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 *** *********************** KORNERUPINE 2, DN Mg(3.93)Al(5.90)Si(3.92)B(0.57)O(20.95)(OH)(1.05) Orthorhombic C mcm Z = 4 R =0.052 NR =1441 21 .12 .1992 Ref.Str.: Moore P.B., Araki T. (1979) * Neues Jb. Miner., Abh., 134, 3, 317-336 Reserv: T.V.Ush. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 16.016 alpha = 90.0 b = 13.758 beta = 90.0 c = 6.72 gamma = 90.0 Unit cell volume (cub. angs.) = 1480.74 Molar volume ( cub.cm/mol.) = 222.98 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.0 0.0 0.0 2.05 Mg = 0.32, Mg = 0.0 2 0.1212 0.141 0.25 0.81 Mg = 1.00 3 0.5 0.1463 0.25 0.66 Mg = 1.00 4 0.2154 0.0 0.0 0.41 Al = 1.00 5 0.3133 0.142 0.25 0.68 Al = 1.00 6 0.4083 0.0 0.0 0.41 Al = 1.00 7 0.4018 0.3528 0.25 0.44 Si = 1.00 8 0.1767 0.3339 0.25 0.67 Si = 1.00 9 0.0 0.3444 0.25 0.68 B = 0.56, Si = 0.44 10 0.2244 0.0453 0.25 0.5 O = 1.00 11 0.4031 0.047 0.25 0.46 O = 1.00 12 0.4016 0.2356 0.25 0.78 O = 1.00 13 0.1377 0.0999 0.9484 0.73 O = 1.00 14 0.2313 0.237 0.25 1.09 O = 1.00 15 0.3166 0.0959 0.9513 0.6 O = 1.00 16 0.0807 0.2848 0.25 0.94 O = 1.00 17 0.5 0.0888 0.943 0.6 O = 1.00 18 0.0 0.1134 0.75 1.16 O = 1.00 19 0.0 0.0874 0.25 0.81 OH = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.0 0.0 0.0 2 2 0.1212 0.141 0.25 3 3 0.5 0.1463 0.25 4 4 0.2154 0.0 0.0 5 5 0.3133 0.142 0.25 6 6 0.4083 0.0 0.0 7 7 0.4018 0.3528 0.25 8 8 0.1767 0.3339 0.25 9 9 0.0 0.3444 0.25 10 10 0.2244 0.0453 0.25 11 11 0.4031 0.047 0.25 12 12 0.4016 0.2356 0.25 13 13 0.1377 0.0999 0.9484 14 14 0.2313 0.237 0.25 15 15 0.3166 0.0959 0.9513 16 16 0.0807 0.2848 0.25 17 17 0.5 0.0888 0.943 18 18 0.0 0.1134 0.75 19 19 0.0 0.0874 0.25 20 1 0.0 0.0 0.5 21 2 0.8788 0.859 0.75 22 3 0.5 0.8537 0.75 23 4 0.7846 0.0 0.5 24 5 0.6867 0.858 0.75 25 6 0.5918 0.0 0.5 26 7 0.5982 0.6472 0.75 27 8 0.8233 0.6661 0.75 28 9 0.0 0.6556 0.75 29 10 0.7756 0.9547 0.75 30 11 0.5969 0.953 0.75 31 12 0.5984 0.7644 0.75 32 13 0.8623 0.9001 0.4484 33 14 0.7688 0.763 0.75 34 15 0.6834 0.9041 0.4513 35 16 0.9194 0.7152 0.75 36 17 0.5 0.9112 0.443 37 18 0.0 0.8866 0.25 38 19 0.0 0.9126 0.75 39 2 0.8788 0.141 0.25 40 4 0.7846 0.0 0.0 41 5 0.6867 0.142 0.25 42 6 0.5918 0.0 0.0 43 7 0.5982 0.3528 0.25 44 8 0.8233 0.3339 0.25 45 10 0.7756 0.0453 0.25 46 11 0.5969 0.047 0.25 47 12 0.5984 0.2356 0.25 48 13 0.8623 0.0999 0.9484 49 14 0.7688 0.237 0.25 50 15 0.6834 0.0959 0.9513 51 16 0.9194 0.2848 0.25 52 2 0.1212 0.859 0.75 53 4 0.2154 0.0 0.5 54 5 0.3133 0.858 0.75 55 6 0.4082 0.0 0.5 56 7 0.4018 0.6472 0.75 57 8 0.1767 0.6661 0.75 58 10 0.2244 0.9547 0.75 59 11 0.4031 0.953 0.75 60 12 0.4016 0.7644 0.75 61 13 0.1377 0.9001 0.4484 62 14 0.2312 0.763 0.75 63 15 0.3166 0.9041 0.4513 64 16 0.0806 0.7152 0.75 65 13 0.1377 0.0999 0.5516 66 15 0.3166 0.0959 0.5487 67 17 0.5 0.0888 0.557 68 13 0.8623 0.9001 0.0516 69 15 0.6834 0.9041 0.0487 70 17 0.5 0.9112 0.057 71 13 0.8623 0.0999 0.5516 72 15 0.6834 0.0959 0.5487 73 13 0.1377 0.9001 0.0516 74 15 0.3166 0.9041 0.0487 75 1 0.5 0.5 0.5 76 2 0.3788 0.359 0.75 77 3 0.0 0.3537 0.75 78 4 0.2846 0.5 0.5 79 5 0.1867 0.358 0.75 80 6 0.0917 0.5 0.5 81 7 0.0982 0.1472 0.75 82 8 0.3233 0.1661 0.75 83 9 0.5 0.1556 0.75 84 10 0.2756 0.4547 0.75 85 11 0.0969 0.453 0.75 86 12 0.0984 0.2644 0.75 87 13 0.3623 0.4001 0.4484 88 14 0.2688 0.263 0.75 89 15 0.1834 0.4041 0.4513 90 16 0.4193 0.2152 0.75 91 17 0.0 0.4112 0.443 92 18 0.5 0.3866 0.25 93 19 0.5 0.4126 0.75 94 1 0.5 0.5 0.0 95 2 0.6212 0.641 0.25 96 3 0.0 0.6463 0.25 97 4 0.7154 0.5 0.0 98 5 0.8133 0.642 0.25 99 6 0.9082 0.5 0.0 100 7 0.9018 0.8528 0.25 101 8 0.6767 0.8339 0.25 102 9 0.5 0.8444 0.25 103 10 0.7244 0.5453 0.25 104 11 0.9031 0.547 0.25 105 12 0.9016 0.7356 0.25 106 13 0.6377 0.5999 0.9484 107 14 0.7312 0.737 0.25 108 15 0.8166 0.5959 0.9513 109 16 0.5806 0.7848 0.25 110 17 0.0 0.5888 0.943 111 18 0.5 0.6134 0.75 112 19 0.5 0.5874 0.25 113 2 0.6212 0.359 0.75 114 4 0.7154 0.5 0.5 115 5 0.8133 0.358 0.75 116 6 0.9082 0.5 0.5 117 7 0.9018 0.1472 0.75 118 8 0.6767 0.1661 0.75 119 10 0.7244 0.4547 0.75 120 11 0.9031 0.453 0.75 121 12 0.9016 0.2644 0.75 122 13 0.6377 0.4001 0.4484 123 14 0.7312 0.263 0.75 124 15 0.8166 0.4041 0.4513 125 16 0.5806 0.2152 0.75 126 2 0.3788 0.641 0.25 127 4 0.2846 0.5 0.0 128 5 0.1867 0.642 0.25 129 6 0.0918 0.5 0.0 130 7 0.0982 0.8528 0.25 131 8 0.3233 0.8339 0.25 132 10 0.2756 0.5453 0.25 133 11 0.0969 0.547 0.25 134 12 0.0984 0.7356 0.25 135 13 0.3623 0.5999 0.9484 136 14 0.2688 0.737 0.25 137 15 0.1834 0.5959 0.9513 138 16 0.4194 0.7848 0.25 139 13 0.3623 0.4001 0.0516 140 15 0.1834 0.4041 0.0487 141 17 0.0 0.4112 0.057 142 13 0.6377 0.5999 0.5516 143 15 0.8166 0.5959 0.5487 144 17 0.0 0.5888 0.557 145 13 0.6377 0.4001 0.0516 146 15 0.8166 0.4041 0.0487 147 13 0.3623 0.5999 0.5516 148 15 0.1834 0.5959 0.5487 X-ray density (g/cm cub.) = 3.26 MU (1/cm) = 101.401 Mass attenuation coefficient (cm**2/g) = 31.136 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Mg ,Mg 2.568 4 2.2927 18 2.0656 19 2.2927 18 2.0656 19 2 Mg 2.568 6 2.1127 10 2.1204 13 2.2025 14 2.0826 16 2.0769 19 2.1204 13 3 Mg 2.568 6 2.0666 11 1.9979 12 2.2094 17 2.0666 11 1.9979 12 2.2094 17 4 Al 2.364 6 1.7976 10 1.8871 13 2.1151 15 1.7976 10 1.8871 13 2.1151 15 5 Al 2.364 6 1.9487 10 1.9434 11 1.9133 12 1.8537 14 2.1058 15 2.1058 15 6 Al 2.364 6 1.8021 11 2.0015 15 1.9487 17 1.8021 11 1.9487 17 2.0015 15 7 Si 2.148 4 1.6127 12 1.6121 13 1.6406 18 1.6121 13 8 Si 2.148 4 1.5938 14 1.6794 16 1.6654 15 1.6654 15 9 B ,Si 2.148 4 1.5303 16 1.5303 16 1.5897 17 1.5897 17 10 O 3.312 10 2.863 11 2.5695 13 2.6398 14 2.5874 15 2.7747 13 2.7898 15 2.5695 13 2.5874 15 2.7747 13 2.7898 15 11 O 3.312 11 2.863 10 2.5946 12 2.5311 15 2.6441 17 2.7531 17 3.1023 11 2.7607 15 2.5311 15 2.6441 17 2.7531 17 2.7607 15 12 O 3.312 10 2.5946 11 2.729 14 3.0951 15 3.2891 17 3.1507 12 3.0951 15 3.2891 17 2.7006 13 2.6071 18 2.7006 13 13 O 3.312 9 2.5695 10 3.1481 14 2.8657 15 2.5833 18 2.9999 19 2.7747 10 2.6665 13 2.8358 13 2.7006 12 14 O 3.312 9 2.6398 10 2.729 12 3.1481 13 3.1086 15 2.5 16 3.1481 13 3.1086 15 2.7745 15 2.7745 15 15 O 3.312 12 2.5874 10 2.5311 11 3.0951 12 2.8657 13 3.1086 14 2.9401 17 2.7898 10 2.7607 11 2.7048 15 2.72 15 2.7745 14 2.6892 16 16 O 3.312 7 2.5 14 3.0079 19 2.5834 16 2.6892 15 2.5253 17 2.6892 15 2.5253 17 17 O 3.312 12 2.6441 11 3.2891 12 2.9401 15 2.7531 11 2.6441 11 3.2891 12 2.9401 15 2.7531 11 2.5943 17 2.5598 17 2.5253 16 2.5253 16 18 O 3.312 7 2.5833 13 2.7619 19 2.5833 13 2.5833 13 2.5833 13 2.6071 12 2.6071 12 19 OH 3.36 7 2.9999 13 3.0079 16 2.7619 18 2.9999 13 3.0079 16 2.9999 13 2.9999 13 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 4.233 8.466 0.048 364.14 4 83.3 460.4 2 2 0 0 5.52 11.039 0.062 213.19 2 73.0 103.6 3 0 2 0 6.429 12.858 0.073 156.54 2 118.0 198.7 4 1 1 1 7.836 15.671 0.088 104.66 8 16.1 9.8 5 2 2 0 8.489 16.978 0.096 88.84 4 33.7 18.4 6 3 1 0 8.903 17.806 0.1 80.57 4 25.0 9.2 7 0 2 1 9.221 18.442 0.104 74.96 4 25.9 9.2 8 1 3 0 10.062 20.124 0.113 62.61 4 33.4 12.8 9 2 2 1 10.772 21.543 0.121 54.36 8 53.1 55.8 10 4 0 0 11.092 22.183 0.125 51.14 2 122.1 69.5 11 3 1 1 11.104 22.208 0.125 51.02 8 42.4 33.5 12 1 3 1 12.061 24.123 0.136 42.93 8 37.2 21.7 13 3 3 0 12.793 25.586 0.144 37.93 4 62.4 26.9 14 4 2 0 12.861 25.723 0.144 37.5 4 57.5 22.6 15 0 4 0 12.941 25.882 0.145 37.02 2 202.2 138.0 16 0 0 2 13.253 26.506 0.149 35.2 2 324.8 338.7 17 1 1 2 13.936 27.872 0.156 31.64 8 52.6 32.0 18 2 4 0 14.107 28.214 0.158 30.83 4 62.8 22.2 19 5 1 0 14.294 28.589 0.16 29.98 4 49.9 13.6 20 2 0 2 14.395 28.791 0.161 29.53 4 60.1 19.4 21 3 3 1 14.438 28.876 0.162 29.35 8 22.1 5.2 22 4 2 1 14.5 28.999 0.163 29.08 8 45.0 21.5 23 0 4 1 14.571 29.142 0.163 28.78 4 110.9 64.6 24 0 2 2 14.782 29.563 0.166 27.91 4 396.2 799.2 25 2 4 1 15.625 31.25 0.175 24.77 8 8.8 0.7 26 5 1 1 15.796 31.592 0.177 24.2 8 96.7 82.6 27 2 2 2 15.823 31.646 0.177 24.11 8 39.9 14.0 28 3 1 2 16.057 32.115 0.18 23.36 8 78.0 51.8 29 1 5 0 16.501 33.003 0.184 22.02 4 140.4 79.2 30 1 3 2 16.752 33.505 0.187 21.31 8 51.4 20.5 31 6 0 0 16.772 33.544 0.187 21.26 2 51.8 5.2 32 5 3 0 17.057 34.114 0.19 20.49 4 478.0 854.0 33 4 4 0 17.172 34.343 0.192 20.19 4 98.6 35.8 34 4 0 2 17.414 34.828 0.194 19.59 4 31.6 3.6 35 1 5 1 17.836 35.672 0.199 18.59 8 9.4 0.6 36 6 2 0 18.031 36.062 0.201 18.15 4 1.7 0.0 37 5 3 1 18.356 36.712 0.204 17.45 8 37.3 8.9 38 3 5 0 18.357 36.714 0.204 17.45 4 0.6 0.0 39 4 4 1 18.464 36.928 0.206 17.23 8 21.4 2.9 40 3 3 2 18.586 37.172 0.207 16.98 8 22.2 3.1 41 4 2 2 18.635 37.27 0.207 16.88 8 50.6 15.7 42 0 4 2 18.692 37.384 0.208 16.77 4 196.2 117.8 43 6 2 1 19.273 38.546 0.214 15.67 8 19.3 2.1 44 2 4 2 19.549 39.097 0.217 15.19 8 51.9 14.9 45 3 5 1 19.581 39.163 0.218 15.13 8 41.5 9.5 46 0 6 0 19.629 39.258 0.218 15.05 2 99.9 13.7 47 5 1 2 19.69 39.379 0.219 14.95 8 111.1 67.3 48 7 1 0 19.955 39.91 0.222 14.51 4 35.6 3.4 49 2 6 0 20.452 40.905 0.227 13.73 4 25.1 1.6 50 1 1 3 20.592 41.184 0.228 13.53 8 25.3 3.2 51 0 6 1 20.79 41.58 0.23 13.24 4 51.1 6.3 52 7 1 1 21.101 42.203 0.234 12.81 8 1.2 0.0 53 0 2 3 21.201 42.403 0.235 12.67 4 199.6 92.1 54 1 5 2 21.408 42.817 0.237 12.4 8 85.9 33.4 55 6 4 0 21.424 42.849 0.237 12.38 4 370.6 310.1 56 2 6 1 21.577 43.153 0.239 12.18 8 9.5 0.4 57 6 0 2 21.626 43.252 0.239 12.12 4 53.4 6.3 58 5 5 0 21.657 43.313 0.24 12.08 4 305.5 205.8 59 5 3 2 21.856 43.713 0.242 11.84 8 107.4 49.8 60 4 4 2 21.95 43.899 0.243 11.72 8 0.7 0.0 61 2 2 3 21.976 43.952 0.243 11.69 8 60.1 15.4 62 7 3 0 22.101 44.201 0.244 11.54 4 52.8 5.9 63 3 1 3 22.154 44.308 0.245 11.48 8 57.4 13.8 64 6 4 1 22.509 45.019 0.249 11.08 8 72.0 21.0 65 8 0 0 22.629 45.257 0.25 10.94 2 78.6 6.2 66 6 2 2 22.655 45.31 0.25 10.92 8 51.0 10.4 67 1 3 3 22.688 45.376 0.25 10.88 8 53.6 11.4 68 5 5 1 22.733 45.466 0.251 10.83 8 125.2 61.9 69 4 6 0 22.775 45.55 0.251 10.79 4 43.8 3.8 70 3 5 2 22.926 45.851 0.253 10.63 8 3.7 0.1 71 7 3 1 23.16 46.321 0.255 10.38 8 44.9 7.6 72 1 7 0 23.257 46.514 0.256 10.29 4 54.2 5.5 73 8 2 0 23.623 47.246 0.26 9.93 4 25.6 1.2 74 4 6 1 23.811 47.623 0.262 9.75 8 19.8 1.4 75 0 6 2 23.998 47.995 0.264 9.58 4 109.6 21.0 76 3 3 3 24.142 48.284 0.265 9.45 8 20.7 1.5 77 4 2 3 24.182 48.363 0.266 9.42 8 5.7 0.1 78 0 4 3 24.228 48.456 0.266 9.38 4 216.1 79.9 79 7 1 2 24.276 48.552 0.267 9.33 8 9.7 0.3 80 1 7 1 24.277 48.555 0.267 9.33 8 18.7 1.2 81 8 2 1 24.632 49.264 0.271 9.03 8 54.1 9.6 82 3 7 0 24.685 49.37 0.271 8.99 4 22.9 0.9 83 2 6 2 24.703 49.406 0.271 8.97 8 8.0 0.2 84 2 4 3 24.929 49.858 0.274 8.79 8 3.1 0.0 85 5 1 3 25.045 50.09 0.275 8.69 8 7.6 0.2 86 6 4 2 25.547 51.094 0.28 8.31 8 33.4 3.4 87 3 7 1 25.663 51.326 0.281 8.23 8 53.9 8.7 88 5 5 2 25.75 51.501 0.282 8.16 8 186.4 103.4 89 9 1 0 25.878 51.756 0.283 8.07 4 160.2 37.8 90 7 5 0 25.966 51.933 0.284 8.01 4 87.7 11.2 91 7 3 2 26.141 52.281 0.286 7.89 8 21.0 1.3 92 6 6 0 26.286 52.572 0.287 7.79 4 54.2 4.2 93 8 4 0 26.435 52.87 0.289 7.69 4 48.5 3.3 94 1 5 3 26.488 52.977 0.29 7.65 8 6.7 0.1 95 8 0 2 26.607 53.215 0.291 7.58 4 49.2 3.4 96 0 8 0 26.609 53.218 0.291 7.57 2 253.8 44.5 97 4 6 2 26.737 53.475 0.292 7.49 8 98.1 26.3 98 9 1 1 26.824 53.649 0.293 7.44 8 38.6 4.0 99 5 3 3 26.871 53.742 0.293 7.41 8 100.5 27.3 100 7 5 1 26.911 53.821 0.294 7.38 8 94.3 23.9 101 4 4 3 26.951 53.902 0.294 7.36 8 33.3 3.0 102 1 7 2 27.167 54.333 0.296 7.22 8 67.5 12.0 103 6 6 1 27.222 54.445 0.297 7.19 8 92.1 22.3 104 2 8 0 27.265 54.531 0.297 7.17 4 21.7 0.6 105 0 0 4 27.29 54.581 0.298 7.15 2 658.1 282.5 106 8 4 1 27.368 54.736 0.298 7.1 8 45.3 5.3 107 5 7 0 27.375 54.749 0.298 7.1 4 138.4 24.8 108 8 2 2 27.494 54.989 0.3 7.03 8 27.4 1.9 109 0 8 1 27.538 55.076 0.3 7.01 4 58.3 4.3 110 6 2 3 27.559 55.118 0.3 6.99 8 110.5 31.2 111 9 3 0 27.665 55.329 0.301 6.93 4 94.9 11.4 112 1 1 4 27.672 55.343 0.301 6.93 8 34.9 3.1 113 3 5 3 27.794 55.588 0.303 6.86 8 29.0 2.1 114 2 0 4 27.936 55.871 0.304 6.78 4 37.2 1.7 115 0 2 4 28.163 56.325 0.306 6.66 4 33.8 1.4 116 2 8 1 28.18 56.359 0.307 6.65 8 8.2 0.2 117 5 7 1 28.286 56.573 0.308 6.59 8 49.7 5.9 118 3 7 2 28.451 56.903 0.309 6.51 8 0.2 0.0 119 9 3 1 28.57 57.14 0.31 6.44 8 17.2 0.7 120 0 6 3 28.733 57.466 0.312 6.36 4 46.1 2.5 121 10 0 0 28.747 57.494 0.312 6.35 2 371.0 79.8 122 2 2 4 28.795 57.59 0.313 6.33 8 22.3 1.2 123 3 1 4 28.941 57.883 0.314 6.26 8 3.4 0.0 124 7 1 3 28.979 57.957 0.314 6.24 8 36.0 3.0 125 4 8 0 29.174 58.349 0.316 6.15 4 44.6 2.2 126 2 6 3 29.357 58.715 0.318 6.06 8 15.8 0.6 127 1 3 4 29.384 58.768 0.318 6.05 8 23.4 1.2 128 9 1 2 29.538 59.076 0.32 5.98 8 62.1 8.4 129 10 2 0 29.591 59.182 0.321 5.95 4 66.6 4.8 130 7 5 2 29.619 59.238 0.321 5.94 8 26.0 1.5 131 4 0 4 29.816 59.633 0.323 5.85 4 63.7 4.3 132 6 6 2 29.912 59.824 0.324 5.81 8 245.3 127.6 133 8 4 2 30.049 60.099 0.325 5.75 8 5.7 0.1 134 4 8 1 30.051 60.101 0.325 5.75 8 1.5 0.0 135 6 4 3 30.111 60.221 0.326 5.73 8 24.5 1.3 136 0 8 2 30.209 60.419 0.327 5.68 4 47.7 2.4 137 5 5 3 30.293 60.586 0.327 5.65 8 74.4 11.4 138 1 9 0 30.41 60.819 0.329 5.6 4 1.5 0.0 139 10 2 1 30.46 60.92 0.329 5.58 8 4.8 0.0 140 3 3 4 30.608 61.217 0.331 5.52 8 49.1 4.9 141 4 2 4 30.642 61.285 0.331 5.51 8 39.0 3.1 142 7 3 3 30.644 61.289 0.331 5.51 8 74.1 11.0 143 0 4 4 30.682 61.364 0.331 5.49 4 53.0 2.8 144 8 6 0 30.715 61.43 0.332 5.48 4 70.5 5.0 145 2 8 2 30.815 61.631 0.333 5.44 8 49.2 4.8 146 5 7 2 30.917 61.833 0.334 5.4 8 448.8 396.7 147 9 5 0 31.03 62.06 0.335 5.36 4 9.0 0.1 148 7 7 0 31.108 62.217 0.335 5.33 4 55.7 3.0 149 4 6 3 31.184 62.368 0.336 5.3 8 44.1 3.8 150 9 3 2 31.185 62.371 0.336 5.3 8 147.2 41.9 151 1 9 1 31.265 62.53 0.337 5.27 8 94.8 17.3 152 2 4 4 31.282 62.565 0.337 5.26 8 47.6 4.3 153 5 1 4 31.383 62.766 0.338 5.22 8 26.2 1.3 154 8 6 1 31.565 63.131 0.34 5.16 8 49.9 4.7 155 1 7 3 31.574 63.148 0.34 5.15 8 22.6 1.0 156 3 9 0 31.61 63.221 0.34 5.14 4 43.6 1.8 157 8 2 3 31.873 63.746 0.343 5.05 8 67.0 8.3 158 9 5 1 31.876 63.751 0.343 5.05 8 54.9 5.6 159 7 7 1 31.953 63.906 0.344 5.02 8 23.0 1.0 160 10 4 0 32.041 64.082 0.344 4.99 4 38.7 1.4 161 11 1 0 32.14 64.28 0.345 4.96 4 306.5 85.0 162 10 0 2 32.194 64.388 0.346 4.94 4 135.2 16.5 163 6 8 0 32.196 64.391 0.346 4.94 4 65.7 3.9 164 3 9 1 32.448 64.895 0.348 4.86 8 8.3 0.1 165 4 8 2 32.594 65.188 0.35 4.81 8 12.9 0.3 166 1 5 4 32.64 65.279 0.35 4.8 8 101.2 17.9 167 3 7 3 32.751 65.501 0.351 4.76 8 25.1 1.1 168 6 0 4 32.803 65.606 0.352 4.75 4 38.0 1.2 169 10 4 1 32.872 65.745 0.352 4.72 8 42.2 3.1 170 11 1 1 32.97 65.94 0.353 4.69 8 80.7 11.2 171 5 3 4 32.977 65.953 0.353 4.69 8 336.1 193.3 172 10 2 2 32.986 65.971 0.353 4.69 8 131.9 29.8 173 6 8 1 33.025 66.049 0.354 4.68 8 25.6 1.1 174 4 4 4 33.047 66.095 0.354 4.67 8 53.2 4.8 175 6 2 4 33.587 67.174 0.359 4.51 8 49.0 4.0 176 11 3 0 33.715 67.43 0.36 4.48 4 38.3 1.2 177 9 1 3 33.755 67.511 0.361 4.47 8 31.3 1.6 178 1 9 2 33.757 67.514 0.361 4.47 8 48.5 3.8 179 3 5 4 33.796 67.593 0.361 4.45 8 19.1 0.6 180 7 5 3 33.83 67.661 0.361 4.44 8 90.1 13.2 181 5 9 0 33.94 67.881 0.362 4.41 4 186.1 27.9 182 8 6 2 34.046 68.092 0.363 4.39 8 26.6 1.1 183 0 10 0 34.047 68.095 0.363 4.39 2 31.7 0.4 184 6 6 3 34.103 68.206 0.364 4.37 8 122.6 24.0 185 8 4 3 34.231 68.462 0.365 4.34 8 23.3 0.9 186 9 5 2 34.344 68.688 0.366 4.31 8 37.9 2.3 187 0 8 3 34.38 68.761 0.367 4.3 4 95.7 7.2 188 7 7 2 34.419 68.838 0.367 4.29 8 19.4 0.6 189 11 3 1 34.526 69.051 0.368 4.26 8 26.6 1.1 190 2 10 0 34.616 69.233 0.369 4.24 4 3.7 0.0 191 0 6 4 34.638 69.276 0.369 4.23 4 208.2 33.5 192 5 9 1 34.748 69.497 0.37 4.21 8 25.1 1.0 193 0 10 1 34.854 69.709 0.371 4.18 4 121.1 11.2 194 7 1 4 34.86 69.72 0.371 4.18 8 2.4 0.0 195 3 9 2 34.896 69.791 0.371 4.17 8 11.7 0.2 196 2 8 3 34.947 69.894 0.372 4.16 8 6.5 0.1 197 5 7 3 35.042 70.083 0.373 4.13 8 127.3 24.4 198 2 6 4 35.203 70.406 0.374 4.1 8 26.7 1.1 199 12 0 0 35.249 70.498 0.375 4.09 2 141.8 7.5 200 9 3 3 35.294 70.588 0.375 4.08 8 18.2 0.5 201 1 1 5 35.3 70.6 0.375 4.07 8 8.8 0.1 202 10 4 2 35.306 70.612 0.375 4.07 8 196.6 57.4 203 11 1 2 35.4 70.801 0.376 4.05 8 64.3 6.1 204 2 10 1 35.417 70.835 0.376 4.05 8 76.2 8.6 205 6 8 2 35.453 70.906 0.377 4.04 8 47.5 3.3 206 9 7 0 35.726 71.453 0.379 3.98 4 114.8 9.6 207 0 2 5 35.73 71.459 0.379 3.98 4 83.5 5.1 208 6 4 4 35.889 71.778 0.381 3.94 8 201.1 58.2 209 10 6 0 35.919 71.839 0.381 3.94 4 138.3 13.7 210 12 2 0 36.008 72.016 0.382 3.92 4 43.1 1.3 211 5 5 4 36.056 72.111 0.382 3.91 8 150.7 32.4 212 8 8 0 36.19 72.381 0.383 3.88 4 45.2 1.4 213 2 2 5 36.287 72.574 0.384 3.86 8 13.4 0.3 214 4 10 0 36.3 72.599 0.384 3.86 4 35.2 0.9 215 7 3 4 36.378 72.755 0.385 3.84 8 20.8 0.6 216 3 1 5 36.417 72.833 0.385 3.83 8 19.0 0.5 217 9 7 1 36.517 73.034 0.386 3.81 8 36.6 1.9 218 4 8 3 36.623 73.247 0.387 3.79 8 29.6 1.2 219 10 6 1 36.708 73.416 0.388 3.78 8 22.0 0.7 220 11 5 0 36.765 73.53 0.389 3.76 4 39.2 1.1 221 8 0 4 36.766 73.532 0.389 3.76 4 24.8 0.4 222 12 2 1 36.796 73.592 0.389 3.76 8 98.4 13.3 223 1 3 5 36.81 73.62 0.389 3.76 8 12.6 0.2 224 4 6 4 36.875 73.749 0.39 3.74 8 44.4 2.7 225 11 3 2 36.909 73.817 0.39 3.74 8 152.7 31.8 226 8 8 1 36.977 73.954 0.39 3.72 8 12.7 0.2 227 10 2 3 36.995 73.99 0.391 3.72 8 15.6 0.3 228 4 10 1 37.085 74.17 0.391 3.7 8 19.9 0.5 229 5 9 2 37.125 74.251 0.392 3.7 8 52.0 3.6 230 0 10 2 37.228 74.457 0.393 3.68 4 447.1 134.1 231 1 7 4 37.235 74.47 0.393 3.68 8 15.5 0.3 232 7 9 0 37.301 74.603 0.393 3.66 4 85.8 4.9 233 8 2 4 37.512 75.025 0.395 3.63 8 9.8 0.1 234 11 5 1 37.547 75.094 0.396 3.62 8 21.9 0.6 235 1 9 3 37.73 75.46 0.397 3.59 8 59.3 4.6 236 2 10 2 37.777 75.555 0.398 3.58 8 71.4 6.7 237 3 3 5 37.909 75.818 0.399 3.56 8 21.7 0.6 238 4 2 5 37.94 75.88 0.399 3.55 8 45.3 2.7 239 0 4 5 37.976 75.951 0.399 3.55 4 13.0 0.1 240 8 6 3 38.006 76.011 0.4 3.54 8 34.6 1.5 241 7 9 1 38.079 76.159 0.4 3.53 8 36.3 1.7 242 1 11 0 38.151 76.303 0.401 3.52 4 27.9 0.5 243 12 4 0 38.248 76.495 0.402 3.5 4 24.7 0.4 244 9 5 3 38.291 76.582 0.402 3.5 8 43.0 2.4 245 3 7 4 38.33 76.66 0.403 3.49 8 27.5 1.0 246 7 7 3 38.363 76.725 0.403 3.49 8 16.7 0.4 247 12 0 2 38.389 76.778 0.403 3.48 4 107.9 7.4 248 2 4 5 38.521 77.042 0.404 3.46 8 7.1 0.1 249 5 1 5 38.612 77.224 0.405 3.45 8 78.5 7.7 250 3 9 3 38.82 77.64 0.407 3.42 8 12.0 0.2 251 9 7 2 38.852 77.703 0.407 3.41 8 45.1 2.5 252 13 1 0 38.883 77.766 0.407 3.41 4 37.2 0.9 253 1 11 1 38.924 77.847 0.408 3.4 8 12.9 0.2 254 12 4 1 39.019 78.039 0.409 3.39 8 76.3 7.2 255 10 6 2 39.039 78.078 0.409 3.38 8 2.3 0.0 256 6 10 0 39.04 78.081 0.409 3.38 4 24.8 0.4 257 12 2 2 39.125 78.25 0.41 3.37 8 57.6 4.1 258 10 4 3 39.215 78.429 0.41 3.36 8 53.5 3.5 259 3 11 0 39.238 78.476 0.411 3.36 4 27.7 0.5 260 9 1 4 39.273 78.547 0.411 3.35 8 119.0 17.3 261 8 8 2 39.302 78.604 0.411 3.35 8 56.7 3.9 262 11 1 3 39.306 78.611 0.411 3.35 8 138.0 23.2 263 7 5 4 39.344 78.689 0.412 3.34 8 42.7 2.2 264 6 8 3 39.356 78.713 0.412 3.34 8 61.5 4.6 265 4 10 2 39.408 78.817 0.412 3.33 8 76.0 7.0 266 6 6 4 39.602 79.204 0.414 3.31 8 12.3 0.2 267 13 1 1 39.651 79.302 0.414 3.3 8 36.3 1.6 268 8 4 4 39.723 79.445 0.415 3.29 8 22.6 0.6 269 1 5 5 39.766 79.531 0.415 3.28 8 17.4 0.4 270 6 10 1 39.808 79.615 0.416 3.28 8 51.0 3.1 271 11 5 2 39.862 79.724 0.416 3.27 8 64.1 4.9 272 0 8 4 39.864 79.728 0.416 3.27 4 185.6 20.6 273 3 11 1 40.004 80.008 0.417 3.25 8 16.7 0.3 274 5 3 5 40.078 80.155 0.418 3.25 8 62.8 4.7 275 4 4 5 40.143 80.286 0.418 3.24 8 9.4 0.1 276 13 3 0 40.346 80.691 0.42 3.21 4 31.0 0.6 277 7 9 2 40.385 80.77 0.421 3.21 8 48.5 2.7 278 2 8 4 40.402 80.804 0.421 3.21 8 8.2 0.1 279 5 7 4 40.492 80.984 0.421 3.2 8 130.9 20.0 280 6 2 5 40.645 81.29 0.423 3.18 8 43.7 2.2 281 9 3 4 40.732 81.465 0.424 3.17 8 71.9 6.0 282 11 3 3 40.764 81.529 0.424 3.16 8 138.3 22.1 283 3 5 5 40.84 81.681 0.424 3.16 8 24.8 0.7 284 5 9 3 40.975 81.95 0.426 3.14 8 42.6 2.1 285 0 10 3 41.075 82.15 0.427 3.13 4 78.7 3.5 286 10 8 0 41.087 82.175 0.427 3.13 4 121.7 8.5 287 13 3 1 41.107 82.214 0.427 3.13 8 24.4 0.7 288 11 7 0 41.177 82.355 0.427 3.12 4 63.1 2.3 289 1 11 2 41.217 82.433 0.428 3.12 8 49.1 2.7 290 12 4 2 41.311 82.622 0.429 3.11 8 24.4 0.7 291 5 11 0 41.388 82.775 0.429 3.1 4 82.8 3.9 292 2 10 3 41.61 83.219 0.431 3.08 8 74.3 6.2 293 9 9 0 41.627 83.254 0.431 3.07 4 1.5 0.0 294 0 6 5 41.63 83.26 0.431 3.07 4 49.1 1.4 295 10 0 4 41.642 83.284 0.431 3.07 4 271.0 41.2 296 7 1 5 41.839 83.679 0.433 3.05 8 2.8 0.0 297 10 8 1 41.846 83.692 0.433 3.05 8 4.0 0.0 298 12 6 0 41.896 83.792 0.433 3.05 4 23.0 0.3 299 13 1 2 41.935 83.869 0.434 3.04 8 1.4 0.0 300 11 7 1 41.936 83.871 0.434 3.04 8 7.8 0.1 301 4 8 4 42.006 84.013 0.434 3.04 8 22.0 0.5 302 6 10 2 42.089 84.179 0.435 3.03 8 13.6 0.2 303 5 11 1 42.145 84.29 0.436 3.03 8 79.1 6.9 304 2 6 5 42.163 84.327 0.436 3.02 8 5.1 0.0 305 0 12 0 42.21 84.421 0.436 3.02 2 161.9 7.2 306 3 11 2 42.284 84.568 0.437 3.01 8 77.4 6.6 307 14 0 0 42.324 84.648 0.437 3.01 2 19.0 0.1 308 10 2 4 42.365 84.729 0.437 3.01 8 45.1 2.2 309 9 9 1 42.384 84.768 0.438 3.0 8 2.5 0.0 310 12 6 1 42.652 85.304 0.44 2.98 8 33.7 1.2 311 9 7 3 42.66 85.32 0.44 2.98 8 41.8 1.9 312 2 12 0 42.742 85.485 0.441 2.97 4 28.1 0.4 313 8 10 0 42.792 85.584 0.441 2.97 4 27.2 0.4 314 6 4 5 42.815 85.629 0.441 2.97 8 67.6 4.9 315 10 6 3 42.844 85.688 0.441 2.97 8 23.0 0.6 316 12 2 3 42.928 85.856 0.442 2.96 8 78.1 6.6 317 0 12 1 42.966 85.932 0.442 2.96 4 100.8 5.5 318 5 5 5 42.974 85.948 0.442 2.96 8 64.4 4.5 319 14 2 0 43.045 86.089 0.443 2.95 4 88.6 4.2 320 1 9 4 43.076 86.151 0.443 2.95 8 3.4 0.0 321 8 8 3 43.102 86.205 0.444 2.95 8 3.5 0.0 322 4 10 3 43.207 86.414 0.444 2.94 8 31.3 1.0 323 13 5 0 43.238 86.477 0.445 2.94 4 30.2 0.5 324 7 3 5 43.281 86.563 0.445 2.93 8 10.3 0.1 325 8 6 4 43.344 86.687 0.446 2.93 8 40.9 1.8 326 13 3 2 43.376 86.753 0.446 2.93 8 36.7 1.4 327 0 0 6 43.452 86.905 0.446 2.92 2 264.6 18.7 328 2 12 1 43.497 86.994 0.447 2.92 8 51.6 2.8 329 8 10 1 43.546 87.093 0.447 2.91 8 18.7 0.4 330 9 5 4 43.621 87.243 0.448 2.91 8 11.8 0.1 331 11 5 3 43.653 87.306 0.448 2.91 8 8.1 0.1 332 7 7 4 43.691 87.382 0.448 2.9 8 45.2 2.2 333 4 6 5 43.758 87.516 0.449 2.9 8 6.7 0.0 334 1 1 6 43.765 87.53 0.449 2.9 8 18.2 0.4 335 14 2 1 43.799 87.597 0.449 2.9 8 23.5 0.6 336 2 0 6 43.983 87.966 0.451 2.89 4 16.9 0.2 337 13 5 1 43.992 87.984 0.451 2.88 8 56.7 3.4 338 1 7 5 44.105 88.21 0.452 2.88 8 10.4 0.1 339 10 8 2 44.111 88.221 0.452 2.88 8 10.9 0.1 340 3 9 4 44.137 88.275 0.452 2.88 8 29.9 0.9 341 7 9 3 44.169 88.338 0.452 2.87 8 24.7 0.6 342 0 2 6 44.171 88.343 0.452 2.87 4 165.7 14.4 343 11 7 2 44.2 88.399 0.453 2.87 8 10.8 0.1 344 4 12 0 44.335 88.67 0.454 2.86 4 25.1 0.3 345 8 2 5 44.372 88.745 0.454 2.86 8 26.5 0.7 346 5 11 2 44.408 88.817 0.454 2.86 8 5.6 0.0 347 10 4 4 44.523 89.047 0.455 2.85 8 27.6 0.8 348 7 11 0 44.578 89.156 0.456 2.85 4 11.3 0.1 349 11 1 4 44.613 89.225 0.456 2.85 8 175.4 32.0 350 9 9 2 44.646 89.292 0.456 2.85 8 72.6 5.5 351 6 8 4 44.662 89.325 0.456 2.85 8 58.5 3.6 352 2 2 6 44.702 89.403 0.457 2.84 8 23.5 0.6 353 3 1 6 44.825 89.651 0.458 2.84 8 21.6 0.5 354 12 6 2 44.913 89.826 0.458 2.83 8 38.5 1.5 355 1 11 3 44.992 89.983 0.459 2.83 8 24.9 0.6 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 1 1 0 4.233 8.466 10.43619 460.4 53.9 54.9 5.6 2 2 0 0 5.52 11.039 8.008 103.6 12.1 12.3 5.6 3 0 2 0 6.429 12.858 6.879 198.7 23.3 23.6 5.6 4 1 1 1 7.836 15.671 5.65 9.8 1.2 1.2 5.6 5 2 2 0 8.489 16.978 5.21809 18.4 2.2 2.2 5.6 6 3 1 0 8.903 17.806 4.97709 9.2 1.1 1.1 5.6 7 0 2 1 9.221 18.442 4.80699 9.2 1.1 1.1 5.6 8 1 3 0 10.062 20.124 4.40882 12.8 1.5 1.5 5.6 9 2 2 1 10.772 21.543 4.12146 55.8 6.5 6.6 5.6 10 4 0 0 11.092 22.183 4.004 103.0 12.1 12.2 5.6 11 1 3 1 12.061 24.123 3.68628 21.7 2.5 2.6 5.6 12 3 3 0 12.793 25.586 3.47873 26.9 3.2 3.2 5.6 13 4 2 0 12.861 25.723 3.46048 22.6 2.7 2.7 5.6 14 0 4 0 12.941 25.882 3.4395 138.0 16.2 16.3 5.6 15 0 0 2 13.253 26.506 3.36 338.7 39.7 39.9 5.6 16 1 1 2 13.936 27.872 3.19832 32.0 3.7 3.8 5.6 17 2 4 0 14.107 28.214 3.16033 22.2 2.6 2.6 5.6 18 5 1 0 14.294 28.589 3.11976 13.6 1.6 1.6 5.6 19 2 0 2 14.395 28.791 3.09832 19.4 2.3 2.3 5.6 20 4 2 1 14.5 28.999 3.07653 21.5 2.5 2.5 5.6 21 0 4 1 14.571 29.142 3.06176 64.6 7.6 7.6 5.6 22 0 2 2 14.782 29.563 3.0191 799.2 93.6 93.9 5.6 23 5 1 1 15.796 31.592 2.82969 96.6 11.3 11.3 5.6 24 3 1 2 16.057 32.115 2.78481 51.8 6.1 6.1 5.6 25 1 5 0 16.501 33.003 2.71187 79.2 9.3 9.3 5.6 26 1 3 2 16.752 33.505 2.67239 25.7 3.0 3.0 5.7 27 5 3 0 17.057 34.114 2.62605 854.0 100.0 100.0 5.7 28 4 4 0 17.172 34.343 2.60905 35.8 4.2 4.2 5.7 29 5 3 1 18.356 36.712 2.44592 8.9 1.0 1.0 5.7 30 4 2 2 18.635 37.27 2.41062 15.7 1.8 1.8 5.7 31 0 4 2 18.692 37.384 2.40349 117.8 13.8 13.8 5.7 32 2 4 2 19.549 39.097 2.30204 14.9 1.7 1.7 5.7 33 3 5 1 19.581 39.163 2.29835 9.5 1.1 1.1 5.7 34 0 6 0 19.629 39.258 2.293 13.7 1.6 1.6 5.7 35 5 1 2 19.69 39.379 2.28622 67.3 7.9 7.8 5.7 36 0 2 3 21.201 42.403 2.12992 92.1 10.8 10.7 5.7 37 6 4 0 21.424 42.849 2.10878 343.5 40.2 39.9 5.7 38 5 5 0 21.657 43.313 2.08724 205.8 24.1 23.9 5.7 39 5 3 2 21.856 43.713 2.06908 49.8 5.8 5.8 5.7 40 2 2 3 21.976 43.952 2.05836 15.4 1.8 1.8 5.7 41 3 1 3 22.154 44.308 2.04266 13.8 1.6 1.6 5.7 42 6 4 1 22.509 45.019 2.01204 21.0 2.5 2.4 5.7 43 6 2 2 22.655 45.31 1.99979 16.5 1.9 1.9 5.7 44 1 3 3 22.688 45.376 1.99703 11.4 1.3 1.3 5.7 45 5 5 1 22.733 45.466 1.9933 61.9 7.2 7.2 5.7 46 0 6 2 23.998 47.995 1.89399 21.0 2.5 2.4 5.7 47 0 4 3 24.228 48.456 1.87703 79.9 9.4 9.2 5.7 48 8 2 1 24.632 49.264 1.84812 9.6 1.1 1.1 5.7 49 3 7 1 25.663 51.326 1.77863 8.7 1.0 1.0 5.8 50 5 5 2 25.75 51.501 1.77299 103.4 12.1 11.9 5.8 51 9 1 0 25.878 51.756 1.76485 37.8 4.4 4.3 5.8 52 7 5 0 25.966 51.933 1.75926 11.2 1.3 1.3 5.8 53 0 8 0 26.609 53.218 1.71975 47.9 5.6 5.5 5.8 54 4 6 2 26.737 53.475 1.71211 26.3 3.1 3.0 5.8 55 5 3 3 26.871 53.742 1.70422 27.3 3.2 3.1 5.8 56 7 5 1 26.911 53.821 1.70191 23.9 2.8 2.7 5.8 57 1 7 2 27.167 54.333 1.68706 12.0 1.4 1.4 5.8 58 6 6 1 27.222 54.445 1.68387 22.3 2.6 2.5 5.8 59 0 0 4 27.29 54.581 1.68 282.5 33.1 32.3 5.8 60 5 7 0 27.375 54.749 1.67522 30.1 3.5 3.4 5.8 61 6 2 3 27.559 55.118 1.66488 35.5 4.2 4.1 5.8 62 9 3 0 27.665 55.329 1.65903 14.5 1.7 1.7 5.8 63 10 0 0 28.747 57.494 1.6016 82.2 9.6 9.4 5.8 64 6 6 2 29.912 59.824 1.54467 127.6 14.9 14.5 5.8 65 5 5 3 30.293 60.586 1.52705 11.4 1.3 1.3 5.8 66 7 3 3 30.644 61.289 1.51122 14.1 1.7 1.6 5.8 67 5 7 2 30.917 61.833 1.49921 396.7 46.5 45.0 5.8 68 9 3 2 31.185 62.371 1.48758 45.6 5.3 5.2 5.8 69 1 9 1 31.265 62.53 1.48417 21.6 2.5 2.4 5.8 70 8 2 3 31.873 63.746 1.45876 13.8 1.6 1.6 5.9 71 11 1 0 32.14 64.28 1.44791 85.0 10.0 9.6 5.9 72 10 0 2 32.194 64.388 1.44575 20.4 2.4 2.3 5.9 73 1 5 4 32.64 65.279 1.42816 17.9 2.1 2.0 5.9 74 10 2 2 32.986 65.971 1.41484 234.3 27.4 26.4 5.9 75 7 5 3 33.83 67.661 1.38356 13.2 1.5 1.5 5.9 76 5 9 0 33.94 67.881 1.37962 27.9 3.3 3.1 5.9 77 6 6 3 34.103 68.206 1.37382 24.0 2.8 2.7 5.9 78 0 6 4 34.638 69.276 1.35519 33.5 3.9 3.7 5.9 79 0 10 1 34.854 69.709 1.34784 11.2 1.3 1.3 5.9 80 5 7 3 35.042 70.083 1.34155 24.4 2.9 2.7 5.9 81 10 4 2 35.306 70.612 1.3328 57.4 6.7 6.4 5.9 82 2 10 1 35.417 70.835 1.32915 14.7 1.7 1.6 5.9 83 9 7 0 35.726 71.453 1.31917 14.6 1.7 1.6 5.9 84 6 4 4 35.889 71.778 1.31399 58.2 6.8 6.5 5.9 85 10 6 0 35.919 71.839 1.31302 13.7 1.6 1.5 5.9 86 5 5 4 36.056 72.111 1.30873 32.4 3.8 3.6 5.9 87 12 2 1 36.796 73.592 1.28602 13.5 1.6 1.5 6.0 88 11 3 2 36.909 73.817 1.28264 31.8 3.7 3.5 6.0 89 0 10 2 37.228 74.457 1.2732 134.4 15.7 14.9 6.0 90 9 1 4 39.273 78.547 1.21683 21.3 2.5 2.3 6.0 91 11 1 3 39.306 78.611 1.216 23.2 2.7 2.6 6.0 92 0 8 4 39.864 79.728 1.20175 25.5 3.0 2.8 6.0 93 5 7 4 40.492 80.984 1.18625 20.0 2.3 2.2 6.1 94 11 3 3 40.764 81.529 1.17969 22.1 2.6 2.4 6.1 95 10 8 0 41.087 82.175 1.17205 12.0 1.4 1.3 6.1 96 10 0 4 41.642 83.284 1.15923 41.2 4.8 4.5 6.1 97 0 12 1 42.966 85.932 1.13017 10.0 1.2 1.1 6.1 98 0 0 6 43.452 86.905 1.12 18.7 2.2 2.0 6.1 99 0 2 6 44.171 88.343 1.10544 14.5 1.7 1.6 6.2 100 11 1 4 44.613 89.225 1.09678 32.0 3.7 3.4 6.2 101 9 9 2 44.646 89.292 1.09614 9.0 1.1 1.0 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) |