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 *** *********************** PIEMONTITE 10, t-epidote, syn, f-epidote, s-epidote Ca(2)Al(2.15)Fe(0.1)Mn(0.7)Si(3)O(12)OH Monoclinic P 2(1)/m Z = 2 P2(1)/m 20 .9 .17 Ref.Str.: Nagashima M., Akasaka M. (2010) * Amer. Mineral., 95, 1237-1246 L: $Ca2 Al2.15 Fe0.12 Mn0.73 Si3 O13 H1$ R: N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 8.8727 alpha = 90.0 b = 5.6686 beta = 115.48 c = 10.1682 gamma = 90.0 Unit cell volume (cub. angs.) = 461.67 Molar volume ( cub.cm/mol.) = 139.04 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.7554 0.75 0.152 0.0 Ca = 1.00 2 0.6006 0.75 0.4233 0.0 Ca = 1.00 3 0.0 0.0 0.0 0.0 Al = 0.84, Fe = 0.01, Mn = 0.15 4 0.0 0.0 0.5 0.0 Al = 1.00 5 0.2983 0.25 0.224 0.0 Al = 0.31, Fe = 0.11, Mn = 0.58 6 0.3374 0.75 0.046 0.0 Si = 1.00 7 0.6847 0.25 0.2748 0.0 Si = 1.00 8 0.1872 0.75 0.3218 0.0 Si = 1.00 9 0.2328 0.992 0.0346 0.0 O = 1.00 10 0.3061 0.9794 0.3433 0.0 O = 1.00 11 0.7982 0.019 0.3433 0.0 O = 1.00 12 0.062 0.25 0.137 0.0 O = 1.00 13 0.041 0.75 0.148 0.0 O = 1.00 14 0.064 0.75 0.408 0.0 O = 1.00 15 0.514 0.75 0.1793 0.0 O = 1.00 16 0.523 0.25 0.31 0.0 O = 1.00 17 0.622 0.25 0.0975 0.0 O = 1.00 18 0.083 0.25 0.4308 0.0 OH = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.7554 0.75 0.152 2 2 0.6006 0.75 0.4233 3 3 0.0 0.0 0.0 4 4 0.0 0.0 0.5 5 5 0.2983 0.25 0.224 6 6 0.3374 0.75 0.046 7 7 0.6847 0.25 0.2748 8 8 0.1872 0.75 0.3218 9 9 0.2328 0.992 0.0346 10 10 0.3061 0.9794 0.3433 11 11 0.7982 0.019 0.3433 12 12 0.062 0.25 0.137 13 13 0.041 0.75 0.148 14 14 0.064 0.75 0.408 15 15 0.514 0.75 0.1793 16 16 0.523 0.25 0.31 17 17 0.622 0.25 0.0975 18 18 0.083 0.25 0.4308 19 1 0.2446 0.25 0.848 20 2 0.3994 0.25 0.5767 21 3 0.0 0.5 0.0 22 4 0.0 0.5 0.5 23 5 0.7017 0.75 0.776 24 6 0.6626 0.25 0.954 25 7 0.3153 0.75 0.7252 26 8 0.8128 0.25 0.6782 27 9 0.7672 0.492 0.9654 28 10 0.6939 0.4794 0.6567 29 11 0.2018 0.519 0.6567 30 12 0.938 0.75 0.863 31 13 0.959 0.25 0.852 32 14 0.936 0.25 0.592 33 15 0.486 0.25 0.8207 34 16 0.477 0.75 0.69 35 17 0.378 0.75 0.9025 36 18 0.917 0.75 0.5692 37 9 0.2328 0.508 0.0346 38 10 0.3061 0.5206 0.3433 39 11 0.7982 0.481 0.3433 40 9 0.7672 0.008 0.9654 41 10 0.6939 0.0206 0.6567 42 11 0.2018 0.981 0.6567 X-ray density (g/cm cub.) = 3.44 MU (1/cm) = 264.698 Mass attenuation coefficient (cm**2/g) = 76.969 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Ca 2.928 7 2.3701 11 2.5518 13 2.8532 14 2.2751 15 2.4333 9 2.3701 11 2.4333 9 2 Ca 2.928 8 2.7114 10 2.6996 11 2.2596 15 2.642 10 2.5492 18 2.7114 10 2.6996 11 2.642 10 3 Al ,Fe ,Mn 2.772 6 1.9409 9 1.8953 12 1.9835 13 1.8953 12 1.9835 13 1.9409 9 4 Al 2.364 6 1.8171 11 1.9139 14 1.8686 18 1.9139 14 1.8686 18 1.8171 11 5 Al ,Fe ,Mn 2.772 6 2.2853 9 1.9383 10 1.8928 12 1.7999 16 2.2853 9 1.9383 10 6 Si 2.148 4 1.6322 9 1.5701 15 1.6465 17 1.6322 9 7 Si 2.148 4 1.6157 11 1.6212 16 1.6422 17 1.6157 11 8 Si 2.148 4 1.6289 10 1.6833 13 1.6696 14 1.6289 10 9 O 3.312 10 2.9197 10 2.6225 12 2.7921 13 2.6671 15 3.226 16 2.8002 12 2.7581 13 2.6143 17 2.925 9 2.7436 9 10 O 3.312 9 2.9197 9 2.745 12 2.6736 13 2.8203 14 3.2436 15 2.5946 16 2.9289 18 3.0678 10 2.6008 10 11 O 3.312 9 2.6429 14 2.8012 15 2.6609 16 2.654 17 2.6377 18 2.6352 14 2.5747 18 2.6189 11 3.0497 11 12 O 3.312 10 2.6225 9 2.745 10 2.8458 13 2.8458 13 2.9121 18 2.8002 9 2.6372 13 2.6225 9 2.745 10 2.8002 9 13 O 3.312 10 2.7921 9 2.6736 10 2.8458 12 2.8458 12 2.5626 14 2.7581 9 2.6372 12 2.7921 9 2.6736 10 2.7581 9 14 O 3.312 10 2.8203 10 2.6429 11 2.5626 13 2.8428 18 2.8428 18 2.6352 11 2.4955 18 2.8203 10 2.6429 11 2.6352 11 15 O 3.312 11 2.6671 9 3.2436 10 2.8012 11 3.1168 16 3.1168 16 3.2139 17 3.2139 17 2.5408 17 2.6671 9 3.2436 10 2.8012 11 16 O 3.312 9 3.226 9 2.5946 10 2.6609 11 3.1168 15 3.1168 15 2.6596 17 3.226 9 2.5946 10 2.6609 11 17 O 3.312 8 2.654 11 3.2139 15 3.2139 15 2.6596 16 2.6143 9 2.5408 15 2.654 11 2.6143 9 18 OH 3.36 10 2.9289 10 2.6377 11 2.9121 12 2.8428 14 2.8428 14 2.5747 11 2.4954 14 2.9289 10 2.6377 11 2.5747 11 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 4.814 9.627 0.054 281.03 2 10.2 27.3 2 1 0 0 5.519 11.037 0.062 213.28 2 14.2 40.5 3 1 0 -1 5.548 11.096 0.063 211.0 2 13.1 34.1 4 1 0 1 8.768 17.535 0.099 83.15 2 10.0 7.8 5 1 0 -2 8.824 17.647 0.1 82.07 2 60.7 283.7 6 0 1 1 9.19 18.38 0.104 75.48 4 7.2 7.3 7 1 1 0 9.583 19.166 0.108 69.24 4 9.8 12.4 8 1 1 -1 9.6 19.2 0.108 68.99 4 16.7 36.2 9 0 0 2 9.662 19.324 0.109 68.08 2 1.5 0.1 10 2 0 -1 9.999 19.998 0.113 63.42 2 2.9 0.5 11 2 0 0 11.089 22.178 0.125 51.17 2 54.5 142.7 12 2 0 -2 11.149 22.298 0.126 50.6 2 64.8 199.1 13 1 1 1 11.783 23.566 0.133 45.08 4 23.2 45.4 14 1 1 -2 11.825 23.65 0.133 44.74 4 14.5 17.7 15 0 1 2 12.471 24.942 0.14 40.02 4 0.9 0.1 16 2 1 -1 12.737 25.475 0.143 38.28 4 64.8 301.3 17 1 0 2 13.091 26.182 0.147 36.13 2 58.9 117.6 18 1 0 -3 13.155 26.31 0.148 35.76 2 17.1 9.9 19 2 1 0 13.621 27.242 0.153 33.22 4 8.8 4.9 20 2 1 -2 13.67 27.34 0.153 32.97 4 6.6 2.7 21 2 0 1 13.926 27.852 0.156 31.69 2 57.0 96.5 22 2 0 -3 14.022 28.045 0.157 31.23 2 12.9 4.9 23 0 0 3 14.581 29.162 0.163 28.74 2 39.1 41.3 24 3 0 -1 15.279 30.559 0.171 26.0 2 27.1 18.0 25 3 0 -2 15.313 30.625 0.171 25.87 2 75.2 137.1 26 1 1 2 15.316 30.631 0.171 25.86 4 13.4 8.8 27 1 1 -3 15.371 30.742 0.172 25.66 4 142.4 977.2 28 0 2 0 15.77 31.539 0.176 24.29 2 128.3 375.1 29 2 1 1 16.044 32.089 0.179 23.4 4 45.3 90.1 30 2 1 -3 16.129 32.258 0.18 23.13 4 25.8 28.9 31 0 2 1 16.525 33.05 0.185 21.95 4 7.4 2.3 32 0 1 3 16.623 33.247 0.186 21.67 4 85.7 298.8 33 1 2 0 16.755 33.511 0.187 21.3 4 75.2 225.9 34 1 2 -1 16.765 33.531 0.187 21.27 4 10.1 4.1 35 3 0 0 16.768 33.537 0.187 21.27 2 91.5 167.1 36 3 0 -3 16.86 33.72 0.188 21.01 2 13.5 3.6 37 3 1 -1 17.247 34.495 0.192 20.0 4 103.3 400.6 38 3 1 -2 17.277 34.555 0.193 19.93 4 19.1 13.6 39 2 0 2 17.749 35.498 0.198 18.79 2 95.9 162.0 40 1 0 3 17.801 35.601 0.198 18.67 2 3.3 0.2 41 2 0 -4 17.865 35.731 0.199 18.52 2 21.9 8.3 42 1 0 -4 17.868 35.737 0.199 18.51 2 49.2 42.1 43 1 2 1 18.156 36.311 0.202 17.88 4 9.4 3.0 44 1 2 -2 18.184 36.368 0.203 17.82 4 56.8 108.0 45 3 1 0 18.597 37.193 0.207 16.96 4 10.8 3.7 46 0 2 2 18.628 37.255 0.207 16.9 4 84.8 227.8 47 3 1 -3 18.681 37.361 0.208 16.79 4 96.7 294.8 48 2 2 -1 18.814 37.629 0.209 16.53 4 36.5 41.4 49 2 2 0 19.448 38.895 0.216 15.36 4 14.3 5.9 50 3 0 1 19.471 38.942 0.216 15.32 2 19.4 5.4 51 2 2 -2 19.484 38.967 0.217 15.3 4 64.6 119.8 52 2 1 2 19.497 38.995 0.217 15.27 4 26.1 19.5 53 1 1 3 19.545 39.09 0.217 15.19 4 45.9 60.1 54 2 1 -4 19.605 39.21 0.218 15.09 4 35.3 35.2 55 3 0 -4 19.605 39.21 0.218 15.09 2 32.6 15.1 56 1 1 -4 19.607 39.215 0.218 15.09 4 28.8 23.5 57 0 0 4 19.613 39.226 0.218 15.08 2 3.9 0.2 58 4 0 -2 20.32 40.64 0.225 13.93 2 19.9 5.2 59 1 2 2 20.719 41.438 0.23 13.34 4 14.5 5.3 60 1 2 -3 20.761 41.523 0.23 13.28 4 47.3 55.8 61 4 0 -1 20.898 41.797 0.232 13.09 2 114.4 160.7 62 4 0 -3 20.966 41.932 0.232 12.99 2 40.5 20.0 63 3 1 1 21.098 42.196 0.234 12.81 4 5.9 0.8 64 3 1 -4 21.224 42.447 0.235 12.64 4 15.6 5.8 65 0 1 4 21.231 42.462 0.235 12.63 4 26.4 16.5 66 2 2 1 21.286 42.571 0.236 12.56 4 88.8 185.7 67 2 2 -3 21.352 42.704 0.236 12.47 4 84.3 166.4 68 0 2 3 21.744 43.487 0.24 11.97 4 83.8 157.8 69 4 1 -2 21.895 43.79 0.242 11.79 4 20.0 8.8 70 2 0 3 22.14 44.28 0.245 11.5 2 85.2 78.3 71 3 2 -1 22.244 44.489 0.246 11.38 4 35.2 26.5 72 3 2 -2 22.269 44.537 0.246 11.35 4 24.1 12.4 73 2 0 -5 22.269 44.538 0.246 11.35 2 25.8 7.1 74 4 1 -1 22.44 44.88 0.248 11.15 4 7.8 1.3 75 4 1 -3 22.504 45.008 0.248 11.08 4 1.4 0.0 76 4 0 0 22.623 45.247 0.25 10.95 2 75.1 58.0 77 4 0 -4 22.75 45.501 0.251 10.81 2 13.4 1.8 78 1 0 4 22.762 45.524 0.251 10.8 2 24.4 6.0 79 1 0 -5 22.833 45.666 0.252 10.72 2 42.2 17.9 80 3 0 2 23.031 46.062 0.254 10.52 2 9.9 1.0 81 3 0 -5 23.195 46.391 0.256 10.35 2 44.5 19.2 82 3 2 0 23.35 46.701 0.257 10.19 4 16.6 5.3 83 3 2 -3 23.42 46.84 0.258 10.13 4 10.8 2.2 84 2 1 3 23.617 47.234 0.26 9.94 4 42.3 33.4 85 2 1 -5 23.74 47.479 0.261 9.82 4 2.7 0.1 86 4 1 0 24.077 48.155 0.265 9.51 4 3.8 0.3 87 2 2 2 24.105 48.209 0.265 9.49 4 71.1 90.1 88 1 2 3 24.145 48.289 0.266 9.45 4 14.8 3.9 89 2 2 -4 24.195 48.391 0.266 9.4 4 80.1 113.3 90 1 2 -4 24.197 48.395 0.266 9.4 4 58.8 61.1 91 4 1 -4 24.198 48.396 0.266 9.4 4 8.1 1.2 92 1 1 4 24.209 48.418 0.266 9.39 4 49.3 42.9 93 1 1 -5 24.277 48.554 0.267 9.33 4 42.9 32.3 94 3 1 2 24.466 48.933 0.269 9.17 4 40.2 27.7 95 0 3 1 24.595 49.19 0.27 9.06 4 4.0 0.3 96 3 1 -5 24.623 49.246 0.27 9.04 4 5.8 0.6 97 1 3 0 24.762 49.523 0.272 8.92 4 30.0 15.1 98 1 3 -1 24.769 49.538 0.272 8.92 4 11.1 2.1 99 0 0 5 24.808 49.616 0.272 8.88 2 19.6 3.2 100 4 0 1 25.311 50.623 0.278 8.49 2 22.8 4.1 101 3 2 1 25.472 50.945 0.279 8.37 4 22.4 7.9 102 4 0 -5 25.486 50.972 0.279 8.36 2 7.7 0.5 103 3 2 -4 25.581 51.163 0.28 8.29 4 4.8 0.4 104 0 2 4 25.588 51.175 0.28 8.28 4 44.0 30.1 105 1 3 1 25.799 51.599 0.283 8.13 4 26.4 10.6 106 1 3 -2 25.821 51.642 0.283 8.11 4 18.5 5.2 107 5 0 -2 25.838 51.675 0.283 8.1 2 79.7 48.3 108 5 0 -3 25.874 51.747 0.283 8.07 2 32.3 7.9 109 0 3 2 26.158 52.317 0.286 7.87 4 2.2 0.1 110 4 2 -2 26.166 52.331 0.286 7.87 4 39.2 22.7 111 0 1 5 26.17 52.34 0.286 7.87 4 41.0 24.9 112 2 3 -1 26.301 52.603 0.288 7.78 4 50.5 37.2 113 4 2 -1 26.644 53.288 0.291 7.55 4 20.0 5.7 114 4 1 1 26.655 53.31 0.291 7.54 4 13.8 2.7 115 4 2 -3 26.7 53.4 0.292 7.52 4 16.2 3.7 116 2 3 0 26.792 53.584 0.293 7.46 4 9.1 1.2 117 5 0 -1 26.817 53.635 0.293 7.44 2 18.5 2.4 118 2 3 -2 26.82 53.64 0.293 7.44 4 5.5 0.4 119 4 1 -5 26.823 53.646 0.293 7.44 4 64.5 58.1 120 5 0 -4 26.922 53.845 0.294 7.37 2 19.9 2.8 121 2 0 4 26.936 53.873 0.294 7.37 2 42.1 12.3 122 2 0 -6 27.076 54.152 0.295 7.28 2 68.2 31.8 123 5 1 -2 27.163 54.325 0.296 7.23 4 41.9 23.8 124 5 1 -3 27.197 54.395 0.297 7.21 4 36.6 18.1 125 3 0 3 27.212 54.423 0.297 7.2 2 18.5 2.3 126 3 0 -6 27.398 54.797 0.299 7.09 2 69.7 32.3 127 2 2 3 27.687 55.374 0.302 6.92 4 2.6 0.1 128 2 2 -5 27.796 55.593 0.303 6.86 4 23.8 7.3 129 1 3 2 27.798 55.596 0.303 6.86 4 9.2 1.1 130 1 3 -3 27.832 55.664 0.303 6.84 4 93.7 112.8 131 1 0 5 27.973 55.946 0.304 6.76 2 42.3 11.4 132 1 0 -6 28.048 56.096 0.305 6.72 2 128.6 104.3 133 4 2 0 28.099 56.197 0.306 6.69 4 48.8 29.9 134 5 1 -1 28.11 56.22 0.306 6.69 4 98.8 122.4 135 4 2 -4 28.207 56.414 0.307 6.63 4 121.9 185.1 136 5 1 -4 28.212 56.424 0.307 6.63 4 30.6 11.7 137 1 2 4 28.217 56.434 0.307 6.63 4 68.8 58.8 138 2 1 4 28.226 56.451 0.307 6.62 4 43.5 23.6 139 2 3 1 28.255 56.51 0.307 6.61 4 36.0 16.0 140 1 2 -5 28.278 56.556 0.308 6.6 4 0.0 0.0 141 2 3 -3 28.309 56.618 0.308 6.58 4 19.1 4.5 142 2 1 -6 28.361 56.721 0.308 6.55 4 33.5 13.8 143 3 2 2 28.448 56.896 0.309 6.51 4 66.2 53.5 144 3 1 3 28.492 56.985 0.31 6.48 4 22.0 5.9 145 3 2 -5 28.589 57.179 0.311 6.43 4 6.6 0.5 146 0 3 3 28.628 57.256 0.311 6.41 4 67.7 55.2 147 3 1 -6 28.674 57.347 0.311 6.39 4 11.3 1.5 148 5 0 0 28.74 57.481 0.312 6.36 2 20.6 2.5 149 4 0 2 28.773 57.546 0.312 6.34 2 2.1 0.0 150 5 0 -5 28.907 57.815 0.314 6.28 2 20.0 2.4 151 4 0 -6 28.986 57.973 0.315 6.24 2 143.8 121.0 152 3 3 -1 29.04 58.08 0.315 6.21 4 91.9 98.4 153 3 3 -2 29.06 58.12 0.315 6.2 4 31.5 11.5 154 1 1 5 29.232 58.463 0.317 6.12 4 72.7 60.6 155 1 1 -6 29.304 58.609 0.318 6.09 4 20.7 4.9 156 3 3 0 29.962 59.923 0.324 5.79 4 19.1 4.0 157 5 1 0 29.978 59.957 0.324 5.78 4 52.3 29.7 158 0 2 5 29.994 59.988 0.324 5.78 4 11.0 1.3 159 4 1 2 30.01 60.02 0.325 5.77 4 80.9 70.9 160 3 3 -3 30.02 60.04 0.325 5.76 4 68.3 50.5 161 5 1 -5 30.141 60.282 0.326 5.71 4 18.0 3.5 162 4 1 -6 30.218 60.436 0.327 5.68 4 1.0 0.0 163 0 0 6 30.232 60.463 0.327 5.68 2 51.9 14.4 164 4 2 1 30.438 60.876 0.329 5.59 4 4.6 0.2 165 4 2 -5 30.593 61.185 0.33 5.53 4 48.7 24.6 166 2 3 2 30.6 61.199 0.33 5.52 4 21.8 4.9 167 1 3 3 30.634 61.267 0.331 5.51 4 21.0 4.6 168 2 3 -4 30.677 61.354 0.331 5.49 4 21.6 4.8 169 1 3 -4 30.679 61.357 0.331 5.49 4 14.6 2.2 170 5 2 -2 30.905 61.81 0.333 5.4 4 26.1 6.9 171 5 2 -3 30.937 61.874 0.334 5.39 4 4.6 0.2 172 6 0 -3 31.393 62.785 0.338 5.22 2 52.0 13.3 173 0 1 6 31.434 62.867 0.339 5.21 4 6.0 0.3 174 5 0 1 31.498 62.995 0.339 5.18 2 2.9 0.0 175 5 0 -6 31.719 63.438 0.341 5.1 2 42.1 8.5 176 3 3 1 31.775 63.55 0.342 5.08 4 8.5 0.7 177 5 2 -1 31.781 63.563 0.342 5.08 4 37.0 13.0 178 6 0 -2 31.807 63.613 0.342 5.07 2 6.4 0.2 179 3 3 -4 31.869 63.739 0.343 5.05 4 6.5 0.4 180 0 3 4 31.875 63.75 0.343 5.05 4 20.1 3.8 181 5 2 -4 31.876 63.752 0.343 5.05 4 106.6 107.6 182 6 0 -4 31.882 63.764 0.343 5.05 2 93.1 41.1 183 2 2 4 31.889 63.777 0.343 5.04 4 60.6 34.7 184 3 0 4 31.899 63.797 0.343 5.04 2 71.3 24.0 185 2 2 -6 32.014 64.029 0.344 5.0 4 69.4 45.2 186 2 0 5 32.106 64.211 0.345 4.97 2 2.2 0.0 187 3 0 -7 32.106 64.212 0.345 4.97 2 5.7 0.2 188 3 2 3 32.137 64.273 0.345 4.96 4 30.7 8.8 189 2 0 -7 32.256 64.512 0.346 4.92 2 17.5 1.4 190 3 2 -6 32.306 64.611 0.347 4.9 4 101.3 94.5 191 4 3 -2 32.379 64.758 0.348 4.88 4 9.2 0.8 192 6 1 -3 32.57 65.14 0.349 4.82 4 16.3 2.4 193 5 1 1 32.673 65.346 0.35 4.79 4 28.2 7.1 194 4 3 -1 32.799 65.597 0.352 4.75 4 2.9 0.1 195 1 2 5 32.827 65.653 0.352 4.74 4 19.2 3.3 196 4 3 -3 32.848 65.696 0.352 4.73 4 5.0 0.2 197 4 0 3 32.877 65.754 0.352 4.72 2 51.2 11.6 198 5 1 -6 32.89 65.78 0.352 4.72 4 10.4 1.0 199 1 2 -6 32.895 65.789 0.353 4.72 4 28.5 7.2 200 0 4 0 32.925 65.85 0.353 4.71 2 234.7 243.2 201 6 1 -2 32.976 65.952 0.353 4.69 4 26.1 6.0 202 6 1 -4 33.05 66.101 0.354 4.67 4 30.6 8.2 203 3 1 4 33.066 66.133 0.354 4.66 4 1.6 0.0 204 6 0 -1 33.106 66.212 0.355 4.65 2 9.8 0.4 205 4 0 -7 33.124 66.248 0.355 4.65 2 1.8 0.0 206 6 0 -5 33.254 66.507 0.356 4.61 2 36.5 5.7 207 2 1 5 33.27 66.539 0.356 4.6 4 76.9 51.0 208 3 1 -7 33.27 66.539 0.356 4.6 4 37.9 12.4 209 0 4 1 33.366 66.731 0.357 4.58 4 7.4 0.5 210 2 1 -7 33.417 66.834 0.357 4.56 4 41.5 14.8 211 1 0 6 33.486 66.973 0.358 4.54 2 9.6 0.4 212 1 4 0 33.503 67.006 0.358 4.54 4 7.2 0.4 213 1 4 -1 33.509 67.019 0.358 4.53 4 7.6 0.5 214 5 2 0 33.527 67.054 0.359 4.53 4 58.4 29.0 215 4 2 2 33.557 67.114 0.359 4.52 4 137.1 159.5 216 1 0 -7 33.566 67.132 0.359 4.52 2 45.0 8.6 217 5 2 -5 33.68 67.36 0.36 4.49 4 19.9 3.3 218 2 3 3 33.722 67.445 0.36 4.47 4 34.4 9.9 219 4 2 -6 33.753 67.505 0.361 4.47 4 41.3 14.3 220 2 3 -5 33.82 67.64 0.361 4.45 4 8.0 0.5 221 4 1 3 34.027 68.054 0.363 4.39 4 2.9 0.1 222 4 3 0 34.09 68.18 0.364 4.37 4 4.3 0.2 223 4 3 -4 34.187 68.375 0.365 4.35 4 9.4 0.7 224 1 3 4 34.196 68.392 0.365 4.35 4 50.2 20.5 225 1 3 -5 34.251 68.502 0.365 4.33 4 30.0 7.3 226 6 1 -1 34.252 68.505 0.365 4.33 4 40.5 13.3 227 4 1 -7 34.27 68.54 0.366 4.33 4 34.7 9.8 228 1 4 1 34.368 68.736 0.366 4.3 4 3.9 0.1 229 1 4 -2 34.386 68.773 0.367 4.3 4 34.3 9.5 230 6 1 -5 34.398 68.795 0.367 4.29 4 10.2 0.8 231 3 3 2 34.404 68.807 0.367 4.29 4 19.2 3.0 232 3 3 -5 34.531 69.061 0.368 4.26 4 16.5 2.2 233 1 1 6 34.627 69.253 0.369 4.24 4 2.0 0.0 234 0 4 2 34.671 69.342 0.369 4.23 4 3.1 0.1 235 1 1 -7 34.705 69.41 0.37 4.22 4 0.6 0.0 236 2 4 -1 34.792 69.584 0.37 4.2 4 2.2 0.0 237 0 2 6 34.901 69.802 0.371 4.17 4 71.1 39.5 238 5 0 2 34.989 69.978 0.372 4.15 2 81.1 25.6 239 2 4 0 35.21 70.419 0.374 4.1 4 30.4 7.1 240 2 4 -2 35.233 70.467 0.374 4.09 4 36.3 10.1 241 6 0 0 35.241 70.481 0.375 4.09 2 30.4 3.6 242 5 0 -7 35.259 70.518 0.375 4.08 2 11.8 0.5 243 6 0 -6 35.456 70.911 0.377 4.04 2 19.9 1.5 244 0 3 5 35.803 71.607 0.38 3.96 4 35.8 9.5 245 0 0 7 35.973 71.947 0.381 3.92 2 30.0 3.3 246 6 2 -3 35.982 71.964 0.381 3.92 4 40.9 12.3 247 1 4 2 36.075 72.15 0.382 3.9 4 35.8 9.4 248 5 2 1 36.08 72.161 0.382 3.9 4 20.1 3.0 249 1 4 -3 36.105 72.21 0.383 3.9 4 10.9 0.9 250 5 1 2 36.107 72.215 0.383 3.9 4 28.0 5.7 251 4 3 1 36.209 72.419 0.383 3.88 4 13.3 1.3 252 5 2 -6 36.288 72.575 0.384 3.86 4 44.2 14.1 253 4 3 -5 36.351 72.703 0.385 3.85 4 57.2 23.6 254 6 1 0 36.356 72.711 0.385 3.85 4 19.5 2.7 255 6 2 -2 36.37 72.74 0.385 3.84 4 77.8 43.7 256 5 1 -7 36.374 72.747 0.385 3.84 4 6.5 0.3 257 6 2 -4 36.441 72.882 0.386 3.83 4 75.1 40.5 258 3 2 4 36.456 72.913 0.386 3.83 4 4.2 0.1 259 2 4 1 36.473 72.946 0.386 3.82 4 39.2 11.0 260 2 4 -3 36.52 73.04 0.386 3.81 4 1.8 0.0 261 6 1 -6 36.568 73.136 0.387 3.8 4 21.1 3.2 262 5 3 -2 36.638 73.277 0.387 3.79 4 45.2 14.6 263 2 2 5 36.651 73.302 0.387 3.79 4 33.2 7.8 264 3 2 -7 36.651 73.302 0.387 3.79 4 15.8 1.8 265 5 3 -3 36.668 73.336 0.388 3.78 4 27.4 5.3 266 2 2 -7 36.792 73.584 0.389 3.76 4 8.1 0.5 267 0 4 3 36.799 73.598 0.389 3.76 4 18.2 2.3 268 3 0 5 37.075 74.149 0.391 3.71 2 65.0 14.7 269 0 1 7 37.08 74.159 0.391 3.71 4 52.8 19.3 270 3 4 -1 37.161 74.322 0.392 3.69 4 17.3 2.1 271 3 4 -2 37.179 74.357 0.392 3.69 4 54.3 20.4 272 3 0 -8 37.303 74.606 0.393 3.66 2 86.0 25.4 273 4 2 3 37.378 74.756 0.394 3.65 4 79.6 43.4 274 5 3 -1 37.448 74.896 0.395 3.64 4 97.1 64.3 275 7 0 -3 37.509 75.017 0.395 3.63 2 25.6 2.2 276 5 3 -4 37.536 75.072 0.395 3.62 4 14.9 1.5 277 2 3 4 37.548 75.095 0.396 3.62 4 36.2 8.9 278 7 0 -4 37.549 75.099 0.396 3.62 2 31.1 3.3 279 4 0 4 37.568 75.136 0.396 3.62 2 63.7 13.8 280 6 2 -1 37.594 75.189 0.396 3.61 4 51.7 18.1 281 4 2 -7 37.611 75.223 0.396 3.61 4 9.5 0.6 282 2 3 -6 37.664 75.329 0.397 3.6 4 28.2 5.4 283 2 0 6 37.691 75.383 0.397 3.6 2 56.3 10.7 284 6 2 -5 37.734 75.469 0.397 3.59 4 81.4 44.7 285 3 3 3 37.778 75.556 0.398 3.58 4 26.4 4.7 286 4 0 -8 37.848 75.696 0.398 3.57 2 25.2 2.1 287 2 0 -8 37.855 75.709 0.398 3.57 2 63.2 13.4 288 3 3 -6 37.935 75.871 0.399 3.55 4 17.7 2.1 289 1 2 6 37.955 75.91 0.399 3.55 4 43.7 12.7 290 3 4 0 37.978 75.957 0.399 3.55 4 64.9 28.1 291 1 2 -7 38.03 76.061 0.4 3.54 4 12.2 1.0 292 3 4 -3 38.031 76.061 0.4 3.54 4 8.8 0.5 293 6 0 1 38.154 76.307 0.401 3.52 2 18.7 1.2 294 3 1 5 38.169 76.337 0.401 3.52 4 6.0 0.2 295 7 0 -2 38.3 76.6 0.402 3.5 2 15.1 0.7 296 3 1 -8 38.395 76.79 0.403 3.48 4 0.0 0.0 297 1 3 5 38.422 76.844 0.403 3.48 4 65.4 27.9 298 7 0 -5 38.422 76.844 0.403 3.48 2 10.8 0.4 299 6 0 -7 38.432 76.864 0.403 3.47 2 29.4 2.8 300 1 3 -6 38.486 76.971 0.404 3.47 4 5.8 0.2 301 2 4 2 38.55 77.1 0.405 3.46 4 78.7 40.2 302 1 4 3 38.58 77.161 0.405 3.45 4 1.5 0.0 303 7 1 -3 38.598 77.197 0.405 3.45 4 4.8 0.1 304 2 4 -4 38.619 77.239 0.405 3.45 4 7.2 0.3 305 1 4 -4 38.621 77.242 0.405 3.45 4 38.2 9.4 306 7 1 -4 38.639 77.278 0.405 3.44 4 21.2 2.9 307 4 1 4 38.657 77.315 0.405 3.44 4 15.1 1.5 308 2 1 6 38.78 77.559 0.407 3.42 4 20.7 2.7 309 4 1 -8 38.935 77.869 0.408 3.4 4 11.2 0.8 310 2 1 -8 38.941 77.883 0.408 3.4 4 2.8 0.1 311 5 3 0 39.079 78.158 0.409 3.38 4 47.3 14.2 312 4 3 2 39.107 78.214 0.409 3.37 4 67.2 28.6 313 5 0 3 39.158 78.315 0.41 3.37 2 12.5 0.5 314 5 3 -5 39.223 78.446 0.41 3.36 4 3.5 0.1 315 6 1 1 39.238 78.476 0.411 3.36 4 4.5 0.1 316 4 3 -6 39.291 78.583 0.411 3.35 4 1.4 0.0 317 7 1 -2 39.383 78.766 0.412 3.34 4 13.5 1.1 318 5 2 2 39.388 78.775 0.412 3.34 4 20.8 2.7 319 1 0 7 39.401 78.802 0.412 3.33 2 20.3 1.3 320 5 0 -8 39.474 78.948 0.413 3.32 2 11.6 0.4 321 1 0 -8 39.487 78.975 0.413 3.32 2 14.9 0.7 322 7 1 -5 39.504 79.008 0.413 3.32 4 2.4 0.0 323 6 1 -7 39.514 79.028 0.413 3.32 4 75.0 35.0 324 3 4 1 39.614 79.227 0.414 3.3 4 16.4 1.7 325 6 2 0 39.629 79.257 0.414 3.3 4 27.6 4.7 326 5 2 -7 39.646 79.292 0.414 3.3 4 31.6 6.2 327 3 4 -4 39.7 79.4 0.415 3.29 4 36.5 8.2 328 0 4 4 39.705 79.41 0.415 3.29 4 10.2 0.6 329 6 2 -6 39.835 79.67 0.416 3.28 4 49.4 15.0 330 7 0 -1 39.909 79.817 0.416 3.27 2 23.1 1.6 331 7 0 -6 40.109 80.218 0.418 3.24 2 2.8 0.0 332 4 4 -2 40.166 80.332 0.419 3.23 4 1.2 0.0 333 5 1 3 40.234 80.468 0.419 3.23 4 8.5 0.4 334 0 2 7 40.333 80.667 0.42 3.21 4 61.0 22.5 335 0 3 6 40.379 80.757 0.421 3.21 4 2.1 0.0 336 1 1 7 40.476 80.952 0.421 3.2 4 20.0 2.4 337 5 1 -8 40.548 81.097 0.422 3.19 4 0.5 0.0 338 4 4 -1 40.552 81.104 0.422 3.19 4 64.0 24.5 339 1 1 -8 40.562 81.123 0.422 3.19 4 2.0 0.0 340 4 4 -3 40.598 81.195 0.422 3.18 4 21.7 2.8 341 7 1 -1 40.98 81.961 0.426 3.14 4 10.2 0.6 342 7 1 -6 41.18 82.359 0.427 3.12 4 42.2 10.4 343 3 2 5 41.398 82.795 0.429 3.1 4 39.2 8.9 344 2 4 3 41.408 82.816 0.429 3.1 4 46.3 12.4 345 6 3 -3 41.411 82.822 0.429 3.1 4 15.3 1.4 346 2 4 -5 41.499 82.997 0.43 3.09 4 12.9 1.0 347 5 3 1 41.505 83.01 0.43 3.09 4 32.1 5.9 348 3 2 -8 41.619 83.239 0.431 3.07 4 46.2 12.3 349 5 3 -6 41.704 83.408 0.432 3.07 4 6.2 0.2 350 4 4 0 41.751 83.501 0.432 3.06 4 48.5 13.5 351 6 3 -2 41.783 83.566 0.433 3.06 4 25.4 3.7 352 6 0 2 41.809 83.619 0.433 3.06 2 17.9 0.9 353 7 2 -3 41.819 83.638 0.433 3.06 4 46.7 12.5 354 4 4 -4 41.842 83.683 0.433 3.05 4 12.0 0.8 355 1 4 4 41.85 83.7 0.433 3.05 4 16.1 1.5 356 6 3 -4 41.851 83.702 0.433 3.05 4 28.9 4.8 357 7 2 -4 41.859 83.717 0.433 3.05 4 12.5 0.9 358 3 3 4 41.866 83.732 0.433 3.05 4 8.3 0.4 359 4 2 4 41.877 83.754 0.433 3.05 4 21.4 2.6 360 1 4 -5 41.901 83.802 0.434 3.05 4 24.4 3.4 361 2 2 6 41.997 83.994 0.434 3.04 4 29.7 5.0 362 3 4 2 42.044 84.088 0.435 3.03 4 5.8 0.2 363 2 3 5 42.053 84.106 0.435 3.03 4 68.1 26.4 364 3 3 -7 42.053 84.106 0.435 3.03 4 33.0 6.2 365 4 2 -8 42.149 84.298 0.436 3.02 4 23.6 3.1 366 6 0 -8 42.15 84.3 0.436 3.02 2 75.8 16.3 367 2 2 -8 42.156 84.311 0.436 3.02 4 33.0 6.2 368 3 4 -5 42.163 84.326 0.436 3.02 4 27.2 4.2 369 0 0 8 42.17 84.339 0.436 3.02 2 5.6 0.1 370 2 3 -7 42.189 84.378 0.436 3.02 4 34.2 6.6 371 7 0 0 42.313 84.626 0.437 3.01 2 1.9 0.0 372 6 2 1 42.447 84.894 0.438 3.0 4 10.2 0.6 373 7 2 -2 42.59 85.18 0.439 2.99 4 17.9 1.8 374 7 0 -7 42.59 85.181 0.439 2.99 2 8.5 0.2 375 7 2 -5 42.709 85.418 0.44 2.98 4 12.7 0.9 376 6 2 -7 42.719 85.438 0.44 2.98 4 6.7 0.2 377 4 3 3 42.755 85.51 0.441 2.97 4 0.4 0.0 378 3 0 6 42.805 85.61 0.441 2.97 2 11.0 0.3 379 4 0 5 42.872 85.743 0.442 2.96 2 6.2 0.1 380 6 1 2 42.872 85.744 0.442 2.96 4 9.7 0.5 381 6 3 -1 42.965 85.929 0.442 2.96 4 35.2 6.9 382 4 3 -7 42.981 85.962 0.443 2.96 4 32.9 6.0 383 3 0 -9 43.059 86.119 0.443 2.95 2 20.9 1.2 384 6 3 -5 43.1 86.201 0.444 2.95 4 4.2 0.1 385 4 0 -9 43.188 86.377 0.444 2.94 2 0.7 0.0 386 0 5 1 43.203 86.407 0.444 2.94 4 5.6 0.2 387 6 1 -8 43.211 86.423 0.444 2.94 4 28.6 4.5 388 0 1 8 43.231 86.462 0.445 2.94 4 53.3 15.7 389 1 3 6 43.315 86.629 0.445 2.93 4 10.9 0.7 390 1 5 0 43.33 86.66 0.445 2.93 4 6.5 0.2 391 1 5 -1 43.336 86.671 0.445 2.93 4 9.4 0.5 392 0 4 5 43.365 86.731 0.446 2.93 4 12.8 0.9 393 7 1 0 43.374 86.748 0.446 2.93 4 68.9 26.1 394 1 3 -7 43.388 86.776 0.446 2.93 4 5.7 0.2 395 5 2 3 43.429 86.858 0.446 2.92 4 10.3 0.6 396 7 1 -7 43.651 87.301 0.448 2.91 4 68.7 25.7 397 1 2 7 43.668 87.336 0.448 2.91 4 2.9 0.0 398 5 2 -8 43.74 87.48 0.449 2.9 4 66.8 24.3 399 4 4 1 43.752 87.504 0.449 2.9 4 7.4 0.3 400 1 2 -8 43.753 87.506 0.449 2.9 4 62.9 21.5 401 2 0 7 43.811 87.622 0.449 2.9 2 44.8 5.5 402 3 1 6 43.865 87.729 0.45 2.89 4 32.4 5.7 403 4 4 -5 43.888 87.775 0.45 2.89 4 2.4 0.0 404 4 1 5 43.931 87.863 0.45 2.89 4 35.8 6.9 405 8 0 -4 43.99 87.98 0.451 2.89 2 12.4 0.4 406 2 0 -9 43.992 87.983 0.451 2.88 2 48.1 6.3 407 5 0 4 44.011 88.023 0.451 2.88 2 1.1 0.0 408 3 1 -9 44.119 88.237 0.452 2.88 4 18.6 1.9 409 1 5 1 44.132 88.264 0.452 2.88 4 6.3 0.2 410 1 5 -2 44.149 88.298 0.452 2.88 4 1.7 0.0 411 5 4 -2 44.162 88.324 0.452 2.87 4 54.0 15.7 412 7 2 -1 44.167 88.334 0.452 2.87 4 28.9 4.5 413 5 4 -3 44.19 88.381 0.452 2.87 4 16.9 1.5 414 4 1 -9 44.247 88.495 0.453 2.87 4 82.6 36.8 415 8 0 -3 44.348 88.697 0.454 2.86 2 89.7 21.6 416 7 2 -6 44.365 88.729 0.454 2.86 4 30.2 4.9 417 5 0 -9 44.378 88.756 0.454 2.86 2 11.1 0.3 418 0 5 2 44.415 88.83 0.454 2.86 4 0.6 0.0 419 8 0 -5 44.439 88.878 0.454 2.86 2 34.2 3.1 420 2 5 -1 44.528 89.057 0.455 2.85 4 34.6 6.4 421 5 3 2 44.713 89.426 0.457 2.84 4 36.5 7.1 422 2 1 7 44.869 89.738 0.458 2.83 4 35.2 6.6 423 2 5 0 44.921 89.841 0.458 2.83 4 6.9 0.3 424 5 4 -1 44.941 89.882 0.459 2.83 4 19.1 1.9 425 2 5 -2 44.943 89.886 0.459 2.83 4 0.9 0.0 426 6 3 0 44.95 89.9 0.459 2.83 4 14.7 1.2 427 5 3 -7 44.967 89.934 0.459 2.83 4 11.4 0.7 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 4.814 9.627 9.17919 27.3 2.8 2.8 5.6 2 1 0 0 5.519 11.037 8.0097 40.5 4.1 4.2 5.6 3 1 0 -1 5.548 11.096 7.9674 34.1 3.5 3.5 5.6 4 1 0 -2 8.824 17.647 5.02165 283.7 29.0 29.3 5.6 5 1 1 -1 9.6 19.2 4.61886 48.7 5.0 5.0 5.6 6 2 0 0 11.089 22.178 4.00485 142.7 14.6 14.7 5.6 7 2 0 -2 11.149 22.298 3.9837 199.1 20.4 20.5 5.6 8 1 1 1 11.783 23.566 3.77215 45.4 4.7 4.7 5.6 9 1 1 -2 11.825 23.65 3.75886 17.7 1.8 1.8 5.6 10 2 1 -1 12.737 25.475 3.49358 301.3 30.8 31.0 5.6 11 1 0 2 13.091 26.182 3.40078 117.6 12.0 12.1 5.6 12 1 0 -3 13.155 26.31 3.38458 9.9 1.0 1.0 5.6 13 2 0 1 13.926 27.852 3.20056 96.5 9.9 9.9 5.6 14 0 0 3 14.581 29.162 3.05973 41.3 4.2 4.2 5.6 15 3 0 -1 15.279 30.559 2.92296 18.0 1.8 1.8 5.6 16 3 0 -2 15.313 30.625 2.91676 145.9 14.9 14.9 5.6 17 1 1 -3 15.371 30.742 2.906 977.2 100.0 100.0 5.6 18 0 2 0 15.77 31.539 2.8343 375.1 38.4 38.4 5.6 19 2 1 1 16.044 32.089 2.78701 90.1 9.2 9.2 5.6 20 2 1 -3 16.129 32.258 2.77275 28.9 3.0 3.0 5.6 21 0 1 3 16.623 33.247 2.69253 298.8 30.6 30.5 5.6 22 1 2 0 16.755 33.511 2.67195 397.0 40.6 40.5 5.7 23 3 1 -1 17.247 34.495 2.59792 400.6 41.0 40.9 5.7 24 3 1 -2 17.277 34.555 2.59356 13.6 1.4 1.4 5.7 25 2 0 2 17.749 35.498 2.52674 162.0 16.6 16.5 5.7 26 1 0 -4 17.868 35.737 2.51045 50.4 5.2 5.1 5.7 27 1 2 -2 18.184 36.368 2.46828 108.0 11.1 11.0 5.7 28 0 2 2 18.628 37.255 2.41152 227.8 23.3 23.2 5.7 29 3 1 -3 18.681 37.361 2.40494 294.8 30.2 30.0 5.7 30 2 2 -1 18.814 37.629 2.38845 41.4 4.2 4.2 5.7 31 2 2 0 19.448 38.895 2.31353 11.3 1.2 1.1 5.7 32 2 2 -2 19.484 38.967 2.30943 139.3 14.3 14.2 5.7 33 1 1 3 19.545 39.09 2.30247 60.1 6.1 6.1 5.7 34 2 1 -4 19.605 39.21 2.29571 74.0 7.6 7.5 5.7 35 1 2 -3 20.761 41.523 2.173 55.8 5.7 5.7 5.7 36 4 0 -1 20.898 41.797 2.1594 160.7 16.4 16.3 5.7 37 4 0 -3 20.966 41.932 2.15275 20.0 2.0 2.0 5.7 38 0 1 4 21.231 42.462 2.12711 22.3 2.3 2.3 5.7 39 2 2 1 21.286 42.571 2.12188 185.7 19.0 18.8 5.7 40 2 2 -3 21.352 42.704 2.11557 166.4 17.0 16.8 5.7 41 0 2 3 21.744 43.487 2.07929 157.8 16.2 16.0 5.7 42 2 0 3 22.14 44.28 2.04389 78.3 8.0 7.9 5.7 43 3 2 -1 22.244 44.489 2.03477 46.0 4.7 4.6 5.7 44 4 0 0 22.623 45.247 2.00243 58.0 5.9 5.9 5.7 45 1 0 -5 22.833 45.666 1.98503 17.9 1.8 1.8 5.7 46 3 0 -5 23.195 46.391 1.95569 19.2 2.0 1.9 5.7 47 2 1 3 23.617 47.234 1.92272 33.4 3.4 3.4 5.7 48 2 2 2 24.105 48.209 1.88607 90.1 9.2 9.1 5.7 49 2 2 -4 24.195 48.391 1.87943 218.4 22.4 22.0 5.7 50 1 1 -5 24.277 48.554 1.87348 32.3 3.3 3.2 5.7 51 3 1 2 24.466 48.933 1.85986 27.7 2.8 2.8 5.7 52 1 3 0 24.762 49.523 1.83905 17.1 1.8 1.7 5.7 53 0 2 4 25.588 51.175 1.78351 30.1 3.1 3.0 5.8 54 1 3 1 25.799 51.599 1.76986 15.8 1.6 1.6 5.8 55 5 0 -2 25.838 51.675 1.76741 48.3 4.9 4.8 5.8 56 0 1 5 26.17 52.34 1.74653 47.5 4.9 4.8 5.8 57 2 3 -1 26.301 52.603 1.73841 37.2 3.8 3.7 5.8 58 4 1 -5 26.823 53.646 1.70703 62.0 6.3 6.2 5.8 59 2 0 4 26.936 53.873 1.70039 15.0 1.5 1.5 5.8 60 2 0 -6 27.076 54.152 1.69229 31.8 3.3 3.2 5.8 61 5 1 -2 27.163 54.325 1.6873 23.8 2.4 2.4 5.8 62 5 1 -3 27.197 54.395 1.68531 20.5 2.1 2.0 5.8 63 3 0 -6 27.398 54.797 1.67388 32.3 3.3 3.2 5.8 64 1 3 -3 27.832 55.664 1.64984 112.8 11.5 11.2 5.8 65 1 0 5 27.973 55.946 1.6422 11.4 1.2 1.1 5.8 66 1 0 -6 28.048 56.096 1.63817 104.3 10.7 10.4 5.8 67 5 1 -1 28.11 56.22 1.63483 152.3 15.6 15.2 5.8 68 4 2 -4 28.207 56.414 1.62967 279.1 28.6 27.8 5.8 69 2 3 1 28.255 56.51 1.62713 16.0 1.6 1.6 5.8 70 2 1 -6 28.361 56.721 1.62157 13.8 1.4 1.4 5.8 71 3 2 2 28.448 56.896 1.617 53.5 5.5 5.3 5.8 72 0 3 3 28.628 57.256 1.60768 55.2 5.6 5.5 5.8 73 4 0 -6 28.986 57.973 1.58951 121.0 12.4 12.0 5.8 74 3 3 -1 29.04 58.08 1.58684 110.0 11.3 10.9 5.8 75 1 1 5 29.232 58.463 1.57734 60.6 6.2 6.0 5.8 76 5 1 0 29.978 59.957 1.54157 33.7 3.4 3.3 5.8 77 3 3 -3 30.02 60.04 1.53962 122.7 12.6 12.1 5.8 78 0 0 6 30.232 60.463 1.52987 14.4 1.5 1.4 5.8 79 4 2 -5 30.593 61.185 1.51352 29.5 3.0 2.9 5.8 80 6 0 -3 31.393 62.785 1.47875 13.3 1.4 1.3 5.9 81 5 2 -1 31.781 63.563 1.46252 13.2 1.4 1.3 5.9 82 3 0 4 31.899 63.797 1.45771 211.3 21.6 20.8 5.9 83 2 2 -6 32.014 64.029 1.453 45.2 4.6 4.4 5.9 84 3 2 -6 32.306 64.611 1.4413 94.5 9.7 9.3 5.9 85 4 0 3 32.877 65.754 1.41899 19.7 2.0 1.9 5.9 86 0 4 0 32.925 65.85 1.41715 243.2 24.9 23.9 5.9 87 3 1 -7 33.27 66.539 1.40413 69.2 7.1 6.8 5.9 88 2 1 -7 33.417 66.834 1.39866 14.8 1.5 1.4 5.9 89 5 2 0 33.527 67.054 1.3946 29.0 3.0 2.8 5.9 90 4 2 2 33.557 67.114 1.39351 168.0 17.2 16.5 5.9 91 2 3 3 33.722 67.445 1.38747 9.9 1.0 1.0 5.9 92 4 2 -6 33.753 67.505 1.38638 14.3 1.5 1.4 5.9 93 1 3 4 34.196 68.392 1.37054 20.5 2.1 2.0 5.9 94 4 1 -7 34.27 68.54 1.36794 30.4 3.1 3.0 5.9 95 1 4 -2 34.386 68.773 1.36388 13.3 1.4 1.3 5.9 96 0 2 6 34.901 69.802 1.34627 39.5 4.0 3.9 5.9 97 5 0 2 34.989 69.978 1.34331 25.6 2.6 2.5 5.9 98 2 4 -2 35.233 70.467 1.33518 21.3 2.2 2.1 5.9 99 6 2 -3 35.982 71.964 1.31104 15.6 1.6 1.5 5.9 100 1 4 2 36.075 72.15 1.30812 13.2 1.4 1.3 5.9 101 5 2 -6 36.288 72.575 1.3015 14.1 1.4 1.4 6.0 102 6 2 -2 36.37 72.74 1.29896 70.4 7.2 6.8 6.0 103 6 2 -4 36.441 72.882 1.29678 40.7 4.2 3.9 6.0 104 2 4 1 36.473 72.946 1.29581 11.0 1.1 1.1 6.0 105 5 3 -2 36.638 73.277 1.29076 29.5 3.0 2.9 6.0 106 0 1 7 37.08 74.159 1.27758 34.1 3.5 3.3 6.0 107 3 4 -2 37.179 74.357 1.27466 22.5 2.3 2.2 6.0 108 3 0 -8 37.303 74.606 1.27102 25.4 2.6 2.5 6.0 109 4 2 3 37.378 74.756 1.26885 43.4 4.4 4.2 6.0 110 5 3 -1 37.448 74.896 1.26682 64.3 6.6 6.2 6.0 111 4 0 4 37.568 75.136 1.26337 44.7 4.6 4.3 6.0 112 2 0 6 37.691 75.383 1.25984 16.1 1.6 1.5 6.0 113 6 2 -5 37.734 75.469 1.25863 44.7 4.6 4.3 6.0 114 2 0 -8 37.855 75.709 1.25522 15.5 1.6 1.5 6.0 115 3 4 0 37.978 75.957 1.25175 42.9 4.4 4.1 6.0 116 1 3 5 38.422 76.844 1.2395 31.1 3.2 3.0 6.0 117 2 4 2 38.55 77.1 1.23602 40.2 4.1 3.9 6.0 118 1 4 -4 38.621 77.242 1.2341 12.3 1.3 1.2 6.0 119 4 3 2 39.107 78.214 1.22117 42.8 4.4 4.1 6.0 120 6 1 -7 39.514 79.028 1.21063 35.0 3.6 3.4 6.0 121 6 2 0 39.629 79.257 1.2077 12.6 1.3 1.2 6.0 122 6 2 -6 39.835 79.67 1.20247 15.0 1.5 1.4 6.0 123 0 2 7 40.333 80.667 1.19011 22.5 2.3 2.1 6.1 124 4 4 -1 40.552 81.104 1.18479 24.5 2.5 2.3 6.1 125 7 1 -6 41.18 82.359 1.16989 10.4 1.1 1.0 6.1 126 2 4 3 41.408 82.816 1.1646 22.7 2.3 2.2 6.1 127 3 2 -8 41.619 83.239 1.15975 12.3 1.3 1.2 6.1 128 4 4 0 41.751 83.501 1.15677 13.5 1.4 1.3 6.1 129 7 2 -3 41.819 83.638 1.15523 13.3 1.4 1.3 6.1 130 4 2 4 41.877 83.754 1.15392 13.6 1.4 1.3 6.1 131 2 3 5 42.053 84.106 1.14998 32.6 3.3 3.1 6.1 132 3 4 -5 42.163 84.326 1.14754 36.6 3.7 3.5 6.1 133 6 3 -1 42.965 85.929 1.13019 12.9 1.3 1.2 6.1 134 0 1 8 43.231 86.462 1.12459 20.2 2.1 1.9 6.1 135 7 1 0 43.374 86.748 1.12162 26.3 2.7 2.5 6.1 136 7 1 -7 43.651 87.301 1.11593 25.8 2.6 2.4 6.2 137 5 2 -8 43.74 87.48 1.11411 46.1 4.7 4.3 6.2 138 5 4 -2 44.162 88.324 1.10562 21.8 2.2 2.0 6.2 139 4 1 -9 44.247 88.495 1.10393 36.8 3.8 3.4 6.2 140 8 0 -3 44.348 88.697 1.10194 26.9 2.7 2.5 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) |