4 30.6 91.5 6 0 1 1 11.838 23.677 0.115 44.64 4 16.9 26.4 7 2 1 0 12.577 25.153 0.122 39.32 4 3.5 1.0 8 1 2 0 12.725 25.449 0.123 38.36 4 0.9 0.1 9 2 1 -1 13.792 27.584 0.133 32.35 4 0.7 0.0 10 1 1 1 14.53 29.059 0.14 28.95 4 5.8 2.0 11 1 2 -1 15.272 30.544 0.147 26.02 4 17.2 16.0 12 0 2 1 15.5 31.0 0.149 25.21 4 44.3 102.3 13 2 2 0 16.083 32.166 0.155 23.28 4 100.2 483.9 14 3 0 0 16.918 33.836 0.163 20.86 2 7.1 1.1 15 2 2 -1 17.07 34.14 0.164 20.46 4 149.7 950.0 16 1 2 1 17.684 35.367 0.17 18.94 4 13.9 7.6 17 3 1 -1 17.7 35.399 0.17 18.9 4 86.9 295.7 18 3 1 0 17.899 35.798 0.172 18.44 4 109.9 461.0 19 1 3 0 18.185 36.371 0.174 17.81 4 12.6 5.9 20 2 1 1 18.683 37.366 0.179 16.79 4 4.7 0.8 21 1 0 -2 19.891 39.782 0.19 14.61 2 20.8 6.6 22 1 3 -1 20.115 40.229 0.192 14.25 4 126.4 471.8 23 0 3 1 20.295 40.589 0.194 13.97 4 19.9 11.5 24 2 0 -2 20.364 40.728 0.195 13.87 2 1.6 0.0 25 3 2 -1 20.423 40.846 0.195 13.78 4 6.9 1.4 26 3 2 0 20.6 41.199 0.197 13.52 4 3.4 0.3 27 1 1 -2 20.751 41.502 0.198 13.3 4 21.8 13.1 28 2 3 0 20.759 41.519 0.198 13.28 4 11.5 3.6 29 0 0 2 21.069 42.139 0.201 12.85 2 176.5 414.5 30 2 1 -2 21.208 42.417 0.202 12.66 4 2.1 0.1 31 2 2 1 21.299 42.599 0.203 12.54 4 90.7 213.6 32 2 3 -1 21.561 43.122 0.205 12.2 4 40.1 40.6 33 0 1 2 21.891 43.783 0.208 11.79 4 4.5 0.5 34 1 3 1 22.068 44.136 0.21 11.58 4 52.3 65.6 35 3 0 -2 22.403 44.806 0.213 11.2 2 7.2 0.6 36 4 1 -1 22.533 45.065 0.214 11.05 4 8.6 1.7 37 4 0 0 22.83 45.66 0.217 10.73 2 32.4 11.7 38 1 2 -2 23.174 46.349 0.22 10.37 4 2.9 0.2 39 3 1 -2 23.187 46.374 0.22 10.36 4 13.9 4.1 40 0 4 0 23.298 46.596 0.221 10.25 2 20.8 4.6 41 2 2 -2 23.594 47.188 0.224 9.96 4 29.2 17.6 42 4 1 0 23.603 47.206 0.224 9.95 4 4.7 0.4 43 3 1 1 23.664 47.328 0.224 9.89 4 63.4 82.3 44 1 0 2 23.698 47.396 0.225 9.86 2 49.0 24.6 45 1 4 0 24.031 48.063 0.228 9.55 4 0.6 0.0 46 0 2 2 24.224 48.447 0.229 9.38 4 42.0 34.2 47 3 3 -1 24.4 48.799 0.231 9.23 4 134.9 347.7 48 1 1 2 24.45 48.9 0.231 9.18 4 61.9 72.8 49 3 3 0 24.553 49.107 0.232 9.1 4 23.8 10.7 50 4 2 -1 24.818 49.636 0.235 8.88 4 62.3 71.4 51 2 3 1 25.166 50.332 0.238 8.6 4 13.0 3.0 52 3 2 -2 25.427 50.855 0.24 8.4 4 26.1 11.9 53 1 4 -1 25.601 51.201 0.242 8.27 4 11.0 2.1 54 4 0 -2 25.712 51.424 0.243 8.19 2 129.7 142.7 55 0 4 1 25.75 51.5 0.243 8.16 4 54.7 50.5 56 4 2 0 25.817 51.633 0.243 8.11 4 39.9 26.7 57 3 2 1 25.874 51.747 0.244 8.07 4 5.3 0.5 58 2 4 0 26.138 52.276 0.246 7.89 4 44.5 32.3 59 4 1 -2 26.421 52.843 0.249 7.7 4 22.3 7.9 60 1 2 2 26.611 53.222 0.25 7.57 4 4.6 0.3 61 2 4 -1 26.814 53.628 0.252 7.44 4 52.8 43.0 62 1 3 -2 26.833 53.665 0.252 7.43 4 0.1 0.0 63 2 3 -2 27.21 54.421 0.256 7.2 4 10.9 1.8 64 1 4 1 27.246 54.493 0.256 7.18 4 15.9 3.7 65 2 0 2 27.461 54.922 0.258 7.05 2 114.9 96.5 66 0 3 2 27.78 55.56 0.261 6.87 4 9.0 1.1 67 5 1 -1 27.978 55.956 0.262 6.76 4 2.0 0.1 68 2 1 2 28.14 56.28 0.264 6.67 4 0.7 0.0 69 4 3 -1 28.321 56.642 0.265 6.57 4 29.3 11.7 70 4 2 -2 28.476 56.952 0.267 6.49 4 9.0 1.1 71 3 3 -2 28.878 57.757 0.27 6.29 4 26.1 8.9 72 5 0 0 29.012 58.025 0.271 6.22 2 3.2 0.1 73 4 1 1 29.227 58.454 0.273 6.12 4 1.8 0.0 74 4 3 0 29.236 58.471 0.273 6.12 4 1.8 0.0 75 3 4 -1 29.273 58.545 0.273 6.1 4 18.9 4.5 76 3 3 1 29.288 58.576 0.273 6.09 4 49.2 30.5 77 3 4 0 29.409 58.817 0.274 6.04 4 1.2 0.0 78 5 1 0 29.668 59.336 0.277 5.92 4 37.7 17.4 79 2 4 1 29.952 59.903 0.279 5.79 4 44.9 24.2 80 5 2 -1 29.961 59.923 0.279 5.79 4 21.2 5.4 81 1 3 2 29.969 59.938 0.279 5.79 4 28.4 9.7 82 5 0 -2 30.001 60.002 0.28 5.77 2 22.0 2.9 83 2 2 2 30.116 60.233 0.28 5.72 4 76.8 70.0 84 1 5 0 30.253 60.506 0.282 5.67 4 89.2 93.4 85 5 1 -2 30.644 61.287 0.285 5.51 4 2.0 0.0 86 4 2 1 31.161 62.321 0.289 5.31 4 53.1 31.0 87 2 1 -3 31.276 62.552 0.29 5.26 4 8.9 0.9 88 1 4 -2 31.448 62.895 0.292 5.2 4 18.2 3.6 89 5 2 0 31.585 63.171 0.293 5.15 4 9.7 1.0 90 1 5 -1 31.609 63.218 0.293 5.14 4 32.3 11.1 91 1 1 -3 31.669 63.338 0.293 5.12 4 38.2 15.5 92 4 3 -2 31.706 63.412 0.294 5.11 4 7.1 0.5 93 0 5 1 31.739 63.479 0.294 5.1 4 27.1 7.7 94 2 4 -2 31.79 63.58 0.294 5.08 4 51.0 27.4 95 2 5 0 32.08 64.159 0.297 4.98 4 5.7 0.3 96 3 1 -3 32.091 64.181 0.297 4.98 4 43.1 19.1 97 3 0 2 32.113 64.226 0.297 4.97 2 23.5 2.8 98 0 4 2 32.309 64.618 0.299 4.9 4 33.9 11.7 99 5 2 -2 32.527 65.054 0.301 4.83 4 21.3 4.6 100 2 5 -1 32.676 65.352 0.302 4.78 4 1.5 0.0 101 3 1 2 32.732 65.464 0.302 4.77 4 64.5 41.0 102 4 4 -1 32.804 65.607 0.303 4.74 4 0.6 0.0 103 1 5 1 33.06 66.12 0.305 4.67 4 28.6 7.9 104 5 3 -1 33.105 66.209 0.305 4.65 4 145.1 202.9 105 2 2 -3 33.14 66.279 0.306 4.64 4 121.4 141.7 106 0 1 3 33.246 66.492 0.306 4.61 4 21.6 4.5 107 2 3 2 33.251 66.503 0.307 4.61 4 4.2 0.2 108 3 4 -2 33.316 66.632 0.307 4.59 4 14.3 1.9 109 1 2 -3 33.521 67.041 0.309 4.53 4 23.5 5.2 110 4 4 0 33.646 67.291 0.31 4.5 4 23.3 5.1 111 3 4 1 33.694 67.388 0.31 4.48 4 15.1 2.1 112 3 2 -3 33.93 67.861 0.312 4.42 4 12.0 1.3 113 6 1 -1 33.966 67.931 0.312 4.41 4 17.3 2.7 114 4 1 -3 34.066 68.132 0.313 4.38 4 22.6 4.6 115 4 3 1 34.242 68.485 0.315 4.33 4 14.9 2.0 116 1 4 2 34.325 68.65 0.315 4.31 4 15.1 2.0 117 3 2 2 34.554 69.108 0.317 4.25 4 16.1 2.3 118 5 3 0 34.647 69.295 0.318 4.23 4 4.7 0.2 119 3 5 -1 34.884 69.767 0.32 4.17 4 62.3 33.6 120 3 5 0 35.007 70.014 0.321 4.14 4 61.0 31.9 121 0 2 3 35.055 70.11 0.321 4.13 4 3.2 0.1 122 6 0 -2 35.099 70.199 0.321 4.12 2 107.4 49.2 123 5 1 1 35.337 70.675 0.323 4.07 4 4.9 0.2 124 2 5 1 35.503 71.006 0.325 4.03 4 4.5 0.2 125 5 3 -2 35.548 71.096 0.325 4.02 4 17.8 2.6 126 6 0 0 35.591 71.183 0.325 4.01 2 108.9 49.3 127 6 1 -2 35.693 71.385 0.326 3.99 4 0.8 0.0 128 6 2 -1 35.757 71.515 0.327 3.97 4 28.8 6.8 129 4 2 -3 35.856 71.711 0.327 3.95 4 6.0 0.3 130 1 1 3 35.929 71.857 0.328 3.93 4 4.9 0.2 131 4 4 -2 35.95 71.899 0.328 3.93 4 0.6 0.0 132 2 3 -3 36.136 72.271 0.33 3.89 4 60.8 29.8 133 6 1 0 36.181 72.362 0.33 3.88 4 2.7 0.1 134 0 6 0 36.39 72.779 0.332 3.84 2 157.1 98.1 135 1 3 -3 36.502 73.005 0.333 3.82 4 112.4 99.9 136 1 5 -2 36.881 73.762 0.335 3.74 4 36.3 10.2 137 3 3 -3 36.897 73.794 0.336 3.74 4 57.8 25.9 138 1 6 0 36.952 73.905 0.336 3.73 4 6.0 0.3 139 5 2 1 37.1 74.201 0.337 3.7 4 2.9 0.1 140 5 1 -3 37.115 74.23 0.337 3.7 4 17.2 2.3 141 2 5 -2 37.199 74.398 0.338 3.68 4 7.1 0.4 142 5 4 -1 37.272 74.543 0.339 3.67 4 8.5 0.5 143 2 4 2 37.411 74.822 0.34 3.64 4 38.3 11.0 144 6 2 -2 37.449 74.898 0.34 3.64 4 57.3 24.7 145 3 3 2 37.499 74.999 0.34 3.63 4 10.6 0.8 146 4 0 2 37.545 75.089 0.341 3.62 2 100.2 37.7 147 1 2 3 37.681 75.361 0.342 3.6 4 13.2 1.3 148 0 5 2 37.682 75.364 0.342 3.6 4 36.3 9.8 149 6 2 0 37.929 75.857 0.344 3.56 4 7.9 0.5 150 0 3 3 37.985 75.969 0.344 3.55 4 21.9 3.5 151 4 1 2 38.123 76.245 0.345 3.52 4 19.3 2.7 152 4 5 -1 38.145 76.29 0.345 3.52 4 0.3 0.0 153 1 6 -1 38.189 76.379 0.346 3.51 4 4.4 0.1 154 0 6 1 38.309 76.619 0.347 3.49 4 11.6 1.0 155 4 4 1 38.355 76.711 0.347 3.49 4 0.4 0.0 156 2 6 0 38.623 77.245 0.349 3.45 4 29.2 6.1 157 3 5 -2 38.626 77.253 0.349 3.44 4 67.0 32.0 158 6 3 -1 38.666 77.333 0.349 3.44 4 2.1 0.0 159 5 4 0 38.743 77.486 0.35 3.43 4 13.2 1.2 160 4 3 -3 38.762 77.524 0.35 3.42 4 5.4 0.2 161 5 2 -3 38.848 77.695 0.351 3.41 4 24.8 4.3 162 4 5 0 38.937 77.874 0.351 3.4 4 1.7 0.0 163 3 5 1 38.983 77.966 0.352 3.39 4 51.5 18.7 164 2 6 -1 39.175 78.35 0.353 3.36 4 7.5 0.4 165 1 6 1 39.532 79.063 0.356 3.32 4 14.3 1.4 166 1 5 2 39.58 79.16 0.356 3.31 4 42.0 12.1 167 5 4 -2 39.608 79.216 0.356 3.31 4 18.7 2.4 168 2 1 3 39.633 79.265 0.357 3.3 4 3.8 0.1 169 4 2 2 39.841 79.683 0.358 3.27 4 8.0 0.4 170 5 3 1 39.975 79.951 0.359 3.26 4 170.1 195.3 171 2 4 -3 40.175 80.35 0.361 3.23 4 61.8 25.6 172 6 3 -2 40.316 80.632 0.362 3.22 4 10.1 0.7 173 1 4 -3 40.53 81.059 0.363 3.19 4 0.6 0.0 174 1 3 3 40.543 81.086 0.363 3.19 4 85.3 48.1 175 7 1 -1 40.571 81.143 0.364 3.19 4 34.2 7.7 176 6 3 0 40.786 81.572 0.365 3.16 4 5.9 0.2 177 3 4 -3 40.912 81.824 0.366 3.15 4 0.0 0.0 178 7 0 -2 40.979 81.958 0.367 3.14 2 60.5 11.9 179 4 5 -2 41.129 82.259 0.368 3.12 4 7.1 0.3 180 6 1 -3 41.166 82.331 0.368 3.12 4 10.8 0.8 181 3 6 -1 41.244 82.488 0.369 3.11 4 7.7 0.4 182 2 2 3 41.334 82.669 0.369 3.1 4 40.1 10.3 183 3 6 0 41.361 82.722 0.369 3.1 4 5.2 0.2 184 3 4 2 41.497 82.995 0.37 3.09 4 8.2 0.4 185 7 1 -2 41.544 83.088 0.371 3.08 4 85.6 46.8 186 5 3 -3 41.688 83.377 0.372 3.07 4 77.9 38.6 187 2 6 1 41.831 83.663 0.373 3.05 4 3.6 0.1 188 0 4 3 41.97 83.94 0.374 3.04 4 31.3 6.2 189 6 1 1 42.1 84.201 0.375 3.03 4 0.6 0.0 190 7 2 -1 42.265 84.531 0.376 3.01 4 5.6 0.2 191 5 5 -1 42.403 84.806 0.377 3.0 4 23.5 3.4 192 2 5 2 42.538 85.076 0.378 2.99 4 2.0 0.0 193 6 4 -1 42.637 85.273 0.379 2.98 4 2.6 0.0 194 4 3 2 42.667 85.335 0.379 2.98 4 1.4 0.0 195 4 4 -3 42.73 85.46 0.379 2.98 4 16.1 1.6 196 7 0 0 42.766 85.531 0.38 2.97 2 13.1 0.5 197 6 2 -3 42.856 85.711 0.38 2.97 4 15.5 1.5 198 2 0 -4 42.88 85.759 0.38 2.96 2 5.9 0.1 199 3 0 -4 42.952 85.905 0.381 2.96 2 67.1 13.8 200 1 6 -2 43.15 86.3 0.382 2.94 4 0.6 0.0 201 7 2 -2 43.232 86.463 0.383 2.94 4 3.2 0.1 202 7 1 0 43.327 86.654 0.384 2.93 4 50.6 15.5 203 2 1 -4 43.441 86.882 0.384 2.92 4 29.7 5.3 204 4 5 1 43.456 86.911 0.384 2.92 4 11.6 0.8 205 2 6 -2 43.456 86.912 0.384 2.92 4 25.5 3.9 206 3 1 -4 43.514 87.027 0.385 2.92 4 44.6 12.0 207 6 2 1 43.786 87.571 0.387 2.9 4 36.0 7.8 208 5 0 2 43.791 87.583 0.387 2.9 2 2.4 0.0 209 5 5 0 43.834 87.668 0.387 2.89 4 16.3 1.6 210 1 0 -4 43.887 87.774 0.388 2.89 2 19.7 1.2 211 5 4 1 43.922 87.844 0.388 2.89 4 1.2 0.0 212 0 6 2 43.923 87.847 0.388 2.89 4 116.7 81.5 213 4 0 -4 44.105 88.209 0.389 2.88 2 114.7 39.2 214 2 3 3 44.145 88.291 0.389 2.88 4 22.9 3.1 215 6 4 -2 44.258 88.516 0.39 2.87 4 4.8 0.1 216 3 1 3 44.327 88.653 0.391 2.86 4 32.9 6.4 217 1 7 0 44.34 88.68 0.391 2.86 4 12.8 1.0 218 5 1 2 44.352 88.704 0.391 2.86 4 39.4 9.2 219 4 6 -1 44.372 88.745 0.391 2.86 4 11.4 0.8 220 1 1 -4 44.447 88.895 0.391 2.86 4 11.6 0.8 221 1 4 3 44.482 88.964 0.392 2.86 4 2.1 0.0 222 4 1 -4 44.665 89.33 0.393 2.85 4 27.0 4.3 223 5 5 -2 44.681 89.363 0.393 2.84 4 8.1 0.4 224 6 4 0 44.722 89.445 0.393 2.84 4 15.6 1.4 225 3 6 -2 44.841 89.682 0.394 2.84 4 24.0 3.4 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 7.962 15.924 6.45755 103.6 10.9 11.1 5.6 2 2 0 0 11.186 22.373 4.61062 176.6 18.6 18.8 5.6 3 1 1 -1 11.544 23.089 4.46948 91.5 9.6 9.7 5.6 4 0 1 1 11.838 23.677 4.36003 26.4 2.8 2.8 5.6 5 1 2 -1 15.272 30.544 3.39577 16.0 1.7 1.7 5.6 6 0 2 1 15.5 31.0 3.34702 102.3 10.8 10.8 5.6 7 2 2 0 16.083 32.166 3.22878 483.9 50.9 51.0 5.6 8 2 2 -1 17.07 34.14 3.04718 950.0 100.0 100.0 5.7 9 3 1 -1 17.7 35.399 2.94204 303.3 31.9 31.9 5.7 10 3 1 0 17.899 35.798 2.91033 461.0 48.5 48.5 5.7 11 1 3 -1 20.115 40.229 2.60093 471.8 49.7 49.4 5.7 12 0 3 1 20.295 40.589 2.57883 11.5 1.2 1.2 5.7 13 1 1 -2 20.751 41.502 2.52453 16.7 1.8 1.8 5.7 14 0 0 2 21.069 42.139 2.48809 414.5 43.6 43.3 5.7 15 2 2 1 21.299 42.599 2.46245 213.6 22.5 22.3 5.7 16 2 3 -1 21.561 43.122 2.43397 40.6 4.3 4.2 5.7 17 1 3 1 22.068 44.136 2.38073 65.6 6.9 6.8 5.7 18 4 0 0 22.83 45.66 2.30531 11.7 1.2 1.2 5.7 19 2 2 -2 23.594 47.188 2.23474 18.1 1.9 1.9 5.7 20 3 1 1 23.664 47.328 2.22849 82.3 8.7 8.5 5.7 21 1 0 2 23.698 47.396 2.22549 24.6 2.6 2.6 5.7 22 0 2 2 24.224 48.447 2.18002 34.2 3.6 3.5 5.7 23 3 3 -1 24.4 48.799 2.16525 347.7 36.6 36.1 5.7 24 1 1 2 24.45 48.9 2.16105 72.8 7.7 7.5 5.7 25 3 3 0 24.553 49.107 2.15252 10.7 1.1 1.1 5.7 26 4 2 -1 24.818 49.636 2.13099 71.4 7.5 7.4 5.7 27 3 2 -2 25.427 50.855 2.0832 11.9 1.2 1.2 5.8 28 4 0 -2 25.712 51.424 2.0617 142.7 15.0 14.7 5.8 29 0 4 1 25.75 51.5 2.05886 50.5 5.3 5.2 5.8 30 4 2 0 25.817 51.633 2.05391 26.7 2.8 2.8 5.8 31 2 4 0 26.138 52.276 2.03041 32.3 3.4 3.3 5.8 32 2 4 -1 26.814 53.628 1.98285 43.0 4.5 4.4 5.8 33 2 0 2 27.461 54.922 1.93966 96.5 10.2 9.9 5.8 34 4 3 -1 28.321 56.642 1.88541 11.7 1.2 1.2 5.8 35 3 3 1 29.288 58.576 1.82841 35.0 3.7 3.6 5.8 36 5 1 0 29.668 59.336 1.80708 17.4 1.8 1.8 5.8 37 2 4 1 29.952 59.903 1.79154 39.2 4.1 4.0 5.8 38 2 2 2 30.116 60.233 1.78265 70.0 7.4 7.1 5.8 39 1 5 0 30.253 60.506 1.77535 93.4 9.8 9.5 5.8 40 4 2 1 31.161 62.321 1.72863 31.0 3.3 3.2 5.8 41 1 5 -1 31.609 63.218 1.7066 12.1 1.3 1.2 5.9 42 1 1 -3 31.669 63.338 1.7037 15.5 1.6 1.6 5.9 43 2 4 -2 31.79 63.58 1.69789 27.4 2.9 2.8 5.9 44 3 1 -3 32.091 64.181 1.68366 22.0 2.3 2.2 5.9 45 0 4 2 32.309 64.618 1.67351 11.7 1.2 1.2 5.9 46 3 1 2 32.732 65.464 1.65424 41.0 4.3 4.2 5.9 47 5 3 -1 33.105 66.209 1.63769 202.9 21.4 20.5 5.9 48 2 2 -3 33.14 66.279 1.63617 141.7 14.9 14.3 5.9 49 3 5 -1 34.884 69.767 1.56398 33.6 3.5 3.4 5.9 50 3 5 0 35.007 70.014 1.55916 31.9 3.4 3.2 5.9 51 6 0 -2 35.099 70.199 1.55559 49.2 5.2 4.9 5.9 52 6 0 0 35.591 71.183 1.53687 49.3 5.2 4.9 5.9 53 2 3 -3 36.136 72.271 1.51681 29.8 3.1 3.0 5.9 54 0 6 0 36.39 72.779 1.50767 98.1 10.3 9.8 6.0 55 1 3 -3 36.502 73.005 1.50366 99.9 10.5 10.0 6.0 56 3 3 -3 36.897 73.794 1.48983 36.1 3.8 3.6 6.0 57 2 4 2 37.411 74.822 1.4723 11.0 1.2 1.1 6.0 58 6 2 -2 37.449 74.898 1.47102 24.7 2.6 2.5 6.0 59 4 0 2 37.545 75.089 1.46783 37.7 4.0 3.7 6.0 60 0 5 2 37.682 75.364 1.46326 11.1 1.2 1.1 6.0 61 3 5 -2 38.626 77.253 1.43288 38.1 4.0 3.8 6.0 62 3 5 1 38.983 77.966 1.42184 18.7 2.0 1.8 6.0 63 1 5 2 39.58 79.16 1.40384 14.5 1.5 1.4 6.0 64 5 3 1 39.975 79.951 1.39225 195.3 20.6 19.2 6.0 65 2 4 -3 40.175 80.35 1.38649 25.6 2.7 2.5 6.0 66 1 3 3 40.543 81.086 1.37606 55.8 5.9 5.5 6.1 67 7 0 -2 40.979 81.958 1.36396 11.9 1.3 1.2 6.1 68 2 2 3 41.334 82.669 1.35431 10.5 1.1 1.0 6.1 69 7 1 -2 41.544 83.088 1.34872 46.8 4.9 4.6 6.1 70 5 3 -3 41.688 83.377 1.34489 38.6 4.1 3.8 6.1 71 3 0 -4 42.952 85.905 1.3127 13.8 1.5 1.3 6.1 72 7 1 0 43.327 86.654 1.30357 15.5 1.6 1.5 6.1 73 2 1 -4 43.441 86.882 1.30083 10.1 1.1 1.0 6.1 74 3 1 -4 43.514 87.027 1.29909 12.0 1.3 1.2 6.1 75 0 6 2 43.923 87.847 1.28941 81.5 8.6 7.9 6.2 76 4 0 -4 44.105 88.209 1.2852 39.2 4.1 3.8 6.2 77 5 1 2 44.352 88.704 1.27951 16.6 1.8 1.6 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) |