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 *** *********************** VISHNEVITE 2, syn, f-feldspathoid, s-vishnevite, DF [K(0.51)Na(3.25)Ca(0.06)][Si(3)Al(3)O(12)][SO(4)](0.24) Hexagonal P 6(3) Z = 6 P6(3) 24 .1 .1907 Ref.Str.: Hassan I., Grundy H.D. (1984) * Canad. Mineral., 22, 333-349 Reserv: The positions of atoms Al and Si were traded places. N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 12.685 alpha = 90.0 b = 12.685 beta = 90.0 c = 5.179 gamma = 120.0 Unit cell volume (cub. angs.) = 721.7 Molar volume ( cub.cm/mol.) = 72.45 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.2017 0.4049 0.6698 0.0 O = 1.00 2 0.1175 0.5527 0.7278 0.0 O = 1.00 3 0.0406 0.3599 0.0393 0.0 O = 1.00 4 0.3255 0.3522 0.0561 0.0 O = 1.00 5 0.338 0.4137 0.7506 0.0 Al = 1.00 6 0.0831 0.4124 0.75 0.0 Si = 1.00 7 0.0615 0.1133 0.6725 0.0 O = 0.24, O = 0.0 8 0.0496 0.109 0.9541 0.0 O = 0.24, O = 0.0 9 0.0 0.0 0.2918 0.0 S = 0.24, S = 0.0 10 0.0 0.0 0.0737 0.0 O = 0.24, O = 0.0 11 0.6184 0.3043 0.6893 0.0 O = 0.33, O = 0.0 12 0.6667 0.3333 0.1272 0.0 Na = 1.00 13 0.1319 0.2611 0.2885 0.0 Na = 0.75, K = 0.17, Ca = 0.02 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.2017 0.4049 0.6698 2 2 0.1175 0.5527 0.7278 3 3 0.0406 0.3599 0.0393 4 4 0.3255 0.3522 0.0561 5 5 0.338 0.4137 0.7506 6 6 0.0831 0.4124 0.75 7 7 0.0615 0.1133 0.6725 8 8 0.0496 0.109 0.9541 9 9 0.0 0.0 0.2918 10 10 0.0 0.0 0.0737 11 11 0.6184 0.3043 0.6893 12 12 0.6667 0.3333 0.1272 13 13 0.1319 0.2611 0.2885 14 1 0.5951 0.7968 0.6698 15 1 0.2032 0.7983 0.6698 16 2 0.4473 0.5648 0.7278 17 2 0.4352 0.8825 0.7278 18 3 0.6401 0.6807 0.0393 19 3 0.3193 0.9594 0.0393 20 4 0.6478 0.9733 0.0561 21 4 0.0267 0.6745 0.0561 22 5 0.5863 0.9243 0.7506 23 5 0.0757 0.662 0.7506 24 6 0.5876 0.6707 0.75 25 6 0.3293 0.9169 0.75 26 7 0.8867 0.9482 0.6725 27 7 0.0518 0.9385 0.6725 28 8 0.891 0.9406 0.9541 29 8 0.0594 0.9504 0.9541 30 11 0.6957 0.3141 0.6893 31 11 0.6859 0.3816 0.6893 32 13 0.7389 0.8708 0.2885 33 13 0.1292 0.8681 0.2885 34 1 0.7983 0.5951 0.1698 35 2 0.8825 0.4473 0.2278 36 3 0.9594 0.6401 0.5393 37 4 0.6745 0.6478 0.5561 38 5 0.662 0.5863 0.2506 39 6 0.9169 0.5876 0.25 40 7 0.9385 0.8867 0.1725 41 8 0.9504 0.891 0.4541 42 9 0.0 0.0 0.7918 43 10 0.0 0.0 0.5737 44 11 0.3816 0.6957 0.1893 45 12 0.3333 0.6667 0.6272 46 13 0.8681 0.7389 0.7885 47 1 0.4049 0.2032 0.1698 48 1 0.7968 0.2017 0.1698 49 2 0.5527 0.4352 0.2278 50 2 0.5648 0.1175 0.2278 51 3 0.3599 0.3193 0.5393 52 3 0.6807 0.0406 0.5393 53 4 0.3522 0.0267 0.5561 54 4 0.9733 0.3255 0.5561 55 5 0.4137 0.0757 0.2506 56 5 0.9243 0.338 0.2506 57 6 0.4124 0.3293 0.25 58 6 0.6707 0.0831 0.25 59 7 0.1133 0.0518 0.1725 60 7 0.9482 0.0615 0.1725 61 8 0.109 0.0594 0.4541 62 8 0.9406 0.0496 0.4541 63 11 0.3043 0.6859 0.1893 64 11 0.3141 0.6184 0.1893 65 13 0.2611 0.1292 0.7885 66 13 0.8708 0.1319 0.7885 X-ray density (g/cm cub.) = 2.32 MU (1/cm) = 82.411 Mass attenuation coefficient (cm**2/g) = 35.498 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 O 3.264 7 2.5978 2 2.6453 3 2.8223 4 3.2042 7 2.7552 2 2.8003 3 2.6149 4 2 O 3.264 8 2.5978 1 2.6739 3 2.7552 1 2.8955 4 2.903 3 2.6779 4 3.1904 11 3.2477 11 3 O 3.264 6 2.6453 1 2.6739 2 2.903 2 2.8004 1 2.7768 4 2.6095 4 4 O 3.264 6 2.8223 1 2.8955 2 2.6147 1 2.6779 2 2.6094 3 2.7767 3 5 Al 2.316 4 1.7274 1 1.7359 4 1.7182 2 1.7438 3 6 Si 2.1 4 1.6087 1 1.6107 2 1.6186 3 1.6212 4 7 O ,O 3.264 15 3.2042 1 1.4644 8 2.4229 10 2.1585 7 2.1585 7 2.6203 8 2.5185 8 2.6913 8 1.3471 10 2.8737 7 2.8737 7 2.8738 7 2.8738 7 1.588 8 1.7451 8 8 O ,O 3.264 14 1.4644 7 1.3496 10 2.5185 7 2.6203 7 2.0769 8 2.0769 8 2.6913 7 2.3063 10 1.7449 7 1.5881 7 2.8536 8 2.8536 8 2.8537 8 2.8537 8 9 S ,S 1.98 8 1.1295 10 1.3909 7 1.4643 8 1.46 10 1.3909 7 1.391 7 1.4643 8 1.4644 8 10 O ,O 3.264 14 2.4229 7 1.3496 8 2.4229 7 2.4229 7 1.3496 8 1.3497 8 1.3471 7 2.3063 8 2.5895 10 2.5895 10 1.3471 7 1.3472 7 2.3063 8 2.3063 8 11 O ,O 3.264 4 0.9247 11 0.9247 11 3.2479 2 3.1904 2 12 Na 2.808 6 2.3299 11 2.3299 11 2.3299 11 2.4288 2 2.429 2 2.4288 2 13 Na ,K ,Ca 3.228 13 2.529 1 2.4554 3 2.4448 4 2.5677 7 2.4078 8 3.0765 10 3.2263 10 2.9089 3 2.8774 4 2.615 7 2.5103 7 2.5734 8 2.704 8 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 0 0 4.021 8.041 0.046 403.81 6 6.1 17.5 2 1 1 0 6.976 13.951 0.079 132.64 6 55.2 466.2 3 2 0 0 8.061 16.123 0.091 98.75 6 11.8 15.9 4 1 0 1 9.464 18.928 0.107 71.05 12 65.8 708.9 5 1 2 0 10.691 21.382 0.12 55.21 6 35.1 78.3 6 2 1 0 10.691 21.382 0.12 55.21 6 12.0 9.2 7 1 1 1 11.071 22.141 0.125 51.35 12 8.8 9.1 8 2 0 1 11.795 23.591 0.133 44.98 12 10.7 11.9 9 3 0 0 12.143 24.286 0.137 42.32 6 99.2 479.5 10 1 2 1 13.755 27.51 0.154 32.53 12 77.9 454.3 11 2 1 1 13.755 27.51 0.154 32.53 12 79.7 475.8 12 2 2 0 14.057 28.115 0.158 31.07 6 4.4 0.7 13 1 3 0 14.644 29.288 0.164 28.47 6 10.6 3.7 14 3 1 0 14.644 29.288 0.164 28.47 6 14.5 6.9 15 3 0 1 14.929 29.858 0.167 27.32 12 30.4 58.3 16 4 0 0 16.288 32.577 0.182 22.65 6 106.2 294.2 17 2 2 1 16.548 33.095 0.185 21.89 12 3.7 0.7 18 1 3 1 17.057 34.113 0.19 20.49 12 40.6 77.7 19 3 1 1 17.057 34.113 0.19 20.49 12 52.2 128.9 20 0 0 2 17.305 34.611 0.193 19.86 2 187.8 268.9 21 1 0 2 17.795 35.59 0.198 18.68 12 31.4 42.5 22 2 3 0 17.796 35.593 0.198 18.68 6 29.8 19.1 23 3 2 0 17.796 35.593 0.198 18.68 6 37.8 30.8 24 4 0 1 18.51 37.02 0.206 17.13 12 85.0 285.3 25 1 1 2 18.742 37.483 0.209 16.67 12 16.6 10.5 26 1 4 0 18.743 37.485 0.209 16.67 6 24.1 11.2 27 4 1 0 18.743 37.485 0.209 16.67 6 34.8 23.3 28 2 0 2 19.2 38.399 0.213 15.8 12 11.0 4.4 29 2 3 1 19.871 39.742 0.221 14.64 12 43.4 63.6 30 3 2 1 19.871 39.742 0.221 14.64 12 37.5 47.4 31 1 2 2 20.522 41.044 0.228 13.63 12 12.7 5.1 32 2 1 2 20.522 41.044 0.228 13.63 12 9.5 2.9 33 5 0 0 20.523 41.047 0.228 13.63 6 23.8 8.9 34 1 4 1 20.737 41.473 0.23 13.32 12 39.8 48.6 35 4 1 1 20.737 41.473 0.23 13.32 12 40.8 51.2 36 3 0 2 21.366 42.732 0.236 12.45 12 59.1 100.3 37 3 3 0 21.367 42.734 0.236 12.45 6 116.0 193.1 38 2 4 0 21.779 43.558 0.241 11.93 6 5.4 0.4 39 4 2 0 21.779 43.558 0.241 11.93 6 10.9 1.6 40 5 0 1 22.385 44.77 0.247 11.22 12 47.7 58.8 41 2 2 2 22.584 45.168 0.249 10.99 12 20.7 10.9 42 1 3 2 22.978 45.957 0.253 10.57 12 15.3 5.7 43 3 1 2 22.978 45.957 0.253 10.57 12 15.5 5.9 44 1 5 0 22.979 45.959 0.253 10.57 6 15.5 2.9 45 5 1 0 22.979 45.959 0.253 10.57 6 14.1 2.4 46 3 3 1 23.174 46.349 0.255 10.37 12 3.2 0.2 47 2 4 1 23.561 47.122 0.259 9.99 12 8.6 1.7 48 4 2 1 23.561 47.122 0.259 9.99 12 15.7 5.6 49 4 0 2 24.132 48.264 0.265 9.46 12 65.8 94.4 50 1 5 1 24.694 49.388 0.271 8.98 12 11.1 2.6 51 5 1 1 24.694 49.388 0.271 8.98 12 15.0 4.6 52 6 0 0 24.879 49.758 0.273 8.83 6 7.5 0.6 53 2 3 2 25.245 50.491 0.277 8.54 12 56.3 62.3 54 3 2 2 25.245 50.491 0.277 8.54 12 52.3 53.8 55 3 4 0 25.246 50.492 0.277 8.54 6 49.0 23.6 56 4 3 0 25.246 50.492 0.277 8.54 6 37.3 13.6 57 1 4 2 25.968 51.936 0.284 8.01 12 46.2 39.4 58 4 1 2 25.968 51.936 0.284 8.01 12 52.7 51.3 59 2 5 0 25.969 51.938 0.284 8.01 6 46.9 20.3 60 5 2 0 25.969 51.938 0.284 8.01 6 67.4 41.8 61 6 0 1 26.502 53.003 0.29 7.64 12 22.1 8.6 62 1 0 3 26.851 53.702 0.293 7.42 12 37.8 24.5 63 3 4 1 26.853 53.705 0.293 7.42 12 39.0 26.1 64 4 3 1 26.853 53.705 0.293 7.42 12 28.4 13.8 65 5 0 2 27.373 54.746 0.298 7.1 12 27.0 11.9 66 1 6 0 27.374 54.747 0.298 7.1 6 0.8 0.0 67 6 1 0 27.374 54.747 0.298 7.1 6 7.8 0.5 68 1 1 3 27.544 55.088 0.3 7.0 12 5.8 0.6 69 2 5 1 27.546 55.091 0.3 7.0 12 36.3 21.2 70 5 2 1 27.546 55.091 0.3 7.0 12 44.4 31.8 71 2 0 3 27.886 55.772 0.304 6.81 12 45.6 32.6 72 3 3 2 28.057 56.114 0.305 6.71 12 41.9 27.2 73 2 4 2 28.395 56.79 0.309 6.53 12 20.8 6.5 74 4 2 2 28.395 56.79 0.309 6.53 12 18.4 5.1 75 1 2 3 28.896 57.792 0.314 6.28 12 67.8 66.5 76 2 1 3 28.896 57.792 0.314 6.28 12 67.5 65.9 77 1 6 1 28.898 57.796 0.314 6.28 12 37.4 20.2 78 6 1 1 28.898 57.796 0.314 6.28 12 32.1 14.9 79 4 4 0 29.064 58.128 0.315 6.2 6 92.4 60.9 80 1 5 2 29.394 58.788 0.319 6.04 12 5.6 0.4 81 5 1 2 29.394 58.788 0.319 6.04 12 18.7 4.8 82 3 5 0 29.395 58.789 0.319 6.04 6 47.2 15.5 83 5 3 0 29.395 58.789 0.319 6.04 6 32.4 7.3 84 7 0 0 29.395 58.789 0.319 6.04 6 1.9 0.0 85 3 0 3 29.557 59.114 0.32 5.97 12 16.5 3.8 86 2 6 0 30.373 60.746 0.328 5.62 6 17.0 1.9 87 6 2 0 30.373 60.746 0.328 5.62 6 17.9 2.1 88 2 2 3 30.532 61.064 0.33 5.55 12 9.2 1.1 89 4 4 1 30.534 61.068 0.33 5.55 12 9.5 1.2 90 1 3 3 30.853 61.706 0.333 5.42 12 31.3 12.2 91 3 1 3 30.853 61.706 0.333 5.42 12 42.8 22.9 92 3 5 1 30.855 61.71 0.333 5.42 12 65.1 52.9 93 5 3 1 30.855 61.71 0.333 5.42 12 51.0 32.5 94 7 0 1 30.855 61.71 0.333 5.42 12 55.9 39.1 95 6 0 2 31.014 62.028 0.334 5.36 12 71.3 62.8 96 3 4 2 31.332 62.664 0.338 5.24 12 22.5 6.1 97 4 3 2 31.332 62.664 0.338 5.24 12 15.4 2.8 98 4 0 3 31.805 63.609 0.342 5.07 12 76.8 68.9 99 2 6 1 31.806 63.612 0.342 5.07 12 50.8 30.2 100 6 2 1 31.806 63.612 0.342 5.07 12 50.4 29.7 101 2 5 2 31.963 63.925 0.344 5.02 12 25.1 7.3 102 5 2 2 31.963 63.925 0.344 5.02 12 37.4 16.1 103 1 7 0 31.963 63.927 0.344 5.02 6 60.9 21.5 104 7 1 0 31.963 63.927 0.344 5.02 6 86.2 43.0 105 2 3 3 32.741 65.481 0.351 4.76 12 43.8 21.0 106 3 2 3 32.741 65.481 0.351 4.76 12 40.5 18.0 107 1 6 2 33.204 66.408 0.355 4.62 12 17.0 3.1 108 6 1 2 33.204 66.408 0.355 4.62 12 16.2 2.8 109 4 5 0 33.205 66.41 0.355 4.62 6 11.5 0.7 110 5 4 0 33.205 66.41 0.355 4.62 6 12.6 0.8 111 1 4 3 33.357 66.714 0.357 4.58 12 20.5 4.4 112 4 1 3 33.357 66.714 0.357 4.58 12 8.6 0.8 113 1 7 1 33.358 66.717 0.357 4.58 12 9.4 0.9 114 7 1 1 33.358 66.717 0.357 4.58 12 2.0 0.0 115 3 6 0 33.817 67.634 0.361 4.45 6 19.3 1.9 116 6 3 0 33.817 67.634 0.361 4.45 6 25.8 3.4 117 8 0 0 34.121 68.242 0.364 4.37 6 35.8 6.5 118 5 0 3 34.573 69.145 0.368 4.25 12 31.9 10.0 119 4 5 1 34.574 69.149 0.368 4.25 12 26.0 6.6 120 5 4 1 34.574 69.149 0.368 4.25 12 16.9 2.8 121 4 4 2 34.724 69.449 0.37 4.21 12 89.5 77.7 122 3 5 2 35.025 70.049 0.373 4.14 12 31.7 9.6 123 5 3 2 35.025 70.049 0.373 4.14 12 13.5 1.8 124 7 0 2 35.025 70.049 0.373 4.14 12 40.7 15.8 125 2 7 0 35.025 70.051 0.373 4.14 6 42.0 8.4 126 7 2 0 35.025 70.051 0.373 4.14 6 21.6 2.2 127 3 3 3 35.173 70.347 0.374 4.1 12 4.0 0.2 128 3 6 1 35.175 70.35 0.374 4.1 12 13.1 1.6 129 6 3 1 35.175 70.35 0.374 4.1 12 12.6 1.5 130 2 4 3 35.472 70.944 0.377 4.04 12 17.4 2.8 131 4 2 3 35.472 70.944 0.377 4.04 12 24.0 5.4 132 8 0 1 35.473 70.947 0.377 4.03 12 110.4 113.3 133 2 6 2 35.919 71.837 0.381 3.94 12 17.2 2.7 134 6 2 2 35.919 71.837 0.381 3.94 12 13.5 1.7 135 1 5 3 36.361 72.723 0.385 3.84 12 34.3 10.4 136 5 1 3 36.361 72.723 0.385 3.84 12 37.6 12.5 137 2 7 1 36.363 72.726 0.385 3.84 12 37.0 12.1 138 7 2 1 36.363 72.726 0.385 3.84 12 27.4 6.6 139 0 0 4 36.507 73.015 0.386 3.82 2 124.7 22.8 140 1 0 4 36.801 73.603 0.389 3.76 12 18.4 2.9 141 1 8 0 36.804 73.609 0.389 3.76 6 0.4 0.0 142 8 1 0 36.804 73.609 0.389 3.76 6 9.3 0.4 143 1 1 4 37.387 74.774 0.394 3.65 12 54.7 25.2 144 1 7 2 37.389 74.778 0.394 3.65 12 54.7 25.1 145 7 1 2 37.389 74.778 0.394 3.65 12 70.7 42.1 146 5 5 0 37.39 74.78 0.394 3.65 6 28.2 3.3 147 2 0 4 37.679 75.357 0.397 3.6 12 26.4 5.8 148 4 6 0 37.682 75.363 0.397 3.6 6 36.2 5.4 149 6 4 0 37.682 75.363 0.397 3.6 6 38.4 6.1 150 6 0 3 37.825 75.651 0.398 3.57 12 5.1 0.2 151 3 4 3 38.116 76.231 0.401 3.53 12 54.3 24.0 152 4 3 3 38.116 76.231 0.401 3.53 12 41.3 13.8 153 1 8 1 38.117 76.234 0.401 3.52 12 34.2 9.5 154 8 1 1 38.117 76.234 0.401 3.52 12 58.3 27.6 155 1 2 4 38.549 77.097 0.405 3.46 12 17.2 2.4 156 2 1 4 38.549 77.097 0.405 3.46 12 9.4 0.7 157 4 5 2 38.551 77.102 0.405 3.46 12 14.5 1.7 158 5 4 2 38.551 77.102 0.405 3.46 12 7.1 0.4 159 3 7 0 38.552 77.103 0.405 3.46 6 31.6 4.0 160 7 3 0 38.552 77.103 0.405 3.46 6 16.8 1.1 161 2 5 3 38.694 77.389 0.406 3.43 12 27.1 5.8 162 5 2 3 38.694 77.389 0.406 3.43 12 16.5 2.2 163 5 5 1 38.696 77.392 0.406 3.43 12 6.7 0.4 164 4 6 1 38.984 77.968 0.408 3.39 12 19.1 2.8 165 6 4 1 38.984 77.968 0.408 3.39 12 18.8 2.8 166 3 0 4 39.125 78.251 0.41 3.37 12 33.9 9.0 167 3 6 2 39.128 78.255 0.41 3.37 12 57.7 25.8 168 6 3 2 39.128 78.255 0.41 3.37 12 62.9 30.7 169 9 0 0 39.128 78.257 0.41 3.37 6 59.6 13.8 170 8 0 2 39.415 78.83 0.412 3.33 12 37.8 11.0 171 1 6 3 39.844 79.688 0.416 3.27 12 29.0 6.3 172 6 1 3 39.844 79.688 0.416 3.27 12 17.4 2.3 173 3 7 1 39.846 79.691 0.416 3.27 12 35.0 9.3 174 7 3 1 39.846 79.691 0.416 3.27 12 29.0 6.4 175 2 2 4 39.986 79.972 0.417 3.26 12 38.5 11.1 176 2 8 0 39.989 79.978 0.417 3.26 6 39.1 5.7 177 8 2 0 39.989 79.978 0.417 3.26 6 42.4 6.8 178 1 3 4 40.272 80.544 0.42 3.22 12 8.9 0.6 179 3 1 4 40.272 80.544 0.42 3.22 12 5.7 0.2 180 2 7 2 40.274 80.548 0.42 3.22 12 27.8 5.7 181 7 2 2 40.274 80.548 0.42 3.22 12 10.5 0.8 182 9 0 1 40.417 80.834 0.421 3.2 12 13.0 1.2 183 4 0 4 41.126 82.253 0.427 3.12 12 47.5 16.2 184 4 4 3 41.27 82.54 0.428 3.11 12 2.1 0.0 185 2 8 1 41.271 82.543 0.428 3.11 12 44.5 14.2 186 8 2 1 41.271 82.543 0.428 3.11 12 34.5 8.5 187 3 5 3 41.554 83.108 0.431 3.08 12 48.1 16.4 188 5 3 3 41.554 83.108 0.431 3.08 12 40.6 11.7 189 7 0 3 41.554 83.108 0.431 3.08 12 52.9 19.8 190 2 3 4 41.978 83.956 0.434 3.04 12 52.8 19.6 191 3 2 4 41.978 83.956 0.434 3.04 12 57.7 23.3 192 1 8 2 41.98 83.96 0.434 3.04 12 17.2 2.1 193 8 1 2 41.98 83.96 0.434 3.04 12 15.6 1.7 194 1 9 0 41.981 83.961 0.434 3.04 6 2.8 0.0 195 5 6 0 41.981 83.961 0.434 3.04 6 34.8 4.2 196 6 5 0 41.981 83.961 0.434 3.04 6 22.1 1.7 197 9 1 0 41.981 83.961 0.434 3.04 6 3.6 0.0 198 2 6 3 42.404 84.807 0.438 3.0 12 61.7 26.3 199 6 2 3 42.404 84.807 0.438 3.0 12 63.7 28.1 200 1 4 4 42.544 85.087 0.439 2.99 12 11.7 0.9 201 4 1 4 42.544 85.087 0.439 2.99 12 15.0 1.6 202 5 5 2 42.546 85.092 0.439 2.99 12 11.3 0.9 203 4 7 0 42.547 85.093 0.439 2.99 6 44.7 6.9 204 7 4 0 42.547 85.093 0.439 2.99 6 55.4 10.6 205 4 6 2 42.829 85.657 0.441 2.97 12 43.8 13.1 206 6 4 2 42.829 85.657 0.441 2.97 12 46.0 14.5 207 1 9 1 43.253 86.505 0.445 2.94 12 14.5 1.4 208 5 6 1 43.253 86.505 0.445 2.94 12 27.7 5.2 209 6 5 1 43.253 86.505 0.445 2.94 12 20.8 2.9 210 9 1 1 43.253 86.505 0.445 2.94 12 9.9 0.7 211 5 0 4 43.673 87.346 0.448 2.91 12 28.3 5.3 212 3 7 2 43.675 87.35 0.448 2.91 12 13.4 1.2 213 7 3 2 43.675 87.35 0.448 2.91 12 15.4 1.6 214 3 8 0 43.676 87.352 0.448 2.91 6 25.3 2.1 215 8 3 0 43.676 87.352 0.448 2.91 6 20.2 1.4 216 1 7 3 43.815 87.631 0.449 2.9 12 9.1 0.6 217 7 1 3 43.815 87.631 0.449 2.9 12 9.2 0.6 218 4 7 1 43.817 87.634 0.449 2.9 12 11.4 0.9 219 7 4 1 43.817 87.634 0.449 2.9 12 11.0 0.8 220 3 3 4 44.237 88.474 0.453 2.87 12 24.3 3.9 221 9 0 2 44.239 88.478 0.453 2.87 12 33.6 7.5 222 2 4 4 44.519 89.037 0.455 2.85 12 28.0 5.1 223 4 2 4 44.519 89.037 0.455 2.85 12 33.4 7.3 224 10 0 0 44.521 89.043 0.455 2.85 6 5.4 0.1 225 4 5 3 44.942 89.885 0.459 2.83 12 13.4 1.2 226 5 4 3 44.942 89.885 0.459 2.83 12 14.2 1.3 227 3 8 1 44.944 89.888 0.459 2.83 12 31.9 6.6 228 8 3 1 44.944 89.888 0.459 2.83 12 24.7 4.0 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 0 0 4.021 8.041 10.98553 17.5 1.9 1.9 5.6 2 1 1 0 6.976 13.951 6.3425 466.2 50.1 50.6 5.6 3 2 0 0 8.061 16.123 5.49277 15.9 1.7 1.7 5.6 4 1 0 1 9.464 18.928 4.68452 708.9 76.2 76.7 5.6 5 1 2 0 10.691 21.382 4.15214 87.5 9.4 9.4 5.6 6 2 0 1 11.795 23.591 3.76815 11.9 1.3 1.3 5.6 7 3 0 0 12.143 24.286 3.66184 479.5 51.5 51.7 5.6 8 2 1 1 13.755 27.51 3.23955 930.1 100.0 100.0 5.6 9 3 1 0 14.644 29.288 3.04684 10.6 1.1 1.1 5.6 10 3 0 1 14.929 29.858 2.98995 58.3 6.3 6.3 5.6 11 4 0 0 16.288 32.577 2.74638 294.2 31.6 31.5 5.6 12 3 1 1 17.057 34.113 2.62609 206.6 22.2 22.1 5.7 13 0 0 2 17.305 34.611 2.5895 268.9 28.9 28.7 5.7 14 1 0 2 17.795 35.59 2.52042 92.4 9.9 9.9 5.7 15 4 0 1 18.51 37.02 2.42634 285.3 30.7 30.4 5.7 16 4 1 0 18.743 37.485 2.39724 45.0 4.8 4.8 5.7 17 2 3 1 19.871 39.742 2.26617 111.0 11.9 11.8 5.7 18 5 0 0 20.523 41.047 2.19711 16.8 1.8 1.8 5.7 19 4 1 1 20.737 41.473 2.17549 99.7 10.7 10.6 5.7 20 3 3 0 21.367 42.734 2.11417 293.4 31.5 31.1 5.7 21 5 0 1 22.385 44.77 2.02262 58.8 6.3 6.2 5.7 22 2 2 2 22.584 45.168 2.00576 10.9 1.2 1.1 5.7 23 3 1 2 22.978 45.957 1.97314 16.9 1.8 1.8 5.7 24 4 0 2 24.132 48.264 1.88407 94.4 10.1 9.9 5.7 25 2 3 2 25.245 50.491 1.80607 153.4 16.5 16.1 5.8 26 5 2 0 25.969 51.938 1.75909 152.8 16.4 16.0 5.8 27 3 4 1 26.853 53.705 1.7053 64.3 6.9 6.7 5.8 28 5 0 2 27.373 54.746 1.67533 12.4 1.3 1.3 5.8 29 5 2 1 27.546 55.091 1.66563 53.0 5.7 5.5 5.8 30 2 0 3 27.886 55.772 1.64691 32.6 3.5 3.4 5.8 31 3 3 2 28.057 56.114 1.63767 27.2 2.9 2.8 5.8 32 2 4 2 28.395 56.79 1.61977 11.6 1.2 1.2 5.8 33 1 2 3 28.896 57.792 1.59405 167.5 18.0 17.4 5.8 34 4 4 0 29.064 58.128 1.58563 60.9 6.5 6.3 5.8 35 5 3 0 29.395 58.789 1.56936 27.7 3.0 2.9 5.8 36 7 0 1 30.855 61.71 1.50192 159.6 17.2 16.5 5.8 37 6 0 2 31.014 62.028 1.49498 62.8 6.7 6.5 5.8 38 4 0 3 31.805 63.609 1.46157 128.9 13.9 13.3 5.9 39 7 1 0 31.963 63.927 1.45507 87.9 9.4 9.1 5.9 40 2 3 3 32.741 65.481 1.42424 39.0 4.2 4.0 5.9 41 5 0 3 34.573 69.145 1.35744 19.3 2.1 2.0 5.9 42 4 4 2 34.724 69.449 1.35225 77.7 8.4 7.9 5.9 43 7 0 2 35.025 70.049 1.34212 37.7 4.1 3.9 5.9 44 8 0 1 35.473 70.947 1.32733 121.5 13.1 12.4 5.9 45 2 7 1 36.363 72.726 1.29918 41.7 4.5 4.2 6.0 46 0 0 4 36.507 73.015 1.29475 22.8 2.5 2.3 6.0 47 7 1 2 37.389 74.778 1.26852 95.7 10.3 9.7 6.0 48 6 4 0 37.682 75.363 1.26013 17.3 1.9 1.7 6.0 49 8 1 1 38.117 76.234 1.24788 74.9 8.1 7.6 6.0 50 3 7 0 38.552 77.103 1.23597 10.3 1.1 1.0 6.0 51 9 0 0 39.128 78.257 1.22061 79.3 8.5 8.0 6.0 52 8 0 2 39.415 78.83 1.21317 11.0 1.2 1.1 6.0 53 7 3 1 39.846 79.691 1.20221 24.2 2.6 2.4 6.0 54 2 2 4 39.986 79.972 1.19869 23.6 2.5 2.4 6.0 55 4 0 4 41.126 82.253 1.17113 16.2 1.7 1.6 6.1 56 2 8 1 41.271 82.543 1.16775 22.7 2.4 2.3 6.1 57 7 0 3 41.554 83.108 1.16124 47.9 5.2 4.8 6.1 58 3 2 4 41.978 83.956 1.15166 52.7 5.7 5.2 6.1 59 6 2 3 42.404 84.807 1.14226 54.4 5.8 5.4 6.1 60 7 4 0 42.547 85.093 1.13915 19.9 2.1 2.0 6.1 61 6 4 2 42.829 85.657 1.13309 27.6 3.0 2.7 6.1 62 6 5 1 43.253 86.505 1.12414 10.2 1.1 1.0 6.1 63 5 0 4 43.673 87.346 1.11547 11.6 1.3 1.1 6.2 64 9 0 2 44.239 88.478 1.1041 11.4 1.2 1.1 6.2 65 4 2 4 44.519 89.037 1.09861 12.6 1.4 1.2 6.2 66 8 3 1 44.944 89.888 1.09041 13.1 1.4 1.3 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) |