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 *** *********************** IKRANITE 1, f-eudialyte, DF [Na,H(3)O](15)(Ca,Mn,REE)(6)Fe'''(2)Zr(3.4)Si(24.3)O(66)(O,OH)(6)Cl.2H(2)O Hexagonal R 3m Z = 3 R3m 23 .1 .9 Ref.Str.: Ekimenkova I.A., Rastsvetaeva R.K., Chukanov N.V., Khasanov S.S. (2000) * Dokl. RAN, 371, 65-69 R: from Karnasurt Mountains, Lovozero massif, Kola Peninsula, Russia. Pos.2 is Ca=0.55,Mn=0.233,Ce=0.083,Na=0.075,Sr=0.059. Poss.38,40,41,42,43 are occupied by H(3)O. N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 14.167 alpha = 90.0 b = 14.167 beta = 90.0 c = 30.081 gamma = 120.0 Unit cell volume (cub. angs.) = 5228.52 Molar volume ( cub.cm/mol.) = 1049.78 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.3332 0.1666 0.1669 0.0 Zr = 1.00 2 0.4052 0.3345 0.3337 0.0 Ca = 0.62, Mn = 0.23, Ce = 0.14 3 0.0832 0.5416 0.2573 0.0 Si = 1.00 4 0.1406 0.0703 0.0804 0.0 Si = 1.00 5 0.055 0.3249 0.2366 0.0 Si = 1.00 6 0.2056 0.4112 0.0788 0.0 Si = 1.00 7 0.5266 0.2633 0.2538 0.0 Si = 1.00 8 0.9927 0.6052 0.0971 0.0 Si = 1.00 9 0.0218 0.5109 0.3017 0.0 O = 1.00 10 0.4127 0.3092 0.1278 0.0 O = 1.00 11 0.4021 0.0342 0.0451 0.0 O = 1.00 12 0.0359 0.2993 0.2881 0.0 O = 1.00 13 0.0939 0.3738 0.1073 0.0 O = 1.00 14 0.3912 0.4377 0.226 0.0 O = 1.00 15 0.2584 0.0284 0.2053 0.0 O = 1.00 16 0.4452 0.2226 0.2938 0.0 O = 1.00 17 0.1765 0.353 0.2202 0.0 O = 1.00 18 0.1912 0.0956 0.1259 0.0 O = 1.00 19 0.1808 0.3616 0.0284 0.0 O = 1.00 20 0.606 0.394 0.2537 0.0 O = 1.00 21 0.2208 0.1104 0.0389 0.0 O = 1.00 22 0.3951 0.6049 0.254 0.0 O = 1.00 23 0.0185 0.5092 0.1046 0.0 O = 1.00 24 0.0617 0.1234 0.074 0.0 O = 1.00 25 0.2725 0.545 0.0709 0.0 O = 1.00 26 0.4692 0.2346 0.2045 0.0 O = 1.00 27 0.1573 0.3146 0.3349 0.0 Fe = 0.7 , Fe = 0.0 28 0.3333 0.6667 0.0306 0.0 Zr = 0.09, Nb = 0.03, Ti = 0.03 29 0.3333 0.6667 0.2875 0.0 Zr = 0.16, Nb = 0.07, Ti = 0.07 30 0.3333 0.6667 0.2271 0.0 Zr = 0.15, Zr = 0.0 31 0.3333 0.6667 0.0859 0.0 Si = 0.3 , Si = 0.0 32 0.5324 0.4676 0.997 0.0 Na = 0.3 , Na = 0.0 33 0.5681 0.4319 0.173 0.0 Na = 0.7 , Na = 0.0 34 0.545 0.455 0.1789 0.0 Na = 0.3 , Na = 0.0 35 0.1948 0.0974 0.2874 0.0 Na = 0.65, Na = 0.0 36 0.1948 0.0974 0.2874 0.0 K = 0.1 , Sr = 0.05 37 0.111 0.222 0.1528 0.0 Na = 0.5 , Na = 0.0 38 0.111 0.222 0.1528 0.0 O = 0.17, O = 0.0 39 0.4648 0.2324 0.0484 0.0 Na = 0.62, Na = 0.0 40 0.4648 0.2324 0.0484 0.0 O = 0.2 , O = 0.0 41 0.0808 0.1616 0.1663 0.0 O = 0.34, O = 0.0 42 0.492 0.246 0.035 0.0 O = 0.18, O = 0.0 43 0.134 0.067 0.279 0.0 O = 0.2 , O = 0.0 44 0.3333 0.6667 0.137 0.0 OH = 0.3 , OH = 0.0 45 0.391 0.609 0.159 0.0 OH = 0.22, OH = 0.0 46 0.259 0.518 0.3307 0.0 OH = 0.7 , OH = 0.0 47 0.42 0.58 0.9991 0.0 OH = 0.7 , OH = 0.0 48 0.3333 0.6667 0.15 0.0 Cl = 0.26, Cl = 0.0 49 0.0 0.0 0.225 0.0 H(2)O = 0.7 , H(2)O = 0.0 50 0.0 0.0 0.199 0.0 H(2)O = 0.3 , H(2)O = 0.0 51 0.6667 0.3333 0.0999 0.0 H(2)O = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.3332 0.1666 0.1669 2 2 0.4052 0.3345 0.3337 3 3 0.0832 0.5416 0.2573 4 4 0.1406 0.0703 0.0804 5 5 0.055 0.3249 0.2366 6 6 0.2056 0.4112 0.0788 7 7 0.5266 0.2633 0.2538 8 8 0.9927 0.6052 0.0971 9 9 0.0218 0.5109 0.3017 10 10 0.4127 0.3092 0.1278 11 11 0.4021 0.0342 0.0451 12 12 0.0359 0.2993 0.2881 13 13 0.0939 0.3738 0.1073 14 14 0.3912 0.4377 0.226 15 15 0.2584 0.0284 0.2053 16 16 0.4452 0.2226 0.2938 17 17 0.1765 0.353 0.2202 18 18 0.1912 0.0956 0.1259 19 19 0.1808 0.3616 0.0284 20 20 0.606 0.394 0.2537 21 21 0.2208 0.1104 0.0389 22 22 0.3951 0.6049 0.254 23 23 0.0185 0.5092 0.1046 24 24 0.0617 0.1234 0.074 25 25 0.2725 0.545 0.0709 26 26 0.4692 0.2346 0.2045 27 27 0.1573 0.3146 0.3349 28 28 0.3333 0.6667 0.0306 29 29 0.3333 0.6667 0.2875 30 30 0.3333 0.6667 0.2271 31 31 0.3333 0.6667 0.0859 32 32 0.5324 0.4676 0.997 33 33 0.5681 0.4319 0.173 34 34 0.545 0.455 0.1789 35 35 0.1948 0.0974 0.2874 36 36 0.1948 0.0974 0.2874 37 37 0.111 0.222 0.1528 38 38 0.111 0.222 0.1528 39 39 0.4648 0.2324 0.0484 40 40 0.4648 0.2324 0.0484 41 41 0.0808 0.1616 0.1663 42 42 0.492 0.246 0.035 43 43 0.134 0.067 0.279 44 44 0.3333 0.6667 0.137 45 45 0.391 0.609 0.159 46 46 0.259 0.518 0.3307 47 47 0.42 0.58 0.9991 48 48 0.3333 0.6667 0.15 49 49 0.0 0.0 0.225 50 50 0.0 0.0 0.199 51 51 0.6667 0.3333 0.0999 52 1 0.8334 0.1666 0.1669 53 1 0.8334 0.6668 0.1669 54 2 0.6655 0.0707 0.3337 55 2 0.9293 0.5948 0.3337 56 3 0.4584 0.5416 0.2573 57 3 0.4584 0.9168 0.2573 58 4 0.9297 0.0703 0.0804 59 4 0.9297 0.8594 0.0804 60 5 0.6751 0.7301 0.2366 61 5 0.2699 0.945 0.2366 62 6 0.5888 0.7944 0.0788 63 6 0.2056 0.7944 0.0788 64 7 0.7367 0.2633 0.2538 65 7 0.7367 0.4734 0.2538 66 8 0.3948 0.3875 0.0971 67 8 0.6125 0.0073 0.0971 68 9 0.4891 0.5109 0.3017 69 9 0.4891 0.9782 0.3017 70 10 0.6908 0.1035 0.1278 71 10 0.8965 0.5873 0.1278 72 11 0.9658 0.3679 0.0451 73 11 0.6321 0.5979 0.0451 74 12 0.7007 0.7366 0.2881 75 12 0.2634 0.9641 0.2881 76 13 0.6262 0.7201 0.1073 77 13 0.2799 0.9061 0.1073 78 14 0.5623 0.9535 0.226 79 14 0.0465 0.6088 0.226 80 15 0.9716 0.23 0.2053 81 15 0.77 0.7416 0.2053 82 16 0.7774 0.2226 0.2938 83 16 0.7774 0.5548 0.2938 84 17 0.647 0.8235 0.2202 85 17 0.1765 0.8235 0.2202 86 18 0.9044 0.0956 0.1259 87 18 0.9044 0.8088 0.1259 88 19 0.6384 0.8192 0.0284 89 19 0.1808 0.8192 0.0284 90 20 0.606 0.212 0.2537 91 20 0.788 0.394 0.2537 92 21 0.8896 0.1104 0.0389 93 21 0.8896 0.7792 0.0389 94 22 0.3951 0.7902 0.254 95 22 0.2098 0.6049 0.254 96 23 0.4908 0.5093 0.1046 97 23 0.4907 0.9815 0.1046 98 24 0.8766 0.9383 0.074 99 24 0.0617 0.9383 0.074 100 25 0.455 0.7275 0.0709 101 25 0.2725 0.7275 0.0709 102 26 0.7654 0.2346 0.2045 103 26 0.7654 0.5308 0.2045 104 27 0.6854 0.8427 0.3349 105 27 0.1573 0.8427 0.3349 106 32 0.5324 0.0648 0.997 107 32 0.9352 0.4676 0.997 108 33 0.5681 0.1362 0.173 109 33 0.8638 0.4319 0.173 110 34 0.545 0.09 0.1789 111 34 0.91 0.455 0.1789 112 35 0.9026 0.0974 0.2874 113 35 0.9026 0.8052 0.2874 114 36 0.9026 0.0974 0.2874 115 36 0.9026 0.8052 0.2874 116 37 0.778 0.889 0.1528 117 37 0.111 0.889 0.1528 118 38 0.778 0.889 0.1528 119 38 0.111 0.889 0.1528 120 39 0.7676 0.2324 0.0484 121 39 0.7676 0.5352 0.0484 122 40 0.7676 0.2324 0.0484 123 40 0.7676 0.5352 0.0484 124 41 0.8384 0.9192 0.1663 125 41 0.0808 0.9192 0.1663 126 42 0.754 0.246 0.035 127 42 0.754 0.508 0.035 128 43 0.933 0.067 0.279 129 43 0.933 0.866 0.279 130 45 0.391 0.782 0.159 131 45 0.218 0.609 0.159 132 46 0.482 0.741 0.3307 133 46 0.259 0.741 0.3307 134 47 0.42 0.84 0.9991 135 47 0.16 0.58 0.9991 136 1 0.5001 0.4999 0.5002 137 1 0.1667 0.3335 0.8336 138 2 0.3322 0.404 0.667 139 2 0.2626 0.2615 0.0004 140 3 0.1251 0.8749 0.5906 141 3 0.7917 0.5835 0.924 142 4 0.5964 0.4036 0.4137 143 4 0.263 0.5261 0.7471 144 5 0.3418 0.0634 0.5699 145 5 0.6032 0.6117 0.9033 146 6 0.2555 0.1277 0.4121 147 6 0.5389 0.4611 0.7455 148 7 0.4034 0.5966 0.5871 149 7 0.07 0.1401 0.9205 150 8 0.0615 0.7208 0.4304 151 8 0.9458 0.674 0.7638 152 9 0.1558 0.8442 0.635 153 9 0.8224 0.6449 0.9684 154 10 0.3575 0.4368 0.4611 155 10 0.2298 0.254 0.7945 156 11 0.6325 0.7012 0.3784 157 11 0.9654 0.2646 0.7118 158 12 0.3674 0.0699 0.6214 159 12 0.5967 0.6308 0.9548 160 13 0.2929 0.0534 0.4406 161 13 0.6132 0.5728 0.774 162 14 0.229 0.2868 0.5593 163 14 0.3798 0.2755 0.8927 164 15 0.6383 0.5633 0.5386 165 15 0.1033 0.4083 0.872 166 16 0.4441 0.5559 0.6271 167 16 0.1107 0.2215 0.9605 168 17 0.3137 0.1568 0.5535 169 17 0.5098 0.4902 0.8869 170 18 0.5711 0.4289 0.4592 171 18 0.2377 0.4755 0.7926 172 19 0.3051 0.1525 0.3617 173 19 0.5141 0.4859 0.6951 174 20 0.2727 0.5453 0.587 175 20 0.1213 0.0607 0.9204 176 21 0.5563 0.4437 0.3722 177 21 0.2229 0.4459 0.7056 178 22 0.0618 0.1235 0.5873 179 22 0.5431 0.2716 0.9207 180 23 0.1575 0.8426 0.4379 181 23 0.824 0.6482 0.7713 182 24 0.5433 0.2716 0.4073 183 24 0.395 0.605 0.7407 184 25 0.1217 0.0608 0.4042 185 25 0.6058 0.3942 0.7376 186 26 0.4321 0.5679 0.5378 187 26 0.0987 0.1975 0.8712 188 27 0.3521 0.176 0.6682 189 27 0.4906 0.5094 0.0016 190 28 0.0 0.0 0.3639 191 28 0.6667 0.3333 0.6973 192 29 0.0 0.0 0.6208 193 29 0.6667 0.3333 0.9542 194 30 0.0 0.0 0.5604 195 30 0.6667 0.3333 0.8938 196 31 0.0 0.0 0.4192 197 31 0.6667 0.3333 0.7526 198 32 0.1991 0.3981 0.3303 199 32 0.2685 0.1343 0.6637 200 33 0.2348 0.4695 0.5063 201 33 0.1971 0.0986 0.8397 202 34 0.2117 0.4233 0.5122 203 34 0.2433 0.1217 0.8456 204 35 0.5693 0.4307 0.6207 205 35 0.2359 0.4719 0.9541 206 36 0.5693 0.4307 0.6207 207 36 0.2359 0.4719 0.9541 208 37 0.4447 0.2223 0.4861 209 37 0.4443 0.5557 0.8195 210 38 0.4447 0.2223 0.4861 211 38 0.4443 0.5557 0.8195 212 39 0.4343 0.5657 0.3817 213 39 0.1009 0.2019 0.7151 214 40 0.4343 0.5657 0.3817 215 40 0.1009 0.2019 0.7151 216 41 0.5051 0.2525 0.4996 217 41 0.4141 0.5859 0.833 218 42 0.4207 0.5793 0.3683 219 42 0.0873 0.1747 0.7017 220 43 0.5997 0.4003 0.6123 221 43 0.2663 0.5327 0.9457 222 44 0.0 0.0 0.4703 223 44 0.6667 0.3333 0.8037 224 45 0.0577 0.1153 0.4923 225 45 0.5513 0.2757 0.8257 226 46 0.1487 0.0743 0.664 227 46 0.5923 0.4077 0.9974 228 47 0.0867 0.1733 0.3324 229 47 0.4933 0.2467 0.6658 230 48 0.0 0.0 0.4833 231 48 0.6667 0.3333 0.8167 232 49 0.6667 0.3333 0.5583 233 49 0.3333 0.6667 0.8917 234 50 0.6667 0.3333 0.5323 235 50 0.3333 0.6667 0.8657 236 51 0.3333 0.6667 0.4332 237 51 0.0 0.0 0.7666 238 1 0.5001 0.0001 0.5002 239 1 0.6665 0.8333 0.8336 240 1 0.9999 0.4999 0.5002 241 1 0.1667 0.8333 0.8336 242 2 0.596 0.9281 0.667 243 2 0.7385 0.0012 0.0004 244 2 0.0719 0.6678 0.667 245 2 0.9988 0.7373 0.0004 246 3 0.1251 0.2501 0.5906 247 3 0.4165 0.2083 0.924 248 3 0.7499 0.8749 0.5906 249 3 0.7917 0.2082 0.924 250 4 0.5964 0.1927 0.4137 251 4 0.4739 0.737 0.7471 252 4 0.8073 0.4036 0.4137 253 4 0.263 0.737 0.7471 254 5 0.9366 0.2783 0.5699 255 5 0.3883 0.9916 0.9033 256 5 0.7217 0.6582 0.5699 257 5 0.0084 0.3967 0.9033 258 6 0.8723 0.1277 0.4121 259 6 0.5389 0.0779 0.7455 260 6 0.8723 0.7445 0.4121 261 6 0.9221 0.461 0.7455 262 7 0.4034 0.8067 0.5871 263 7 0.8599 0.93 0.9205 264 7 0.1933 0.5966 0.5871 265 7 0.07 0.9299 0.9205 266 8 0.2792 0.3406 0.4304 267 8 0.326 0.2719 0.7638 268 8 0.6594 0.9385 0.4304 269 8 0.7281 0.0541 0.7638 270 9 0.1558 0.3115 0.635 271 9 0.3551 0.1776 0.9684 272 9 0.6885 0.8442 0.635 273 9 0.8224 0.1776 0.9684 274 10 0.5632 0.9206 0.4611 275 10 0.746 0.9759 0.7945 276 10 0.0794 0.6425 0.4611 277 10 0.0241 0.7702 0.7945 278 11 0.2988 0.9312 0.3784 279 11 0.7354 0.7009 0.7118 280 11 0.0688 0.3675 0.3784 281 11 0.2991 0.0345 0.7118 282 12 0.9301 0.2974 0.6214 283 12 0.3692 0.966 0.9548 284 12 0.7026 0.6326 0.6214 285 12 0.034 0.4032 0.9548 286 13 0.9466 0.2394 0.4406 287 13 0.4272 0.0405 0.774 288 13 0.7606 0.7071 0.4406 289 13 0.9595 0.3867 0.774 290 14 0.7132 0.9421 0.5593 291 14 0.7245 0.1044 0.8927 292 14 0.0579 0.771 0.5593 293 14 0.8956 0.6202 0.8927 294 15 0.4367 0.0749 0.5386 295 15 0.5917 0.6951 0.872 296 15 0.9251 0.3617 0.5386 297 15 0.3049 0.8966 0.872 298 16 0.4441 0.8881 0.6271 299 16 0.7785 0.8893 0.9605 300 16 0.1119 0.5559 0.6271 301 16 0.1107 0.8892 0.9605 302 17 0.8432 0.1568 0.5535 303 17 0.5098 0.0197 0.8869 304 17 0.8432 0.6863 0.5535 305 17 0.9803 0.4901 0.8869 306 18 0.5711 0.1421 0.4592 307 18 0.5245 0.7623 0.7926 308 18 0.8579 0.4289 0.4592 309 18 0.2377 0.7623 0.7926 310 19 0.8475 0.1525 0.3617 311 19 0.5141 0.0283 0.6951 312 19 0.8475 0.6949 0.3617 313 19 0.9717 0.4859 0.6951 314 20 0.4547 0.7273 0.587 315 20 0.9393 0.0607 0.9204 316 20 0.2727 0.7273 0.587 317 20 0.9393 0.8787 0.9204 318 21 0.5563 0.1125 0.3722 319 21 0.5541 0.7771 0.7056 320 21 0.8875 0.4437 0.3722 321 21 0.2229 0.7771 0.7056 322 22 0.8765 0.9382 0.5873 323 22 0.7284 0.2716 0.9207 324 22 0.0618 0.9382 0.5873 325 22 0.7284 0.4568 0.9207 326 23 0.1574 0.3148 0.4379 327 23 0.3518 0.1759 0.7713 328 23 0.6852 0.8425 0.4379 329 23 0.8241 0.1759 0.7713 330 24 0.7284 0.2716 0.4073 331 24 0.395 0.7901 0.7407 332 24 0.7284 0.4567 0.4073 333 24 0.2099 0.6049 0.7407 334 25 0.9392 0.0608 0.4042 335 25 0.6058 0.2117 0.7376 336 25 0.9392 0.8783 0.4042 337 25 0.7883 0.3941 0.7376 338 26 0.4321 0.8641 0.5378 339 26 0.8025 0.9013 0.8712 340 26 0.1359 0.5679 0.5378 341 26 0.0987 0.9012 0.8712 342 27 0.824 0.176 0.6682 343 27 0.4906 0.9813 0.0016 344 27 0.824 0.6479 0.6682 345 27 0.0187 0.5094 0.0016 346 32 0.6019 0.8009 0.3303 347 32 0.8657 0.1343 0.6637 348 32 0.1991 0.8009 0.3303 349 32 0.8657 0.7315 0.6637 350 33 0.5305 0.7652 0.5063 351 33 0.9014 0.0986 0.8397 352 33 0.2348 0.7652 0.5063 353 33 0.9014 0.8029 0.8397 354 34 0.5767 0.7883 0.5122 355 34 0.8783 0.1217 0.8456 356 34 0.2117 0.7883 0.5122 357 34 0.8783 0.7566 0.8456 358 35 0.5693 0.1385 0.6207 359 35 0.5281 0.7641 0.9541 360 35 0.8615 0.4307 0.6207 361 35 0.2359 0.7641 0.9541 362 36 0.5693 0.1385 0.6207 363 36 0.5281 0.7641 0.9541 364 36 0.8615 0.4307 0.6207 365 36 0.2359 0.7641 0.9541 366 37 0.7777 0.2223 0.4861 367 37 0.4443 0.8887 0.8195 368 37 0.7777 0.5553 0.4861 369 37 0.1113 0.5556 0.8195 370 38 0.7777 0.2223 0.4861 371 38 0.4443 0.8887 0.8195 372 38 0.7777 0.5553 0.4861 373 38 0.1113 0.5556 0.8195 374 39 0.4343 0.8685 0.3817 375 39 0.7981 0.8991 0.7151 376 39 0.1315 0.5657 0.3817 377 39 0.1009 0.899 0.7151 378 40 0.4343 0.8685 0.3817 379 40 0.7981 0.8991 0.7151 380 40 0.1315 0.5657 0.3817 381 40 0.1009 0.899 0.7151 382 41 0.7475 0.2525 0.4996 383 41 0.4141 0.8283 0.833 384 41 0.7475 0.4949 0.4996 385 41 0.1717 0.5858 0.833 386 42 0.4207 0.8413 0.3683 387 42 0.8253 0.9127 0.7017 388 42 0.1587 0.5793 0.3683 389 42 0.0873 0.9126 0.7017 390 43 0.5997 0.1993 0.6123 391 43 0.4673 0.7337 0.9457 392 43 0.8007 0.4003 0.6123 393 43 0.2663 0.7336 0.9457 394 45 0.8847 0.9423 0.4923 395 45 0.7243 0.2757 0.8257 396 45 0.0577 0.9423 0.4923 397 45 0.7243 0.4486 0.8257 398 46 0.9257 0.0743 0.664 399 46 0.5923 0.1847 0.9974 400 46 0.9257 0.8513 0.664 401 46 0.8153 0.4076 0.9974 402 47 0.8267 0.9133 0.3324 403 47 0.7533 0.2467 0.6658 404 47 0.0867 0.9133 0.3324 405 47 0.7533 0.5066 0.6658 406 2 0.4052 0.0707 0.3337 407 5 0.055 0.7301 0.2366 408 8 0.9927 0.3875 0.0971 409 10 0.4127 0.1035 0.1278 410 11 0.4021 0.3679 0.0451 411 12 0.0359 0.7366 0.2881 412 13 0.0939 0.7201 0.1073 413 14 0.3912 0.9535 0.226 414 15 0.2584 0.23 0.2053 415 2 0.6655 0.5948 0.3337 416 2 0.9293 0.3345 0.3337 417 5 0.6751 0.945 0.2366 418 5 0.2699 0.3249 0.2366 419 8 0.3948 0.0073 0.0971 420 8 0.6125 0.6052 0.0971 421 10 0.6908 0.5873 0.1278 422 10 0.8965 0.3092 0.1278 423 11 0.9658 0.5979 0.0451 424 11 0.6321 0.0342 0.0451 425 12 0.7007 0.9641 0.2881 426 12 0.2634 0.2993 0.2881 427 13 0.6262 0.9061 0.1073 428 13 0.2799 0.3738 0.1073 429 14 0.5623 0.6088 0.226 430 14 0.0465 0.4377 0.226 431 15 0.9716 0.7416 0.2053 432 15 0.77 0.0284 0.2053 433 2 0.3322 0.9281 0.667 434 2 0.2626 0.0012 0.0004 435 5 0.3418 0.2783 0.5699 436 5 0.6032 0.9916 0.9033 437 8 0.0615 0.3406 0.4304 438 8 0.9458 0.2719 0.7638 439 10 0.3575 0.9206 0.4611 440 10 0.2298 0.9759 0.7945 441 11 0.6325 0.9312 0.3784 442 11 0.9654 0.7009 0.7118 443 12 0.3674 0.2974 0.6214 444 12 0.5967 0.966 0.9548 445 13 0.2929 0.2394 0.4406 446 13 0.6132 0.0405 0.774 447 14 0.229 0.9421 0.5593 448 14 0.3798 0.1044 0.8927 449 15 0.6383 0.0749 0.5386 450 15 0.1033 0.6951 0.872 451 2 0.596 0.6678 0.667 452 2 0.7385 0.7374 0.0004 453 2 0.0719 0.404 0.667 454 2 0.9988 0.2615 0.0004 455 5 0.9366 0.6582 0.5699 456 5 0.3883 0.3968 0.9033 457 5 0.7217 0.0634 0.5699 458 5 0.0084 0.6117 0.9033 459 8 0.2792 0.9385 0.4304 460 8 0.326 0.0542 0.7638 461 8 0.6594 0.7208 0.4304 462 8 0.7281 0.674 0.7638 463 10 0.5632 0.6425 0.4611 464 10 0.746 0.7702 0.7945 465 10 0.0794 0.4368 0.4611 466 10 0.0241 0.254 0.7945 467 11 0.2988 0.3675 0.3784 468 11 0.7354 0.0346 0.7118 469 11 0.0688 0.7012 0.3784 470 11 0.2991 0.2646 0.7118 471 12 0.9301 0.6326 0.6214 472 12 0.3692 0.4033 0.9548 473 12 0.7026 0.0699 0.6214 474 12 0.034 0.6308 0.9548 475 13 0.9466 0.7071 0.4406 476 13 0.4272 0.3868 0.774 477 13 0.7606 0.0534 0.4406 478 13 0.9595 0.5728 0.774 479 14 0.7132 0.771 0.5593 480 14 0.7245 0.6202 0.8927 481 14 0.0579 0.2868 0.5593 482 14 0.8956 0.2755 0.8927 483 15 0.4367 0.3617 0.5386 484 15 0.5917 0.8967 0.872 485 15 0.9251 0.5633 0.5386 486 15 0.3049 0.4083 0.872 X-ray density (g/cm cub.) = 2.9 MU (1/cm) = 261.883 Mass attenuation coefficient (cm**2/g) = 90.339 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Zr 3.156 6 2.1114 10 2.0532 15 2.1346 18 2.0158 26 2.1114 10 2.0532 15 2 Ca ,Mn ,Ce 3.42 8 2.2745 16 2.3693 9 2.39 19 2.2374 21 3.3566 24 3.4117 40 2.2724 12 2.2379 11 3 Si 2.64 4 1.5334 9 1.5993 14 1.5565 22 1.5993 14 4 Si 2.64 4 1.5029 18 1.5895 21 1.6411 24 1.6411 24 5 Si 2.64 4 1.5832 12 1.6369 17 1.5817 15 1.6919 14 6 Si 2.64 4 1.6375 13 1.6337 19 1.6587 25 1.6375 13 7 Si 2.64 4 1.5637 16 1.6159 20 1.6417 26 1.616 20 8 Si 2.64 4 1.591 23 1.5584 10 1.5702 13 1.601 11 9 O 3.804 13 3.1293 12 3.4242 46 2.5973 14 3.2113 20 2.7166 22 3.4243 46 3.3535 11 2.6866 21 2.7578 40 2.6147 42 3.1293 12 2.5973 14 3.3535 11 10 O 3.804 11 3.5619 14 3.0841 18 2.8155 26 2.8699 40 3.2958 42 3.5407 51 2.571 23 2.9142 10 2.651 11 3.0033 15 2.5454 13 11 O 3.804 12 3.2511 21 2.4878 40 2.6261 42 2.5786 13 3.132 19 2.5048 23 3.2011 47 3.3539 9 2.8436 12 2.8502 46 2.651 10 3.2585 11 12 O 3.804 11 3.1293 9 2.6838 17 3.3821 46 2.6652 15 3.2622 16 2.8695 43 2.6007 47 2.8433 11 3.287 19 3.2231 12 2.6575 14 13 O 3.804 13 3.6517 17 2.7187 19 2.6222 23 3.4896 24 2.7105 25 2.6604 38 3.4152 41 2.5786 11 3.509 15 3.5318 18 3.2794 45 2.5453 10 2.6351 13 14 O 3.804 10 3.5619 10 2.6594 17 3.496 20 2.4885 22 3.6191 26 3.1557 45 2.5973 9 2.6551 15 2.6573 12 2.424 14 15 O 3.804 14 3.792 16 2.9024 18 2.9545 26 3.0469 43 3.5272 49 3.4822 50 2.6652 12 3.509 13 2.5701 17 2.575 38 2.4914 41 3.0033 10 2.6551 14 2.8561 15 16 O 3.804 11 3.792 15 2.6475 20 2.7023 26 3.2622 12 2.6476 20 2.6705 19 3.5954 21 3.6208 24 3.5954 21 3.792 15 3.2622 12 17 O 3.804 12 2.6838 12 3.6517 13 2.6594 14 3.5083 22 2.5872 38 2.8536 41 2.5701 15 3.5082 22 2.5701 15 2.6838 12 3.6517 13 2.6593 14 18 O 3.804 15 3.0841 10 2.9024 15 2.6421 21 2.5847 24 2.6808 38 2.502 41 3.7933 49 3.2153 50 3.5318 13 2.5847 24 2.6809 38 2.5019 41 3.0841 10 2.9024 15 3.5318 13 19 O 3.804 12 2.7187 13 3.2284 24 2.588 25 3.3688 47 3.132 11 3.3687 47 2.6708 16 3.2557 43 3.2873 12 3.132 11 2.7187 13 3.2871 12 20 O 3.804 10 3.496 14 2.6475 16 2.5825 26 3.2113 9 2.6476 16 2.5785 20 2.5785 20 2.5826 26 3.7686 21 3.4961 14 21 O 3.804 11 3.2511 11 2.6421 18 2.5776 24 3.0072 40 3.3294 42 2.5776 24 3.5956 16 3.7689 20 2.6867 9 3.5958 16 3.2511 11 22 O 3.804 12 2.4885 14 3.5083 17 2.8595 45 2.8606 46 3.4763 48 2.7166 9 3.5082 17 2.625 22 2.625 22 2.8605 46 3.4959 42 2.4884 14 23 O 3.804 10 2.6222 13 3.5226 25 2.571 10 2.5048 11 3.5232 25 2.9444 45 3.6174 47 2.6236 13 2.57 10 2.5057 11 24 O 3.804 12 3.4896 13 2.5847 18 3.2284 19 2.5776 21 2.6612 38 2.8158 41 2.5847 18 2.5776 21 2.6224 24 2.6224 24 3.6211 16 3.4897 13 25 O 3.804 14 2.7105 13 2.588 19 3.5226 23 2.4863 44 3.0235 45 2.8707 47 2.8089 48 3.5232 23 2.5854 25 2.5854 25 3.0234 45 2.8706 47 3.7704 43 2.7104 13 26 O 3.804 9 2.8155 10 3.6191 14 2.9545 15 2.7023 16 2.5825 20 2.5826 20 2.8155 10 3.6191 14 2.9545 15 27 Fe ,Fe 3.132 7 2.148 12 2.4987 46 1.7348 47 2.1889 11 3.0992 23 2.1481 12 2.1888 11 28 Zr ,Nb ,Ti 3.156 9 1.923 25 2.3282 47 1.923 25 1.9228 25 2.328 47 2.328 47 3.0384 43 3.0382 43 3.0382 43 29 Zr ,Nb ,Ti 3.156 6 1.8201 22 2.2396 46 1.8199 22 1.8199 22 2.2396 46 2.2394 46 30 Zr ,Zr 3.156 8 1.7182 22 2.7103 44 2.4898 45 2.3192 48 1.718 22 1.718 22 2.4896 45 2.4896 45 31 Si ,Si 2.64 8 1.5595 25 1.5371 44 2.6149 45 1.9282 48 1.5595 25 1.5592 25 2.6148 45 2.6148 45 32 Na ,Na 3.348 8 3.1134 42 2.7588 47 2.2111 11 3.1135 42 2.3836 12 1.4707 46 2.2111 11 2.3838 12 33 Na ,Na 3.348 9 2.427 10 3.0059 14 2.5996 20 2.5995 26 3.2689 51 2.7992 23 2.5996 26 2.4271 10 3.006 14 34 Na ,Na 3.348 8 2.5042 10 2.5062 14 2.7024 20 2.8535 26 2.6014 23 2.8537 26 2.5042 10 2.5063 14 35 Na ,Na 3.348 10 2.9576 15 3.0782 16 0.7876 43 3.039 49 2.5193 12 2.6133 19 2.6433 47 2.6432 47 2.9576 15 2.5193 12 36 K ,Sr 3.768 14 2.9576 15 3.0782 16 0.7876 43 3.039 49 3.5754 50 2.5193 12 3.5225 43 3.5224 43 2.6133 19 3.6271 25 2.6433 47 2.6432 47 2.9576 15 2.5193 12 37 Na ,Na 3.348 10 2.6604 13 2.5872 17 2.6808 18 2.6612 24 0.845 41 3.0578 50 2.575 15 2.6809 18 2.575 15 2.6605 13 38 O ,O 3.804 11 2.6604 13 2.5872 17 2.6808 18 2.6612 24 0.845 41 3.4836 49 3.0578 50 2.575 15 2.6809 18 2.575 15 2.6605 13 39 Na ,Na 3.348 10 2.8699 10 2.4878 11 3.0072 21 0.5233 42 2.9213 51 2.7019 46 2.7582 9 2.7019 46 2.8699 10 2.4878 11 40 O ,O 3.804 10 2.8699 10 2.4878 11 3.0072 21 0.5233 42 2.9213 51 2.7019 46 2.7582 9 2.7019 46 2.8699 10 2.4878 11 41 O ,O 3.804 13 3.4152 13 2.8536 17 2.502 18 2.8158 24 0.845 38 2.655 49 2.2133 50 2.4914 15 2.5019 18 3.4342 41 3.4342 41 2.4915 15 3.4154 13 42 O ,O 3.804 13 3.2958 10 2.6261 11 3.3294 21 0.5233 40 2.8989 51 3.7118 42 3.7118 42 3.4962 22 2.3005 46 2.6151 9 2.3005 46 3.2958 10 2.6261 11 43 O ,O 3.804 12 3.0469 15 2.3112 49 2.9145 50 2.8695 12 2.8475 43 2.8475 43 3.2554 19 3.7701 25 2.5125 47 2.5123 47 3.0469 15 2.8695 12 44 OH ,OH 3.852 10 3.832 22 2.4863 25 1.5622 45 0.3911 48 3.8319 22 3.8319 22 2.4863 25 2.4862 25 1.562 45 1.562 45 45 OH ,OH 3.852 16 3.1557 14 3.8413 17 2.8595 22 3.0235 25 1.5622 44 1.4408 48 3.2794 13 3.8413 17 3.8223 22 3.8223 22 2.9444 23 3.0234 25 2.4507 45 2.4507 45 3.2792 13 3.1556 14 46 OH ,OH 3.852 15 3.4242 9 3.3821 12 2.8606 22 3.4243 9 2.8605 22 3.1592 46 3.1592 46 2.7018 40 2.3003 42 3.5832 51 2.8502 11 2.702 40 2.3005 42 3.3821 12 2.8503 11 47 OH ,OH 3.852 13 3.3688 19 2.8707 25 3.2011 11 3.3687 19 3.6174 23 2.8706 25 3.6833 47 3.6833 47 2.6008 12 2.5126 43 2.5126 43 3.2009 11 2.6009 12 48 Cl ,Cl 4.344 19 4.0369 13 3.4763 22 4.097 23 2.8089 25 0.3911 44 1.4408 45 4.037 13 4.0367 13 3.4762 22 3.4762 22 4.0972 23 4.097 23 2.8089 25 2.8088 25 1.4405 45 1.4405 45 4.0368 13 4.037 13 4.0369 13 49 H(2)O,H(2)O 3.972 22 3.5272 15 3.7933 18 3.4836 38 2.655 41 2.3112 43 0.7821 50 3.5271 15 3.5272 15 3.7933 18 3.7933 18 3.4836 38 3.4837 38 2.655 41 2.6551 41 2.3111 43 2.3112 43 3.8685 47 3.8685 47 3.8685 47 3.5272 15 3.5271 15 3.5272 15 50 H(2)O,H(2)O 3.972 19 3.4822 15 3.2153 18 3.0578 38 2.2133 41 2.9145 43 0.7821 49 3.4821 15 3.4822 15 3.2152 18 3.2153 18 3.0578 38 3.0579 38 2.2133 41 2.2134 41 2.9144 43 2.9145 43 3.4822 15 3.4821 15 3.4822 15 51 H(2)O 3.972 18 3.5407 10 3.9712 26 2.9213 40 2.8989 42 3.5407 10 3.5407 10 3.9712 26 3.9712 26 2.9213 40 2.9213 40 2.8989 42 2.8989 42 3.5835 46 3.5835 46 3.5833 46 3.5407 10 3.5409 10 3.5407 10 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 1 4.516 9.032 0.044 319.64 6 187.5 246.8 2 0 0 3 5.118 10.236 0.05 248.36 2 184.6 61.9 3 1 0 -2 5.399 10.797 0.053 222.97 6 40.6 8.1 4 1 1 0 7.254 14.509 0.071 122.47 6 436.5 512.1 5 1 0 4 8.019 16.038 0.078 99.82 6 274.9 165.5 6 2 0 -1 8.558 17.116 0.083 87.38 6 146.3 41.0 7 1 1 3 8.894 17.788 0.086 80.74 12 28.5 2.9 8 2 0 2 9.06 18.12 0.088 77.72 6 357.9 218.6 9 1 0 -5 9.531 19.063 0.093 70.02 6 207.8 66.3 10 0 0 6 10.277 20.554 0.1 59.92 2 101.4 4.5 11 2 0 -4 10.846 21.692 0.105 53.59 6 149.9 26.4 12 2 1 1 11.254 22.509 0.109 49.61 12 30.9 2.1 13 2 1 -2 11.645 23.29 0.113 46.2 12 68.3 9.4 14 2 0 5 12.019 24.039 0.116 43.24 6 547.1 284.0 15 1 1 6 12.625 25.251 0.122 39.0 12 278.2 132.5 16 3 0 0 12.633 25.267 0.122 38.94 6 210.5 37.9 17 1 0 7 12.741 25.482 0.123 38.26 6 187.6 29.6 18 2 1 4 13.098 26.195 0.127 36.09 12 270.3 115.7 19 3 0 -3 13.663 27.325 0.132 33.0 6 145.6 15.4 20 3 0 3 13.663 27.325 0.132 33.0 6 465.0 156.6 21 2 1 -5 14.095 28.191 0.136 30.89 12 195.3 51.7 22 1 0 -8 14.407 28.813 0.139 29.48 6 351.0 79.7 23 2 2 0 14.628 29.257 0.141 28.54 6 365.9 83.9 24 2 0 -7 14.722 29.445 0.142 28.15 6 467.7 135.1 25 3 1 -1 15.339 30.679 0.148 25.78 12 344.7 134.5 26 0 0 9 15.522 31.045 0.15 25.13 2 409.0 30.7 27 2 2 3 15.536 31.071 0.15 25.08 12 252.6 70.2 28 3 1 2 15.635 31.269 0.151 24.74 12 141.8 21.8 29 2 0 8 16.201 32.402 0.156 22.91 6 523.1 137.6 30 3 0 -6 16.395 32.789 0.158 22.33 6 274.6 37.0 31 3 0 6 16.395 32.789 0.158 22.33 6 203.0 20.2 32 2 1 7 16.486 32.972 0.159 22.06 12 357.2 123.6 33 3 1 -4 16.769 33.538 0.161 21.26 12 102.2 9.7 34 4 0 1 17.045 34.091 0.164 20.52 6 74.9 2.5 35 1 1 9 17.212 34.424 0.165 20.09 12 332.9 97.7 36 4 0 -2 17.315 34.629 0.166 19.83 6 356.0 55.2 37 3 1 5 17.577 35.155 0.169 19.19 12 786.3 520.8 38 1 0 10 17.828 35.656 0.171 18.61 6 32.1 0.4 39 2 1 -8 17.834 35.667 0.171 18.59 12 241.6 47.7 40 2 2 6 18.012 36.023 0.173 18.19 12 288.1 66.3 41 4 0 4 18.357 36.714 0.176 17.45 6 1306.8 654.0 42 3 2 1 18.613 37.225 0.178 16.93 12 73.7 4.0 43 3 2 -2 18.863 37.725 0.181 16.44 12 118.2 10.1 44 4 0 -5 19.107 38.214 0.183 15.97 6 144.0 7.3 45 2 0 -10 19.34 38.68 0.185 15.55 6 442.9 66.9 46 4 1 0 19.517 39.034 0.187 15.24 12 290.1 56.3 47 1 0 -11 19.579 39.159 0.187 15.13 6 80.2 2.1 48 3 1 -7 19.59 39.18 0.187 15.12 12 410.1 111.6 49 3 2 4 19.835 39.67 0.19 14.7 12 364.0 85.5 50 3 0 -9 20.22 40.439 0.193 14.09 6 653.0 131.9 51 3 0 9 20.22 40.439 0.193 14.09 6 255.0 20.1 52 4 1 -3 20.23 40.46 0.193 14.07 12 27.4 0.5 53 4 1 3 20.23 40.46 0.193 14.07 12 44.4 1.2 54 3 2 -5 20.539 41.078 0.196 13.61 12 54.4 1.8 55 2 1 10 20.759 41.517 0.198 13.29 12 223.6 29.2 56 3 1 8 20.764 41.528 0.198 13.28 12 172.3 17.3 57 0 0 12 20.905 41.81 0.199 13.08 2 741.3 52.6 58 2 0 11 20.984 41.969 0.2 12.97 6 25.1 0.2 59 4 0 7 20.995 41.989 0.2 12.95 6 32.0 0.3 60 5 0 -1 21.453 42.905 0.204 12.34 6 402.2 43.8 61 2 2 9 21.59 43.18 0.206 12.17 12 206.2 22.7 62 5 0 2 21.675 43.35 0.206 12.06 6 85.8 1.9 63 4 0 -8 22.107 44.214 0.21 11.54 6 506.9 65.0 64 1 1 12 22.241 44.482 0.212 11.38 12 53.5 1.4 65 4 1 -6 22.256 44.512 0.212 11.36 12 229.9 26.4 66 4 1 6 22.256 44.512 0.212 11.36 12 40.1 0.8 67 3 3 0 22.261 44.521 0.212 11.36 6 279.8 19.5 68 2 1 -11 22.317 44.633 0.212 11.29 12 141.2 9.9 69 3 2 7 22.326 44.653 0.212 11.28 12 144.0 10.3 70 5 0 -4 22.547 45.093 0.214 11.03 6 76.1 1.4 71 4 2 -1 22.763 45.526 0.216 10.8 12 369.3 64.6 72 3 3 3 22.904 45.807 0.218 10.65 12 94.2 4.1 73 4 2 2 22.975 45.95 0.218 10.58 12 169.7 13.4 74 1 0 13 23.164 46.329 0.22 10.38 6 201.7 9.3 75 5 0 5 23.183 46.367 0.22 10.36 6 67.8 1.0 76 3 1 -10 23.383 46.766 0.222 10.16 12 147.0 9.6 77 3 2 -8 23.388 46.776 0.222 10.16 12 246.6 27.1 78 4 2 -4 23.809 47.618 0.226 9.75 12 52.5 1.2 79 5 1 1 24.017 48.033 0.228 9.56 12 180.9 13.7 80 5 1 -2 24.22 48.441 0.229 9.38 12 325.7 43.7 81 2 0 -13 24.402 48.805 0.231 9.22 6 27.4 0.2 82 4 2 5 24.421 48.841 0.231 9.21 12 308.1 38.4 83 4 0 10 24.613 49.225 0.233 9.05 6 851.8 144.1 84 3 0 -12 24.741 49.482 0.234 8.94 6 97.9 1.9 85 3 0 12 24.741 49.482 0.234 8.94 6 51.2 0.5 86 3 3 6 24.755 49.509 0.234 8.93 12 129.5 6.6 87 3 1 11 24.811 49.621 0.235 8.88 12 379.2 56.1 88 5 0 -7 24.82 49.639 0.235 8.88 6 309.7 18.7 89 1 0 -14 25.001 50.001 0.236 8.73 6 390.9 29.3 90 5 1 4 25.023 50.046 0.236 8.71 12 325.5 40.5 91 4 1 -9 25.344 50.689 0.239 8.46 12 209.6 16.3 92 4 1 9 25.344 50.689 0.239 8.46 12 97.8 3.6 93 2 1 13 25.595 51.19 0.241 8.27 12 11.0 0.0 94 5 1 -5 25.613 51.225 0.242 8.26 12 66.3 1.6 95 3 2 10 25.798 51.597 0.243 8.13 12 352.1 44.2 96 5 0 8 25.803 51.605 0.243 8.12 6 107.8 2.1 97 2 2 12 25.922 51.845 0.244 8.04 12 244.8 21.2 98 6 0 0 25.94 51.879 0.245 8.03 6 85.0 1.3 99 4 0 -11 25.99 51.979 0.245 7.99 6 40.3 0.3 100 4 2 -7 25.998 51.996 0.245 7.99 12 212.4 15.8 101 2 0 14 26.173 52.347 0.247 7.86 6 70.9 0.9 102 4 3 1 26.388 52.777 0.248 7.72 12 302.6 31.0 103 0 0 15 26.489 52.978 0.249 7.65 2 186.0 1.9 104 6 0 -3 26.515 53.03 0.25 7.64 6 333.7 18.7 105 6 0 3 26.515 53.03 0.25 7.64 6 39.8 0.3 106 4 3 -2 26.579 53.158 0.25 7.59 12 113.0 4.3 107 4 2 8 26.95 53.901 0.253 7.36 12 505.1 82.4 108 5 2 0 27.083 54.167 0.255 7.28 12 54.7 1.0 109 3 2 -11 27.132 54.263 0.255 7.25 12 231.9 17.1 110 5 1 7 27.14 54.28 0.255 7.24 12 171.6 9.4 111 2 1 -14 27.31 54.62 0.256 7.14 12 151.5 7.2 112 4 3 4 27.331 54.662 0.257 7.13 12 238.6 17.8 113 1 1 15 27.617 55.234 0.259 6.96 12 176.3 9.5 114 3 3 9 27.634 55.267 0.259 6.95 12 243.6 18.1 115 5 2 -3 27.642 55.284 0.259 6.95 12 181.0 10.0 116 5 2 3 27.642 55.284 0.259 6.95 12 0.8 0.0 117 3 1 -13 27.87 55.739 0.261 6.82 12 245.0 18.0 118 4 3 -5 27.886 55.773 0.261 6.81 12 155.2 7.2 119 5 0 -10 28.061 56.123 0.263 6.71 6 159.3 3.7 120 5 1 -8 28.066 56.131 0.263 6.71 12 12.6 0.0 121 6 0 -6 28.191 56.382 0.264 6.64 6 351.4 18.0 122 6 0 6 28.191 56.382 0.264 6.64 6 469.9 32.2 123 6 1 -1 28.619 57.239 0.268 6.42 12 341.8 32.9 124 1 0 16 28.771 57.543 0.269 6.34 6 234.3 7.6 125 6 1 2 28.8 57.599 0.269 6.33 12 264.2 19.4 126 4 0 13 28.961 57.922 0.271 6.25 6 49.0 0.3 127 4 2 -10 29.148 58.296 0.272 6.16 12 299.4 24.2 128 4 1 -12 29.262 58.525 0.273 6.11 12 234.1 14.7 129 4 1 12 29.262 58.525 0.273 6.11 12 310.2 25.8 130 5 2 -6 29.275 58.549 0.273 6.1 12 369.8 36.6 131 5 2 6 29.275 58.549 0.273 6.1 12 184.0 9.1 132 5 0 11 29.325 58.649 0.274 6.08 6 175.5 4.1 133 4 3 7 29.333 58.665 0.274 6.07 12 298.1 23.7 134 3 1 14 29.494 58.988 0.275 6.0 12 54.5 0.8 135 6 1 -4 29.514 59.028 0.275 5.99 12 185.6 9.1 136 3 0 -15 29.786 59.572 0.278 5.87 6 167.6 3.6 137 3 0 15 29.786 59.572 0.278 5.87 6 108.9 1.5 138 2 0 -16 29.842 59.683 0.278 5.84 6 230.2 6.8 139 3 2 13 30.027 60.054 0.28 5.76 12 197.4 9.9 140 6 1 5 30.043 60.086 0.28 5.76 12 156.2 6.2 141 5 1 10 30.21 60.42 0.281 5.68 12 456.0 51.9 142 4 3 -8 30.214 60.428 0.281 5.68 12 72.0 1.3 143 4 4 0 30.338 60.675 0.282 5.63 6 1151.6 163.9 144 4 2 11 30.383 60.765 0.283 5.61 12 419.8 43.4 145 4 0 -14 30.549 61.097 0.284 5.54 6 833.3 84.5 146 1 0 -17 30.712 61.424 0.285 5.48 6 97.4 1.1 147 5 3 -1 30.743 61.487 0.286 5.47 12 363.4 31.7 148 7 0 1 30.743 61.487 0.286 5.47 6 63.9 0.5 149 2 2 15 30.835 61.669 0.287 5.43 12 383.6 35.1 150 6 0 -9 30.85 61.7 0.287 5.43 6 35.9 0.2 151 6 0 9 30.85 61.7 0.287 5.43 6 255.0 7.7 152 4 4 3 30.858 61.716 0.287 5.42 12 131.0 4.1 153 2 1 16 30.889 61.778 0.287 5.41 12 134.2 4.3 154 5 3 2 30.916 61.832 0.287 5.4 12 149.2 5.3 155 7 0 -2 30.916 61.832 0.287 5.4 6 88.7 0.9 156 3 3 12 31.36 62.72 0.291 5.23 12 182.7 7.7 157 5 1 -11 31.419 62.839 0.291 5.21 12 18.1 0.1 158 6 1 -7 31.427 62.854 0.291 5.21 12 58.1 0.8 159 3 2 -14 31.582 63.164 0.293 5.15 12 375.5 31.9 160 5 3 -4 31.601 63.203 0.293 5.15 12 103.0 2.4 161 7 0 4 31.601 63.203 0.293 5.15 6 173.2 3.4 162 2 0 17 31.743 63.485 0.294 5.1 6 197.2 4.3 163 6 2 1 31.773 63.547 0.294 5.08 12 265.7 15.8 164 5 2 -9 31.878 63.756 0.295 5.05 12 95.9 2.0 165 5 2 9 31.878 63.756 0.295 5.05 12 9.9 0.0 166 6 2 -2 31.943 63.886 0.296 5.03 12 415.5 38.1 167 5 0 -13 32.095 64.189 0.297 4.97 6 113.6 1.4 168 5 3 5 32.11 64.22 0.297 4.97 12 35.3 0.3 169 7 0 -5 32.11 64.22 0.297 4.97 6 469.2 24.0 170 4 3 10 32.271 64.542 0.298 4.92 12 31.5 0.2 171 6 1 8 32.275 64.549 0.298 4.91 12 120.6 3.1 172 0 0 18 32.36 64.719 0.299 4.89 2 584.0 12.2 173 4 4 6 32.39 64.78 0.299 4.88 12 656.1 92.2 174 6 2 4 32.616 65.232 0.301 4.8 12 172.7 6.3 175 2 1 -17 32.755 65.51 0.302 4.76 12 94.3 1.9 176 3 1 -16 32.925 65.851 0.304 4.71 12 284.7 16.7 177 4 2 -13 33.101 66.202 0.305 4.65 12 376.9 29.0 178 6 2 -5 33.116 66.232 0.305 4.65 12 461.9 43.6 179 1 1 18 33.362 66.724 0.307 4.58 12 343.4 23.7 180 7 1 0 33.395 66.791 0.308 4.57 12 76.5 1.2 181 4 3 -11 33.438 66.876 0.308 4.56 12 134.3 3.6 182 5 3 -7 33.446 66.891 0.308 4.55 12 21.2 0.1 183 7 0 7 33.446 66.891 0.308 4.55 6 263.1 6.9 184 5 0 14 33.596 67.191 0.309 4.51 6 201.8 4.0 185 4 1 -15 33.867 67.735 0.312 4.43 12 89.0 1.5 186 4 1 15 33.867 67.735 0.312 4.43 12 212.9 8.8 187 7 1 -3 33.89 67.779 0.312 4.43 12 284.0 15.7 188 7 1 3 33.89 67.779 0.312 4.43 12 73.1 1.0 189 4 0 16 33.919 67.838 0.312 4.42 6 876.2 74.5 190 5 1 13 34.092 68.185 0.313 4.37 12 58.3 0.7 191 6 1 -10 34.263 68.526 0.315 4.33 12 397.3 30.0 192 5 3 8 34.267 68.534 0.315 4.33 12 41.3 0.3 193 7 0 -8 34.267 68.534 0.315 4.33 6 256.0 6.2 194 6 0 -12 34.368 68.735 0.316 4.3 6 62.5 0.4 195 6 0 12 34.368 68.735 0.316 4.3 6 238.8 5.4 196 6 2 7 34.432 68.864 0.316 4.29 12 380.9 27.3 197 4 2 14 34.58 69.16 0.317 4.25 12 238.2 10.6 198 1 0 19 34.726 69.452 0.318 4.21 6 173.5 2.8 199 3 1 17 34.733 69.466 0.318 4.21 12 205.0 7.8 200 5 4 1 34.762 69.525 0.319 4.2 12 59.1 0.6 201 4 4 9 34.863 69.725 0.32 4.18 12 91.5 1.5 202 3 2 16 34.899 69.798 0.32 4.17 12 525.4 50.5 203 5 4 -2 34.925 69.849 0.32 4.16 12 30.2 0.2 204 6 2 -8 35.242 70.484 0.323 4.09 12 27.3 0.1 205 3 0 -18 35.324 70.647 0.323 4.07 6 63.9 0.4 206 3 0 18 35.324 70.647 0.323 4.07 6 274.2 6.7 207 5 2 -12 35.342 70.683 0.323 4.06 12 135.5 3.3 208 5 2 12 35.342 70.683 0.323 4.06 12 335.1 20.0 209 7 1 -6 35.353 70.705 0.323 4.06 12 79.2 1.1 210 7 1 6 35.353 70.705 0.323 4.06 12 45.0 0.4 211 6 3 0 35.356 70.713 0.323 4.06 12 363.1 23.5 212 6 1 11 35.398 70.796 0.324 4.05 12 125.1 2.8 213 5 1 -14 35.551 71.103 0.325 4.02 12 466.6 38.4 214 5 4 4 35.569 71.139 0.325 4.01 12 385.1 26.1 215 2 0 -19 35.696 71.391 0.326 3.99 6 52.6 0.2 216 4 0 -17 35.703 71.406 0.326 3.98 6 50.5 0.2 217 8 0 -1 35.732 71.463 0.326 3.98 6 305.5 8.1 218 3 3 15 35.816 71.632 0.327 3.96 12 100.1 1.7 219 6 3 -3 35.838 71.676 0.327 3.95 12 222.5 8.6 220 6 3 3 35.838 71.676 0.327 3.95 12 127.8 2.8 221 8 0 2 35.892 71.784 0.328 3.94 6 569.6 28.1 222 4 3 13 36.036 72.071 0.329 3.91 12 366.5 23.1 223 5 4 -5 36.05 72.1 0.329 3.91 12 64.1 0.7 224 5 3 -10 36.202 72.405 0.33 3.88 12 17.2 0.1 225 7 0 10 36.202 72.405 0.33 3.88 6 154.4 2.0 226 2 2 18 36.286 72.573 0.331 3.86 12 208.7 7.4 227 8 0 -4 36.53 73.059 0.333 3.81 6 417.9 14.6 228 2 1 19 36.654 73.309 0.334 3.79 12 143.1 3.4 229 3 2 -17 36.661 73.323 0.334 3.78 12 55.1 0.5 230 7 2 -1 36.69 73.38 0.334 3.78 12 183.4 5.6 231 1 0 -20 36.809 73.619 0.335 3.76 6 216.6 3.9 232 5 0 -16 36.824 73.647 0.335 3.75 6 439.6 15.9 233 7 2 2 36.849 73.697 0.335 3.75 12 270.8 12.1 234 8 0 5 37.005 74.01 0.336 3.72 6 55.7 0.3 235 6 2 10 37.156 74.312 0.338 3.69 12 322.8 16.9 236 6 3 -6 37.268 74.535 0.338 3.67 12 215.6 7.5 237 6 3 6 37.268 74.535 0.338 3.67 12 266.1 11.4 238 5 3 11 37.312 74.624 0.339 3.66 12 425.4 29.1 239 7 0 -11 37.312 74.624 0.339 3.66 6 408.7 13.4 240 5 4 7 37.319 74.638 0.339 3.66 12 208.1 7.0 241 4 3 -14 37.462 74.924 0.34 3.64 12 270.2 11.7 242 7 2 -4 37.48 74.96 0.34 3.63 12 250.5 10.0 243 7 1 -9 37.736 75.472 0.342 3.59 12 186.6 5.5 244 7 1 9 37.736 75.472 0.342 3.59 12 223.2 7.8 245 2 0 20 37.757 75.514 0.342 3.58 6 258.2 5.2 246 4 2 -16 37.771 75.542 0.342 3.58 12 389.2 23.8 247 6 1 -13 37.937 75.874 0.344 3.55 12 62.8 0.6 248 7 2 5 37.951 75.902 0.344 3.55 12 154.9 3.7 249 5 4 -8 38.104 76.208 0.345 3.53 12 228.4 8.1 250 4 4 12 38.201 76.402 0.346 3.51 12 391.8 23.7 251 6 2 -11 38.255 76.51 0.346 3.5 12 153.1 3.6 252 8 0 -7 38.262 76.525 0.346 3.5 6 28.1 0.1 253 3 1 -19 38.545 77.089 0.348 3.46 12 234.7 8.4 254 5 0 17 38.552 77.103 0.348 3.46 6 128.1 1.2 255 8 1 1 38.58 77.159 0.349 3.45 12 147.3 3.3 256 0 0 21 38.641 77.282 0.349 3.44 2 338.3 2.9 257 6 0 -15 38.662 77.324 0.349 3.44 6 360.1 9.8 258 6 0 15 38.662 77.324 0.349 3.44 6 388.6 11.4 259 2 1 -20 38.697 77.394 0.349 3.43 12 320.3 15.5 260 5 1 16 38.711 77.422 0.35 3.43 12 71.1 0.8 261 8 1 -2 38.735 77.471 0.35 3.43 12 80.7 1.0 262 8 0 8 39.041 78.082 0.352 3.38 6 561.2 23.4 263 4 1 -18 39.12 78.239 0.353 3.37 12 142.1 3.0 264 4 1 18 39.12 78.239 0.353 3.37 12 130.0 2.5 265 5 5 0 39.151 78.302 0.353 3.37 6 461.5 15.7 266 7 2 -7 39.198 78.396 0.353 3.36 12 178.0 4.7 267 6 1 14 39.339 78.679 0.354 3.34 12 65.8 0.6 268 8 1 4 39.357 78.714 0.354 3.34 12 36.6 0.2 269 4 0 19 39.478 78.957 0.355 3.32 6 115.8 1.0 270 4 2 17 39.485 78.971 0.355 3.32 12 38.6 0.2 271 6 4 -1 39.513 79.027 0.356 3.32 12 351.0 17.9 272 1 1 21 39.574 79.148 0.356 3.31 12 221.5 7.1 273 5 2 -15 39.595 79.19 0.356 3.31 12 357.2 18.5 274 5 2 15 39.595 79.19 0.356 3.31 12 115.9 1.9 275 6 3 -9 39.609 79.218 0.356 3.31 12 40.4 0.2 276 6 3 9 39.609 79.218 0.356 3.31 12 182.0 4.8 277 5 5 3 39.616 79.232 0.356 3.3 12 22.7 0.1 278 6 4 2 39.668 79.336 0.357 3.3 12 356.2 18.4 279 5 3 -13 39.807 79.614 0.358 3.28 12 87.5 1.1 280 7 0 13 39.807 79.614 0.358 3.28 6 313.9 7.1 281 8 1 -5 39.821 79.642 0.358 3.28 12 489.6 34.5 282 5 4 10 39.968 79.937 0.359 3.26 12 13.5 0.0 283 7 2 8 39.972 79.944 0.359 3.26 12 113.6 1.8 284 6 4 -4 40.286 80.571 0.361 3.22 12 139.6 2.8 285 3 2 19 40.407 80.813 0.362 3.21 12 117.6 1.9 286 5 1 -17 40.413 80.827 0.362 3.2 12 141.7 2.8 287 7 3 1 40.441 80.883 0.363 3.2 12 268.4 10.1 288 3 1 20 40.557 81.114 0.363 3.19 12 146.3 3.0 289 4 3 16 40.571 81.142 0.364 3.19 12 161.4 3.6 290 7 3 -2 40.595 81.19 0.364 3.18 12 41.4 0.2 291 6 2 13 40.733 81.466 0.365 3.17 12 65.3 0.6 292 6 4 5 40.747 81.494 0.365 3.17 12 153.7 3.3 293 8 0 -10 40.894 81.788 0.366 3.15 6 812.5 45.6 294 3 3 18 40.975 81.95 0.367 3.14 12 135.8 2.5 295 7 1 -12 40.992 81.984 0.367 3.14 12 87.7 1.1 296 7 1 12 40.992 81.984 0.367 3.14 12 85.0 1.0 297 5 5 6 41.002 82.005 0.367 3.14 12 742.5 75.9 298 9 0 0 41.006 82.012 0.367 3.14 6 156.8 1.7 299 5 4 -11 41.046 82.091 0.367 3.13 12 71.4 0.7 300 8 1 7 41.052 82.105 0.367 3.13 12 210.7 6.1 301 1 0 22 41.164 82.329 0.368 3.12 6 88.4 0.5 302 5 3 14 41.192 82.384 0.368 3.12 12 167.3 3.8 303 7 0 -14 41.192 82.384 0.368 3.12 6 111.1 0.8 304 7 3 4 41.209 82.419 0.368 3.12 12 50.8 0.4 305 3 0 -21 41.424 82.849 0.37 3.09 6 703.7 33.6 306 3 0 21 41.424 82.849 0.37 3.09 6 177.7 2.1 307 9 0 -3 41.466 82.932 0.37 3.09 6 150.1 1.5 308 9 0 3 41.466 82.932 0.37 3.09 6 73.4 0.4 309 4 0 -20 41.479 82.959 0.37 3.09 6 852.9 49.3 310 7 3 -5 41.669 83.338 0.372 3.07 12 140.8 2.7 311 7 2 -10 41.815 83.63 0.373 3.06 12 337.9 15.3 312 8 1 -8 41.818 83.637 0.373 3.06 12 97.2 1.3 313 8 2 0 41.927 83.853 0.374 3.05 12 419.1 23.5 314 8 0 11 41.966 83.932 0.374 3.04 6 14.8 0.0 315 6 4 -7 41.973 83.946 0.374 3.04 12 371.6 18.4 316 2 0 -22 42.084 84.169 0.375 3.03 6 401.9 10.7 317 6 2 -14 42.112 84.224 0.375 3.03 12 287.8 11.0 318 5 0 -19 42.249 84.498 0.376 3.02 6 342.6 7.8 319 4 3 -17 42.256 84.512 0.376 3.02 12 246.3 8.0 320 2 2 21 42.343 84.687 0.377 3.01 12 316.4 13.2 321 4 4 15 42.364 84.728 0.377 3.01 12 203.1 5.4 322 8 2 -3 42.385 84.77 0.377 3.0 12 78.2 0.8 323 8 2 3 42.385 84.77 0.377 3.0 12 435.9 25.1 324 3 2 -20 42.398 84.797 0.377 3.0 12 22.9 0.1 325 6 1 -16 42.412 84.824 0.377 3.0 12 58.8 0.5 326 6 4 8 42.736 85.472 0.379 2.97 12 143.8 2.7 327 6 3 -12 42.83 85.661 0.38 2.97 12 201.7 5.3 328 6 3 12 42.83 85.661 0.38 2.97 12 77.5 0.8 329 9 0 -6 42.841 85.681 0.38 2.97 6 95.8 0.6 330 9 0 6 42.841 85.681 0.38 2.97 6 172.1 1.9 331 7 2 11 42.883 85.767 0.38 2.96 12 57.6 0.4 332 7 3 7 42.89 85.78 0.38 2.96 12 120.3 1.9 333 2 1 22 43.001 86.003 0.381 2.95 12 198.9 5.1 334 4 2 -19 43.166 86.331 0.382 2.94 12 148.0 2.8 335 5 5 9 43.294 86.588 0.383 2.93 12 2.2 0.0 336 1 0 -23 43.455 86.909 0.384 2.92 6 29.1 0.1 337 5 4 13 43.489 86.978 0.385 2.92 12 112.3 1.6 338 8 1 10 43.648 87.296 0.386 2.91 12 103.4 1.4 339 7 3 -8 43.652 87.303 0.386 2.91 12 28.4 0.1 340 6 0 -18 43.728 87.457 0.386 2.9 6 555.9 19.7 341 6 0 18 43.728 87.457 0.386 2.9 6 28.1 0.1 342 8 2 -6 43.756 87.512 0.387 2.9 12 247.6 7.8 343 8 2 6 43.756 87.512 0.387 2.9 12 95.6 1.2 344 5 1 19 44.08 88.161 0.389 2.88 12 38.4 0.2 345 6 1 17 44.087 88.174 0.389 2.88 12 94.5 1.1 346 6 5 1 44.115 88.229 0.389 2.88 12 83.0 0.9 347 9 1 -1 44.115 88.229 0.389 2.88 12 129.8 2.1 348 5 0 20 44.229 88.458 0.39 2.87 6 76.9 0.4 349 5 3 -16 44.243 88.485 0.39 2.87 12 62.1 0.5 350 7 0 16 44.243 88.485 0.39 2.87 6 60.5 0.2 351 6 5 -2 44.267 88.533 0.39 2.87 12 81.8 0.8 352 9 1 2 44.267 88.533 0.39 2.87 12 371.4 17.4 353 2 0 23 44.369 88.738 0.391 2.86 6 106.9 0.7 354 8 0 -13 44.403 88.807 0.391 2.86 6 263.7 4.4 355 6 4 -10 44.562 89.124 0.392 2.85 12 237.8 7.1 356 5 2 -18 44.642 89.285 0.393 2.85 12 164.5 3.4 357 5 2 18 44.642 89.285 0.393 2.85 12 59.9 0.4 358 7 4 0 44.673 89.346 0.393 2.85 12 32.5 0.1 359 8 1 -11 44.712 89.425 0.393 2.84 12 145.7 2.6 360 3 1 -22 44.83 89.66 0.394 2.84 12 80.7 0.8 361 5 4 -14 44.858 89.715 0.394 2.84 12 227.7 6.5 362 6 5 4 44.875 89.749 0.394 2.83 12 189.7 4.5 363 9 1 -4 44.875 89.749 0.394 2.83 12 46.7 0.3 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 0 1 4.516 9.032 11.36039 246.8 37.7 38.5 5.6 2 0 0 3 5.118 10.236 10.027 61.9 9.5 9.7 5.6 3 1 0 2 5.399 10.797 9.50708 8.1 1.2 1.3 5.6 4 1 1 0 7.254 14.509 7.0835 512.1 78.3 79.6 5.6 5 1 0 4 8.019 16.038 6.41165 165.5 25.3 25.7 5.6 6 2 0 1 8.558 17.116 6.01078 41.0 6.3 6.4 5.6 7 2 0 2 9.06 18.12 5.6802 218.6 33.4 33.9 5.6 8 1 0 5 9.531 19.063 5.40172 66.3 10.1 10.3 5.6 9 2 0 4 10.846 21.692 4.75354 26.4 4.0 4.1 5.6 10 2 1 2 11.645 23.29 4.4314 9.4 1.4 1.5 5.6 11 2 0 5 12.019 24.039 4.29531 284.0 43.4 43.9 5.6 12 1 1 6 12.625 25.251 4.09222 170.4 26.1 26.3 5.6 13 1 0 7 12.741 25.482 4.05571 29.6 4.5 4.6 5.6 14 2 1 4 13.098 26.195 3.94714 115.7 17.7 17.9 5.6 15 3 0 3 13.663 27.325 3.7868 172.0 26.3 26.5 5.6 16 2 1 5 14.095 28.191 3.67281 51.7 7.9 8.0 5.6 17 1 0 8 14.407 28.813 3.59508 79.7 12.2 12.3 5.6 18 2 2 0 14.628 29.257 3.54175 83.9 12.8 12.9 5.6 19 2 0 7 14.722 29.445 3.51963 135.1 20.7 20.8 5.6 20 3 1 1 15.339 30.679 3.38124 134.5 20.6 20.7 5.6 21 2 2 3 15.536 31.071 3.33954 101.0 15.4 15.5 5.6 22 3 1 2 15.635 31.269 3.31892 21.8 3.3 3.4 5.6 23 2 0 8 16.201 32.402 3.20582 137.6 21.0 21.1 5.6 24 3 0 6 16.395 32.789 3.16903 57.2 8.7 8.8 5.6 25 2 1 7 16.486 32.972 3.15198 123.6 18.9 19.0 5.6 26 3 1 4 16.769 33.538 3.1002 9.7 1.5 1.5 5.7 27 1 1 9 17.212 34.424 3.02274 97.7 14.9 15.0 5.7 28 4 0 2 17.315 34.629 3.00539 55.2 8.4 8.4 5.7 29 3 1 5 17.577 35.155 2.96186 520.8 79.6 79.7 5.7 30 2 1 8 17.834 35.667 2.92064 47.7 7.3 7.3 5.7 31 2 2 6 18.012 36.023 2.89273 66.3 10.1 10.1 5.7 32 4 0 4 18.357 36.714 2.8401 654.0 100.0 100.0 5.7 33 3 2 2 18.863 37.725 2.76667 10.1 1.5 1.5 5.7 34 4 0 5 19.107 38.214 2.7326 7.3 1.1 1.1 5.7 35 2 0 10 19.34 38.68 2.70086 66.9 10.2 10.2 5.7 36 4 1 0 19.517 39.034 2.67731 56.3 8.6 8.6 5.7 37 3 1 7 19.59 39.18 2.66772 113.7 17.4 17.3 5.7 38 3 2 4 19.835 39.67 2.6361 85.5 13.1 13.0 5.7 39 3 0 9 20.22 40.439 2.58799 153.6 23.5 23.4 5.7 40 2 1 10 20.759 41.517 2.52364 46.5 7.1 7.1 5.7 41 0 0 12 20.905 41.81 2.50675 52.6 8.0 8.0 5.7 42 5 0 1 21.453 42.905 2.44567 43.8 6.7 6.7 5.7 43 2 2 9 21.59 43.18 2.43083 22.7 3.5 3.5 5.7 44 4 0 8 22.107 44.214 2.37677 65.0 9.9 9.9 5.7 45 3 3 0 22.261 44.521 2.36117 48.1 7.4 7.3 5.7 46 3 2 7 22.326 44.653 2.35458 20.1 3.1 3.1 5.7 47 4 2 1 22.763 45.526 2.31176 64.6 9.9 9.8 5.7 48 4 2 2 22.975 45.95 2.29155 13.4 2.0 2.0 5.7 49 1 0 13 23.164 46.329 2.27384 10.3 1.6 1.6 5.7 50 3 2 8 23.388 46.776 2.25331 36.8 5.6 5.6 5.7 51 5 1 1 24.017 48.033 2.19769 13.7 2.1 2.1 5.7 52 5 1 2 24.22 48.441 2.1803 43.7 6.7 6.6 5.7 53 4 2 5 24.421 48.841 2.16351 38.4 5.9 5.8 5.7 54 4 0 10 24.613 49.225 2.14765 144.1 22.0 21.7 5.7 55 3 3 6 24.755 49.509 2.13612 9.0 1.4 1.4 5.7 56 3 1 11 24.811 49.621 2.1316 74.7 11.4 11.3 5.7 57 5 1 4 25.023 50.046 2.11466 69.8 10.7 10.5 5.7 58 4 1 9 25.344 50.689 2.08958 19.9 3.0 3.0 5.8 59 3 2 10 25.798 51.597 2.05527 46.3 7.1 7.0 5.8 60 2 2 12 25.922 51.845 2.04611 22.4 3.4 3.4 5.8 61 4 2 7 25.998 51.996 2.04055 15.8 2.4 2.4 5.8 62 4 3 1 26.388 52.777 2.01249 31.0 4.7 4.7 5.8 63 6 0 3 26.515 53.03 2.00359 20.9 3.2 3.1 5.8 64 4 2 8 26.95 53.901 1.97357 82.4 12.6 12.4 5.8 65 3 2 11 27.132 54.263 1.96137 26.5 4.0 4.0 5.8 66 4 3 4 27.331 54.662 1.94815 25.0 3.8 3.7 5.8 67 5 2 3 27.642 55.284 1.92795 37.6 5.7 5.6 5.8 68 3 1 13 27.87 55.739 1.91344 25.2 3.8 3.8 5.8 69 6 0 6 28.191 56.382 1.8934 50.2 7.7 7.5 5.8 70 6 1 1 28.619 57.239 1.86739 32.9 5.0 4.9 5.8 71 6 1 2 28.8 57.599 1.85669 27.0 4.1 4.0 5.8 72 4 2 10 29.148 58.296 1.83641 24.2 3.7 3.6 5.8 73 5 2 6 29.275 58.549 1.82918 86.2 13.2 12.8 5.8 74 4 3 7 29.333 58.665 1.82588 27.8 4.2 4.1 5.8 75 6 1 4 29.514 59.028 1.81565 9.1 1.4 1.3 5.8 76 2 0 16 29.842 59.683 1.79754 6.8 1.0 1.0 5.8 77 3 2 13 30.027 60.054 1.78745 16.0 2.4 2.4 5.8 78 5 1 10 30.21 60.42 1.77764 53.2 8.1 7.9 5.8 79 4 4 0 30.338 60.675 1.77087 163.9 25.1 24.4 5.8 80 4 2 11 30.383 60.765 1.7685 43.4 6.6 6.4 5.8 81 4 0 14 30.549 61.097 1.75981 84.5 12.9 12.5 5.8 82 5 3 1 30.743 61.487 1.74974 32.2 4.9 4.8 5.8 83 2 2 15 30.835 61.669 1.74508 47.1 7.2 7.0 5.8 84 5 3 2 30.916 61.832 1.74093 10.5 1.6 1.6 5.8 85 3 3 12 31.36 62.72 1.71876 7.7 1.2 1.1 5.8 86 3 2 14 31.582 63.164 1.7079 37.7 5.8 5.6 5.9 87 6 2 1 31.773 63.547 1.69869 15.8 2.4 2.3 5.9 88 6 2 2 31.943 63.886 1.69062 38.1 5.8 5.6 5.9 89 7 0 5 32.11 64.22 1.68275 25.7 3.9 3.8 5.9 90 0 0 18 32.36 64.719 1.67117 12.2 1.9 1.8 5.9 91 4 4 6 32.39 64.78 1.66977 92.2 14.1 13.6 5.9 92 3 1 16 32.925 65.851 1.6456 16.7 2.6 2.5 5.9 93 6 2 5 33.116 66.232 1.63719 72.6 11.1 10.7 5.9 94 1 1 18 33.362 66.724 1.62651 23.7 3.6 3.5 5.9 95 7 0 7 33.446 66.891 1.62291 10.6 1.6 1.6 5.9 96 4 0 16 33.919 67.838 1.60291 101.6 15.5 14.9 5.9 97 6 1 10 34.263 68.526 1.58875 36.5 5.6 5.4 5.9 98 6 2 7 34.432 68.864 1.58193 27.3 4.2 4.0 5.9 99 4 2 14 34.58 69.16 1.57599 10.6 1.6 1.6 5.9 100 3 1 17 34.733 69.466 1.5699 10.5 1.6 1.5 5.9 101 3 2 16 34.899 69.798 1.56338 50.7 7.7 7.4 5.9 102 5 2 12 35.342 70.683 1.5463 55.0 8.4 8.0 5.9 103 5 1 14 35.551 71.103 1.53837 64.5 9.9 9.4 5.9 104 8 0 1 35.732 71.463 1.53163 8.1 1.2 1.2 5.9 105 6 3 3 35.838 71.676 1.5277 13.2 2.0 1.9 5.9 106 8 0 2 35.892 71.784 1.52571 28.1 4.3 4.1 5.9 107 4 3 13 36.036 72.071 1.52045 23.8 3.6 3.5 5.9 108 2 2 18 36.286 72.573 1.51137 7.4 1.1 1.1 6.0 109 8 0 4 36.53 73.059 1.50269 14.6 2.2 2.1 6.0 110 5 0 16 36.824 73.647 1.49238 31.8 4.9 4.6 6.0 111 6 2 10 37.156 74.312 1.48093 16.9 2.6 2.5 6.0 112 6 3 6 37.268 74.535 1.47713 18.9 2.9 2.7 6.0 113 5 3 11 37.312 74.624 1.47564 49.5 7.6 7.2 6.0 114 4 3 14 37.462 74.924 1.47058 21.7 3.3 3.1 6.0 115 7 1 9 37.736 75.472 1.46148 18.6 2.8 2.7 6.0 116 4 2 16 37.771 75.542 1.46032 23.8 3.6 3.4 6.0 117 5 4 8 38.104 76.208 1.44947 8.1 1.2 1.2 6.0 118 4 4 12 38.201 76.402 1.44637 23.7 3.6 3.4 6.0 119 3 1 19 38.545 77.089 1.43545 9.6 1.5 1.4 6.0 120 6 0 15 38.662 77.324 1.43177 24.1 3.7 3.5 6.0 121 2 1 20 38.697 77.394 1.43068 16.2 2.5 2.3 6.0 122 8 0 8 39.041 78.082 1.42005 23.4 3.6 3.4 6.0 123 5 5 0 39.151 78.302 1.4167 15.7 2.4 2.3 6.0 124 6 4 1 39.513 79.027 1.40581 17.9 2.7 2.6 6.0 125 5 2 15 39.595 79.19 1.40339 32.5 5.0 4.7 6.0 126 6 4 2 39.668 79.336 1.40123 18.4 2.8 2.6 6.0 127 8 1 5 39.821 79.642 1.39674 42.7 6.5 6.1 6.0 128 7 3 1 40.441 80.883 1.37892 14.9 2.3 2.1 6.1 129 4 3 16 40.571 81.142 1.37527 6.6 1.0 0.9 6.1 130 8 0 10 40.894 81.788 1.3663 45.6 7.0 6.5 6.1 131 5 5 6 41.002 82.005 1.36332 82.2 12.6 11.7 6.1 132 3 0 21 41.424 82.849 1.3519 35.8 5.5 5.1 6.1 133 4 0 20 41.479 82.959 1.35043 51.2 7.8 7.3 6.1 134 7 2 10 41.815 83.63 1.34157 16.6 2.5 2.4 6.1 135 8 2 0 41.927 83.853 1.33866 23.5 3.6 3.3 6.1 136 6 4 7 41.973 83.946 1.33745 18.4 2.8 2.6 6.1 137 6 2 14 42.112 84.224 1.33386 21.8 3.3 3.1 6.1 138 4 3 17 42.256 84.512 1.33016 15.8 2.4 2.2 6.1 139 2 2 21 42.343 84.687 1.32793 18.7 2.9 2.6 6.1 140 8 2 3 42.385 84.77 1.32688 25.6 3.9 3.6 6.1 141 6 3 12 42.83 85.661 1.31571 8.6 1.3 1.2 6.1 142 6 0 18 43.728 87.457 1.29399 28.7 4.4 4.0 6.2 143 9 1 2 44.267 88.533 1.28146 17.4 2.7 2.4 6.2 144 6 4 10 44.562 89.124 1.27474 7.1 1.1 1.0 6.2 145 5 4 14 44.858 89.715 1.26811 11.2 1.7 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) |