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 *** *********************** ALLORIITE 1, DF (Na,K,Ca)(16)[Si(12)Al(12)O(48)][SO(4)](2)[SO(3),CO(3)][OH,O,Cl,H(2)O](3,5) Hexagonal P 31c Z = 1 P31c 11 .8 .17 Ref.Str.: Rastsvetaeva R.K., Ivanova A.G., Chukanov N.V., Verin I.A. (2007) Doklady Earth Sciences, 415, 815-819 L: $Si12 Al12 O61.79 Ca2.23 K2.16 Na11.61 S2.7 C0.31 Cl0.17 H6.26$ R: Locality - Sabatino volcanic complex, Latium, Italy. N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 12.892 alpha = 90.0 b = 12.892 beta = 90.0 c = 21.34 gamma = 120.0 Unit cell volume (cub. angs.) = 3071.61 Molar volume ( cub.cm/mol.) = 1850.14 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.6667 0.3334 0.14 0.0 Ca = 0.8 , Ca = 0.0 2 0.6667 0.3334 0.1048 0.0 Ca = 0.2 , Ca = 0.0 3 0.6667 0.3334 0.3581 0.0 Ca = 0.75, Ca = 0.0 4 0.6667 0.3334 0.3276 0.0 Ca = 0.25, Ca = 0.0 5 0.0 0.0 0.2059 0.0 Ca = 0.23, Ca = 0.0 6 0.2174 0.4341 0.3732 0.0 K = 0.72, K = 0.0 7 0.2234 0.4452 0.355 0.0 Na = 0.28, Na = 0.0 8 0.219 0.4376 0.1246 0.0 Na = 1.00 9 0.4958 0.5132 0.2463 0.0 Na = 0.81, Na = 0.0 10 0.478 0.529 0.2574 0.0 Na = 0.19, Na = 0.0 11 0.9992 0.4966 0.4962 0.0 Na = 0.8 , Na = 0.0 12 0.55 0.487 0.992 0.0 Na = 0.2 , Na = 0.0 13 0.0 0.0 0.253 0.0 Na = 0.77, Na = 0.0 14 0.0 0.0 0.4993 0.0 Na = 0.75, Na = 0.0 15 0.0 0.0 0.443 0.0 Na = 0.25, Na = 0.0 16 0.2506 0.9998 0.495 0.0 Si = 1.00 17 0.9198 0.5832 0.3693 0.0 Si = 1.00 18 0.0026 0.2539 0.2461 0.0 Si = 1.00 19 0.92 0.5835 0.1222 0.0 Si = 1.00 20 0.7451 0.9998 0.9951 0.0 Al = 1.00 21 0.0832 0.4067 0.8693 0.0 Al = 1.00 22 0.0038 0.7464 0.7461 0.0 Al = 1.00 23 0.0832 0.4067 0.6222 0.0 Al = 1.00 24 0.6587 0.0028 0.1846 0.0 O = 1.00 25 0.0012 0.3295 0.1858 0.0 O = 1.00 26 0.9972 0.6576 0.3106 0.0 O = 1.00 27 0.0012 0.3266 0.3091 0.0 O = 1.00 28 0.2247 0.1059 0.2468 0.0 O = 1.00 29 0.669 0.0162 0.4313 0.0 O = 1.00 30 0.3344 0.0127 0.4364 0.0 O = 1.00 31 0.6673 0.0178 0.0571 0.0 O = 1.00 32 0.3384 0.0145 0.0525 0.0 O = 1.00 33 0.1147 0.2354 0.0076 0.0 O = 1.00 34 0.1146 0.2371 0.4873 0.0 O = 1.00 35 0.1227 0.2482 0.2476 0.0 O = 1.00 36 0.5426 0.4614 0.1227 0.0 O = 1.00 37 0.4593 0.5422 0.8717 0.0 O = 1.00 38 0.4502 0.2318 0.1293 0.0 O = 1.00 39 0.447 0.231 0.3652 0.0 O = 1.00 40 0.3334 0.6667 0.4675 0.0 S = 0.8 , S = 0.0 41 0.3334 0.6667 0.4847 0.0 S = 0.2 , S = 0.0 42 0.214 0.609 0.4428 0.0 O = 0.68, O = 0.0 43 0.207 0.603 0.474 0.0 O = 0.32, O = 0.0 44 0.6667 0.3334 0.046 0.0 O = 0.8 , O = 0.0 45 0.3334 0.6667 0.2473 0.0 S = 0.7 , S = 0.0 46 0.2132 0.6 0.2234 0.0 O = 0.7 , O = 0.0 47 0.3334 0.6667 0.0207 0.0 S = 0.75, S = 0.0 48 0.207 0.6032 0.0405 0.0 O = 1.00 49 0.6667 0.3334 0.4493 0.0 O = 0.61, O = 0.0 50 0.3334 0.6667 0.066 0.0 S = 0.25, S = 0.0 51 0.3334 0.6667 0.136 0.0 O = 0.25, O = 0.0 52 0.3334 0.6667 0.304 0.0 C = 0.31, C = 0.0 53 0.236 0.616 0.297 0.0 O = 0.3 , O = 0.0 54 0.0 0.0 0.361 0.0 H(2)O = 0.75, H(2)O = 0.0 55 0.0 0.0 0.401 0.0 H(2)O = 0.25, H(2)O = 0.0 56 0.0 0.0 0.1217 0.0 H(2)O = 0.78, H(2)O = 0.0 57 0.067 0.046 0.114 0.0 H(2)O = 0.22, H(2)O = 0.0 58 0.611 0.209 0.24 0.0 H(2)O = 0.23, H(2)O = 0.0 59 0.6667 0.3334 0.24 0.0 Cl = 0.17, Cl = 0.0 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.6667 0.3334 0.14 2 2 0.6667 0.3334 0.1048 3 3 0.6667 0.3334 0.3581 4 4 0.6667 0.3334 0.3276 5 5 0.0 0.0 0.2059 6 6 0.2174 0.4341 0.3732 7 7 0.2234 0.4452 0.355 8 8 0.219 0.4376 0.1246 9 9 0.4958 0.5132 0.2463 10 10 0.478 0.529 0.2574 11 11 0.9992 0.4966 0.4962 12 12 0.55 0.487 0.992 13 13 0.0 0.0 0.253 14 14 0.0 0.0 0.4993 15 15 0.0 0.0 0.443 16 16 0.2506 0.9998 0.495 17 17 0.9198 0.5832 0.3693 18 18 0.0026 0.2539 0.2461 19 19 0.92 0.5835 0.1222 20 20 0.7451 0.9998 0.9951 21 21 0.0832 0.4067 0.8693 22 22 0.0038 0.7464 0.7461 23 23 0.0832 0.4067 0.6222 24 24 0.6587 0.0028 0.1846 25 25 0.0012 0.3295 0.1858 26 26 0.9972 0.6576 0.3106 27 27 0.0012 0.3266 0.3091 28 28 0.2247 0.1059 0.2468 29 29 0.669 0.0162 0.4313 30 30 0.3344 0.0127 0.4364 31 31 0.6673 0.0178 0.0571 32 32 0.3384 0.0145 0.0525 33 33 0.1147 0.2354 0.0076 34 34 0.1146 0.2371 0.4873 35 35 0.1227 0.2482 0.2476 36 36 0.5426 0.4614 0.1227 37 37 0.4593 0.5422 0.8717 38 38 0.4502 0.2318 0.1293 39 39 0.447 0.231 0.3652 40 40 0.3334 0.6667 0.4675 41 41 0.3334 0.6667 0.4847 42 42 0.214 0.609 0.4428 43 43 0.207 0.603 0.474 44 44 0.6667 0.3334 0.046 45 45 0.3334 0.6667 0.2473 46 46 0.2132 0.6 0.2234 47 47 0.3334 0.6667 0.0207 48 48 0.207 0.6032 0.0405 49 49 0.6667 0.3334 0.4493 50 50 0.3334 0.6667 0.066 51 51 0.3334 0.6667 0.136 52 52 0.3334 0.6667 0.304 53 53 0.236 0.616 0.297 54 54 0.0 0.0 0.361 55 55 0.0 0.0 0.401 56 56 0.0 0.0 0.1217 57 57 0.067 0.046 0.114 58 58 0.611 0.209 0.24 59 59 0.6667 0.3334 0.24 60 6 0.5659 0.7833 0.3732 61 6 0.2167 0.7826 0.3732 62 7 0.5548 0.7782 0.355 63 7 0.2218 0.7766 0.355 64 8 0.5624 0.7814 0.1246 65 8 0.2186 0.781 0.1246 66 9 0.4868 0.9826 0.2463 67 9 0.0174 0.5042 0.2463 68 10 0.471 0.949 0.2574 69 10 0.051 0.522 0.2574 70 11 0.5034 0.5026 0.4962 71 11 0.4974 0.0008 0.4962 72 12 0.513 0.063 0.992 73 12 0.937 0.45 0.992 74 16 0.0002 0.2508 0.495 75 16 0.7492 0.7494 0.495 76 17 0.4168 0.3366 0.3693 77 17 0.6634 0.0802 0.3693 78 18 0.7461 0.7487 0.2461 79 18 0.2513 0.9974 0.2461 80 19 0.4165 0.3365 0.1222 81 19 0.6635 0.08 0.1222 82 20 0.0002 0.7453 0.9951 83 20 0.2547 0.2549 0.9951 84 21 0.5933 0.6765 0.8693 85 21 0.3235 0.9168 0.8693 86 22 0.2536 0.2574 0.7461 87 22 0.7426 0.9962 0.7461 88 23 0.5933 0.6765 0.6222 89 23 0.3235 0.9168 0.6222 90 24 0.9972 0.6559 0.1846 91 24 0.3441 0.3413 0.1846 92 25 0.6705 0.6717 0.1858 93 25 0.3283 0.9988 0.1858 94 26 0.3424 0.3396 0.3106 95 26 0.6604 0.0028 0.3106 96 27 0.6734 0.6746 0.3091 97 27 0.3254 0.9988 0.3091 98 28 0.8941 0.1188 0.2468 99 28 0.8812 0.7753 0.2468 100 29 0.9838 0.6528 0.4313 101 29 0.3472 0.331 0.4313 102 30 0.9873 0.3217 0.4364 103 30 0.6783 0.6656 0.4364 104 31 0.9822 0.6495 0.0571 105 31 0.3505 0.3327 0.0571 106 32 0.9855 0.3239 0.0525 107 32 0.6761 0.6616 0.0525 108 33 0.7646 0.8793 0.0076 109 33 0.1207 0.8853 0.0076 110 34 0.7629 0.8775 0.4873 111 34 0.1225 0.8854 0.4873 112 35 0.7518 0.8745 0.2476 113 35 0.1255 0.8773 0.2476 114 36 0.5386 0.0812 0.1227 115 36 0.9188 0.4574 0.1227 116 37 0.4578 0.9171 0.8717 117 37 0.0829 0.5407 0.8717 118 38 0.7682 0.2184 0.1293 119 38 0.7816 0.5498 0.1293 120 39 0.769 0.216 0.3652 121 39 0.784 0.553 0.3652 122 42 0.391 0.605 0.4428 123 42 0.395 0.786 0.4428 124 43 0.397 0.604 0.474 125 43 0.396 0.793 0.474 126 46 0.4 0.6132 0.2234 127 46 0.3868 0.7868 0.2234 128 48 0.3968 0.6038 0.0405 129 48 0.3962 0.793 0.0405 130 53 0.384 0.62 0.297 131 53 0.38 0.764 0.297 132 57 0.954 0.021 0.114 133 57 0.979 0.933 0.114 134 58 0.791 0.402 0.24 135 58 0.598 0.389 0.24 136 1 0.3334 0.6667 0.64 137 2 0.3334 0.6667 0.6048 138 3 0.3334 0.6667 0.8581 139 4 0.3334 0.6667 0.8276 140 5 0.0 0.0 0.7059 141 6 0.4341 0.2174 0.8732 142 7 0.4452 0.2234 0.855 143 8 0.4376 0.219 0.6246 144 9 0.5132 0.4958 0.7463 145 10 0.529 0.478 0.7574 146 11 0.4966 0.9992 0.9962 147 12 0.487 0.55 0.492 148 13 0.0 0.0 0.753 149 14 0.0 0.0 0.9993 150 15 0.0 0.0 0.943 151 16 0.9998 0.2506 0.995 152 17 0.5832 0.9198 0.8693 153 18 0.2539 0.0026 0.7461 154 19 0.5835 0.92 0.6222 155 20 0.9998 0.7451 0.4951 156 21 0.4067 0.0832 0.3693 157 22 0.7464 0.0038 0.2461 158 23 0.4067 0.0832 0.1222 159 24 0.0028 0.6587 0.6846 160 25 0.3295 0.0012 0.6858 161 26 0.6576 0.9972 0.8106 162 27 0.3266 0.0012 0.8091 163 28 0.1059 0.2247 0.7468 164 29 0.0162 0.669 0.9313 165 30 0.0127 0.3344 0.9364 166 31 0.0178 0.6673 0.5571 167 32 0.0145 0.3384 0.5525 168 33 0.2354 0.1147 0.5076 169 34 0.2371 0.1146 0.9873 170 35 0.2482 0.1227 0.7476 171 36 0.4614 0.5426 0.6227 172 37 0.5422 0.4593 0.3717 173 38 0.2318 0.4502 0.6293 174 39 0.231 0.447 0.8652 175 40 0.6667 0.3334 0.9675 176 41 0.6667 0.3334 0.9847 177 42 0.609 0.214 0.9428 178 43 0.603 0.207 0.974 179 44 0.3334 0.6667 0.546 180 45 0.6667 0.3334 0.7473 181 46 0.6 0.2132 0.7234 182 47 0.6667 0.3334 0.5207 183 48 0.6032 0.207 0.5405 184 49 0.3334 0.6667 0.9493 185 50 0.6667 0.3334 0.566 186 51 0.6667 0.3334 0.636 187 52 0.6667 0.3334 0.804 188 53 0.616 0.236 0.797 189 54 0.0 0.0 0.861 190 55 0.0 0.0 0.901 191 56 0.0 0.0 0.6217 192 57 0.046 0.067 0.614 193 58 0.209 0.611 0.74 194 59 0.3334 0.6667 0.74 195 6 0.7833 0.5659 0.8732 196 6 0.7826 0.2167 0.8732 197 7 0.7782 0.5548 0.855 198 7 0.7766 0.2218 0.855 199 8 0.7814 0.5624 0.6246 200 8 0.781 0.2186 0.6246 201 9 0.9826 0.4868 0.7463 202 9 0.5042 0.0174 0.7463 203 10 0.949 0.471 0.7574 204 10 0.522 0.051 0.7574 205 11 0.5026 0.5034 0.9962 206 11 0.0008 0.4974 0.9962 207 12 0.063 0.513 0.492 208 12 0.45 0.937 0.492 209 16 0.2508 0.0002 0.995 210 16 0.7494 0.7492 0.995 211 17 0.3366 0.4168 0.8693 212 17 0.0802 0.6634 0.8693 213 18 0.7487 0.7461 0.7461 214 18 0.9974 0.2513 0.7461 215 19 0.3365 0.4165 0.6222 216 19 0.08 0.6635 0.6222 217 20 0.7453 0.0002 0.4951 218 20 0.2549 0.2547 0.4951 219 21 0.6765 0.5933 0.3693 220 21 0.9168 0.3235 0.3693 221 22 0.2574 0.2536 0.2461 222 22 0.9962 0.7426 0.2461 223 23 0.6765 0.5933 0.1222 224 23 0.9168 0.3235 0.1222 225 24 0.6559 0.9972 0.6846 226 24 0.3413 0.3441 0.6846 227 25 0.6717 0.6705 0.6858 228 25 0.9988 0.3283 0.6858 229 26 0.3396 0.3424 0.8106 230 26 0.0028 0.6604 0.8106 231 27 0.6746 0.6734 0.8091 232 27 0.9988 0.3254 0.8091 233 28 0.1188 0.8941 0.7468 234 28 0.7753 0.8812 0.7468 235 29 0.6528 0.9838 0.9313 236 29 0.331 0.3472 0.9313 237 30 0.3217 0.9873 0.9364 238 30 0.6656 0.6783 0.9364 239 31 0.6495 0.9822 0.5571 240 31 0.3327 0.3505 0.5571 241 32 0.3239 0.9855 0.5525 242 32 0.6616 0.6761 0.5525 243 33 0.8793 0.7646 0.5076 244 33 0.8853 0.1207 0.5076 245 34 0.8775 0.7629 0.9873 246 34 0.8854 0.1225 0.9873 247 35 0.8745 0.7518 0.7476 248 35 0.8773 0.1255 0.7476 249 36 0.0812 0.5386 0.6227 250 36 0.4574 0.9188 0.6227 251 37 0.9171 0.4578 0.3717 252 37 0.5407 0.0829 0.3717 253 38 0.2184 0.7682 0.6293 254 38 0.5498 0.7816 0.6293 255 39 0.216 0.769 0.8652 256 39 0.553 0.784 0.8652 257 42 0.605 0.391 0.9428 258 42 0.786 0.395 0.9428 259 43 0.604 0.397 0.974 260 43 0.793 0.396 0.974 261 46 0.6132 0.4 0.7234 262 46 0.7868 0.3868 0.7234 263 48 0.6038 0.3968 0.5405 264 48 0.793 0.3962 0.5405 265 53 0.62 0.384 0.797 266 53 0.764 0.38 0.797 267 57 0.021 0.954 0.614 268 57 0.933 0.979 0.614 269 58 0.402 0.791 0.74 270 58 0.389 0.598 0.74 X-ray density (g/cm cub.) = 2.37 MU (1/cm) = 97.883 Mass attenuation coefficient (cm**2/g) = 41.299 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Ca ,Ca 3.42 11 2.8389 36 2.4295 38 2.006 44 2.5476 58 2.134 59 2.8401 36 2.839 36 2.4296 38 2.4284 38 2.5469 58 2.5469 58 2 Ca ,Ca 3.42 14 2.8406 36 2.4746 38 1.2548 44 3.2032 58 2.8852 59 2.8418 36 2.8407 36 2.4747 38 2.4735 38 3.2027 58 3.2026 58 3.1277 43 3.1273 43 3.1272 43 3 Ca ,Ca 3.42 11 2.4595 39 1.9462 49 2.8788 58 2.5203 59 2.4596 39 2.4584 39 2.8783 58 2.8783 58 2.8107 37 2.8106 37 2.8117 37 4 Ca ,Ca 3.42 11 2.5826 39 2.5971 49 2.3304 58 1.8694 59 2.5828 39 2.5816 39 2.3297 58 2.3297 58 2.9498 37 2.9497 37 2.9508 37 5 Ca ,Ca 3.42 11 2.6575 28 2.9105 35 3.3098 54 1.7968 56 2.1051 57 2.6574 28 2.6575 28 2.9105 35 2.9106 35 2.1051 57 2.1052 57 6 K ,K 3.768 12 2.7745 27 3.2817 34 3.39 35 2.7186 42 3.111 43 2.7638 53 2.7981 26 2.886 29 2.9017 30 2.6717 42 3.1167 43 2.8024 53 7 Na ,Na 3.348 11 2.6689 27 3.1767 35 2.8706 42 3.326 43 2.4595 53 2.6821 26 3.1171 29 3.1577 30 2.8234 42 3.3267 43 2.4962 53 8 Na 3.348 9 2.7602 25 2.9985 46 2.8518 48 2.5694 51 2.7901 24 3.0118 31 3.0274 32 3.1197 46 2.8556 48 9 Na ,Na 3.348 9 2.8583 36 2.477 24 2.5125 25 2.5253 26 2.5697 27 2.2401 46 2.6698 53 2.5354 58 2.9013 37 10 Na ,Na 3.348 9 3.2314 36 2.6593 24 2.7041 25 2.4574 26 2.5215 27 1.9512 46 2.2317 53 2.9294 58 2.8611 37 11 Na ,Na 3.348 9 2.656 42 2.3681 43 2.5322 29 2.528 30 2.4621 31 2.4585 32 2.8505 36 2.8107 37 2.489 48 12 Na ,Na 3.348 10 2.8046 36 3.049 37 3.2391 44 2.7176 31 2.3911 32 3.1957 48 2.7944 29 2.4569 30 2.0035 42 1.6691 43 13 Na ,Na 3.348 12 2.5136 28 2.7736 35 2.3047 54 3.1583 55 2.8019 56 3.0634 57 2.5135 28 2.5136 28 2.7736 35 2.7737 35 3.0633 57 3.0634 57 14 Na ,Na 3.348 12 2.66 34 2.9513 54 2.0977 55 2.66 34 2.6601 34 2.6344 33 2.612 56 2.5645 57 2.6344 33 2.6346 33 2.5645 57 2.5645 57 15 Na ,Na 3.348 8 2.8114 34 1.7499 54 0.8963 55 2.8114 34 2.8115 34 2.9681 33 2.9681 33 2.9682 33 16 Si 2.64 4 1.6059 30 1.5791 34 1.611 33 1.6145 32 17 Si 2.64 4 1.5899 26 1.5799 29 1.5945 39 1.6003 37 18 Si 2.64 4 1.6198 25 1.6441 27 1.5867 35 1.5982 28 19 Si 2.64 4 1.645 24 1.617 31 1.6181 36 1.6185 38 20 Al 2.856 4 1.7445 31 1.7142 33 1.7513 29 1.7148 34 21 Al 2.856 4 1.7302 37 1.7024 30 1.7083 39 1.671 27 22 Al 2.856 4 1.7281 24 1.7633 26 1.7323 28 1.7032 35 23 Al 2.856 4 1.7298 32 1.7127 38 1.7169 25 1.7136 36 24 O 3.804 8 2.726 31 3.2369 58 2.6889 26 2.9444 28 2.8231 35 2.5939 36 2.6808 38 3.3114 46 25 O 3.804 8 2.6315 27 2.6331 35 3.2778 46 2.6888 28 2.8502 32 2.7224 36 2.8681 38 3.4767 58 26 O 3.804 9 3.7197 46 3.3913 53 2.6889 24 2.943 28 2.5802 29 2.8073 35 2.6502 39 3.3817 58 2.5964 37 27 O 3.804 9 2.6315 25 2.604 35 3.6884 46 3.4432 53 2.6744 28 2.7211 30 2.8564 39 3.6189 58 2.7668 37 28 O 3.804 11 2.74 35 3.5573 38 3.5463 39 3.4985 54 3.6644 56 3.3453 57 2.9444 24 2.6888 25 2.943 26 2.6744 27 2.5598 35 29 O 3.804 9 2.5802 26 2.8734 34 2.6392 39 3.2957 42 3.3718 43 3.7798 48 2.7115 31 2.913 33 2.5526 37 30 O 3.804 8 2.8724 39 2.7211 27 2.6177 34 3.3845 42 3.398 43 2.7102 33 2.4964 32 2.7188 37 31 O 3.804 8 2.726 24 2.8492 33 2.5955 36 2.7184 38 3.2573 48 3.4356 43 2.7115 29 2.855 34 32 O 3.804 8 2.9281 38 2.8502 25 2.6257 33 2.725 36 3.3021 48 2.6443 34 3.4837 43 2.4964 30 33 O 3.804 10 3.583 56 3.1614 57 2.8492 31 2.6257 32 3.3707 57 2.7102 30 2.7496 34 3.4762 55 2.913 29 2.5966 34 34 O 3.804 9 3.7782 54 3.2252 55 2.8734 29 2.6177 30 2.6443 32 2.7496 33 3.3109 57 2.855 31 2.5966 33 35 O 3.804 8 2.6331 25 2.604 27 2.74 28 3.6791 54 3.6834 57 2.8231 24 2.8073 26 2.5598 28 36 O 3.804 11 2.5835 38 3.2561 44 3.7668 59 2.5939 24 2.7224 25 2.5955 31 2.725 32 2.7021 38 3.6647 48 2.8834 58 3.4702 43 37 O 3.804 9 2.5644 39 3.2493 49 2.5964 26 2.7667 27 2.5524 29 2.7188 30 2.726 39 3.6456 42 3.1448 58 38 O 3.804 11 3.5573 28 2.9281 32 2.5835 36 3.0017 44 3.2517 58 3.3809 59 2.6808 24 2.8681 25 2.7184 31 2.7021 36 3.0752 58 39 O 3.804 11 3.5463 28 2.8724 30 3.0409 49 3.5055 58 3.6283 59 2.6502 26 2.8564 27 2.6392 29 3.3335 58 2.5644 37 2.7257 37 40 S ,S 2.52 7 1.4337 42 1.418 43 1.4328 42 1.4327 42 1.417 43 1.4169 43 1.6752 44 41 S ,S 2.52 7 1.6054 42 1.4296 43 1.6046 42 1.6044 42 1.4286 43 1.4285 43 1.3081 44 42 O ,O 3.804 12 0.6712 43 3.1215 53 3.2957 29 3.3845 30 2.3082 42 2.3082 42 2.4831 43 2.4515 43 3.7674 53 3.7386 53 2.5745 44 3.6458 37 43 O ,O 3.804 12 0.6712 42 3.7911 53 3.3718 29 3.398 30 2.4515 42 2.4831 42 2.4431 43 2.4431 43 3.4356 31 3.4837 32 2.0862 44 3.4703 36 44 O ,O 3.804 12 3.2561 36 3.0017 38 3.2571 36 3.2562 36 3.0018 38 3.0008 38 2.5745 42 2.0862 43 2.5739 42 2.5739 42 2.0856 43 2.0855 43 45 S ,S 2.52 7 1.4382 46 2.3751 51 1.5192 53 1.4372 46 1.4372 46 1.5185 53 1.5184 53 46 O ,O 3.804 10 3.2778 25 3.7197 26 3.6884 27 2.2993 51 1.5922 53 3.3114 24 2.3279 46 2.3279 46 2.6104 53 2.6486 53 47 S ,S 2.52 5 1.4731 48 2.4605 51 1.4722 48 1.4721 48 1.5237 49 48 O 3.804 8 2.4789 51 3.2573 31 3.3021 32 3.6647 36 2.4431 48 2.4431 48 3.7798 29 2.404 49 49 O ,O 3.804 9 3.0409 39 3.041 39 3.04 39 3.2493 37 2.404 48 3.2492 37 3.2502 37 2.4034 48 2.4034 48 50 S ,S 2.52 5 1.5125 48 1.4938 51 1.5116 48 1.5115 48 2.4904 49 51 O ,O 3.804 9 2.2993 46 2.4789 48 3.6038 53 2.2987 46 2.2987 46 2.4783 48 2.4783 48 3.6035 53 3.6035 53 52 C ,C 2.412 6 2.1833 46 1.098 53 2.1826 46 2.1826 46 1.097 53 1.0969 53 53 O ,O 3.804 12 3.3913 26 3.4432 27 3.1215 42 3.7911 43 1.5922 46 3.6038 51 3.7386 42 3.7674 42 2.6486 46 2.6104 46 1.8828 53 1.8828 53 54 H(2)O,H(2)O 3.972 10 3.4985 28 3.7782 34 3.6791 35 0.8536 55 3.4985 28 3.4985 28 3.7782 34 3.7782 34 3.6791 35 3.6792 35 55 H(2)O,H(2)O 3.972 7 3.2252 34 0.8536 54 3.2252 34 3.2253 34 3.4762 33 3.4762 33 3.4763 33 56 H(2)O,H(2)O 3.972 15 3.6644 28 3.583 33 3.8598 35 0.7826 57 3.6643 28 3.6644 28 3.583 33 3.583 33 3.8598 35 3.8598 35 0.7826 57 0.7827 57 3.9033 34 3.9033 34 3.9034 34 57 H(2)O,H(2)O 3.972 11 3.3453 28 3.9434 32 3.1614 33 3.6834 35 0.7826 56 3.8711 31 3.3707 33 3.8817 35 1.3253 57 1.3253 57 3.3109 34 58 H(2)O,H(2)O 3.972 13 3.2369 24 3.2517 38 3.5055 39 1.3914 59 3.4767 25 3.3817 26 3.6189 27 2.8834 36 3.0752 38 3.3335 39 2.4087 58 2.4087 58 3.1447 37 59 Cl ,Cl 4.344 16 3.7668 36 3.3809 38 3.6283 39 4.14 44 1.3914 58 3.7677 36 3.7669 36 3.3811 38 3.3802 38 3.6284 39 3.6275 39 1.3903 58 1.3902 58 3.9642 37 3.9641 37 3.9649 37 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 3.956 7.912 0.045 417.19 6 59.5 94.0 2 0 0 2 4.14 8.28 0.047 380.78 2 43.3 15.1 3 1 0 1 4.466 8.932 0.051 326.9 12 45.3 85.5 4 1 0 2 5.731 11.462 0.065 197.6 12 25.3 16.0 5 1 1 0 6.863 13.726 0.078 137.1 6 98.2 84.1 6 1 0 3 7.377 14.754 0.083 118.36 12 68.0 69.6 7 2 0 0 7.931 15.862 0.09 102.1 6 41.2 11.0 8 1 1 -2 8.025 16.051 0.091 99.66 6 42.3 11.3 9 1 1 2 8.025 16.051 0.091 99.66 6 43.0 11.7 10 2 0 1 8.2 16.4 0.093 95.37 12 37.6 17.1 11 0 0 4 8.302 16.603 0.094 93.0 2 65.8 8.5 12 2 0 2 8.959 17.918 0.101 79.54 12 21.7 4.8 13 1 0 4 9.208 18.416 0.104 75.18 12 221.8 470.5 14 2 0 3 10.102 20.204 0.114 62.09 12 28.4 6.4 15 2 1 0 10.517 21.035 0.118 57.12 12 84.0 51.3 16 2 1 -1 10.724 21.447 0.121 54.86 12 62.5 27.3 17 2 1 1 10.724 21.447 0.121 54.86 12 59.2 24.4 18 1 1 -4 10.802 21.604 0.122 54.04 6 33.6 3.9 19 1 1 4 10.802 21.604 0.122 54.04 6 44.5 6.8 20 1 0 5 11.14 22.281 0.125 50.68 12 203.7 267.4 21 2 1 -2 11.32 22.64 0.127 49.01 12 31.5 6.2 22 2 1 2 11.32 22.64 0.127 49.01 12 30.7 5.9 23 2 0 4 11.52 23.04 0.13 47.25 12 51.7 16.1 24 3 0 0 11.945 23.89 0.134 43.81 6 498.1 691.2 25 3 0 1 12.128 24.256 0.136 42.43 12 45.4 11.1 26 2 1 -3 12.254 24.507 0.138 41.53 12 70.0 25.9 27 2 1 3 12.254 24.507 0.138 41.53 12 67.9 24.3 28 0 0 6 12.508 25.016 0.141 39.77 2 56.0 2.6 29 3 0 2 12.662 25.325 0.142 38.76 12 26.5 3.5 30 2 0 5 13.131 26.262 0.147 35.9 12 79.2 28.7 31 1 0 6 13.138 26.276 0.148 35.86 12 21.4 2.1 32 2 1 -4 13.458 26.916 0.151 34.08 12 331.2 475.5 33 2 1 4 13.458 26.916 0.151 34.08 12 331.8 477.2 34 3 0 3 13.509 27.017 0.152 33.81 12 69.3 20.6 35 2 2 0 13.827 27.654 0.155 32.18 6 57.8 6.8 36 1 1 -6 14.321 28.642 0.161 29.86 6 15.9 0.5 37 1 1 6 14.321 28.642 0.161 29.86 6 5.2 0.1 38 3 1 0 14.404 28.808 0.161 29.5 12 23.6 2.1 39 2 2 -2 14.457 28.915 0.162 29.26 6 16.5 0.5 40 2 2 2 14.457 28.915 0.162 29.26 6 14.0 0.4 41 3 1 -1 14.558 29.116 0.163 28.83 12 89.2 29.2 42 3 1 1 14.558 29.116 0.163 28.83 12 89.2 29.2 43 3 0 4 14.617 29.234 0.164 28.58 12 52.4 10.0 44 2 1 -5 14.874 29.748 0.167 27.54 12 10.0 0.4 45 2 1 5 14.874 29.748 0.167 27.54 12 8.6 0.3 46 2 0 6 14.88 29.76 0.167 27.52 12 23.3 1.9 47 3 1 -2 15.012 30.024 0.168 27.0 12 4.3 0.1 48 3 1 2 15.012 30.024 0.168 27.0 12 11.1 0.4 49 1 0 7 15.184 30.368 0.17 26.35 12 93.6 29.4 50 3 1 -3 15.742 31.483 0.176 24.38 12 126.4 49.5 51 3 1 3 15.742 31.483 0.176 24.38 12 129.6 52.0 52 3 0 5 15.939 31.878 0.178 23.74 12 133.5 53.8 53 4 0 0 16.02 32.039 0.179 23.48 6 214.7 68.8 54 4 0 1 16.16 32.32 0.181 23.04 12 213.9 134.0 55 2 2 -4 16.214 32.428 0.181 22.87 6 85.0 10.5 56 2 2 4 16.214 32.428 0.181 22.87 6 88.6 11.4 57 2 1 -6 16.453 32.907 0.184 22.16 12 15.1 0.6 58 2 1 6 16.453 32.907 0.184 22.16 12 18.7 1.0 59 4 0 2 16.574 33.148 0.185 21.81 12 33.7 3.1 60 3 1 -4 16.715 33.431 0.187 21.41 12 168.7 77.5 61 3 1 4 16.715 33.431 0.187 21.41 12 165.8 74.8 62 2 0 7 16.732 33.463 0.187 21.37 12 15.2 0.6 63 0 0 8 16.784 33.568 0.187 21.22 2 747.9 251.7 64 4 0 3 17.245 34.489 0.192 20.01 12 187.2 89.2 65 1 0 8 17.271 34.542 0.193 19.94 12 46.5 5.5 66 3 0 6 17.432 34.864 0.194 19.54 12 26.9 1.8 67 3 2 0 17.501 35.003 0.195 19.37 12 75.6 14.1 68 3 2 -1 17.631 35.262 0.197 19.06 12 39.6 3.8 69 3 2 1 17.631 35.262 0.197 19.06 12 39.7 3.8 70 3 1 -5 17.898 35.797 0.199 18.45 12 125.4 36.9 71 3 1 5 17.898 35.797 0.199 18.45 12 123.9 36.0 72 3 2 -2 18.015 36.031 0.201 18.18 12 14.1 0.5 73 3 2 2 18.015 36.031 0.201 18.18 12 15.8 0.6 74 4 0 4 18.147 36.294 0.202 17.9 12 260.7 154.6 75 2 1 -7 18.162 36.324 0.202 17.86 12 17.7 0.7 76 2 1 7 18.162 36.324 0.202 17.86 12 24.7 1.4 77 1 1 -8 18.211 36.422 0.203 17.76 6 29.4 1.0 78 1 1 8 18.211 36.422 0.203 17.76 6 18.9 0.4 79 4 1 0 18.431 36.862 0.205 17.3 12 139.4 42.8 80 4 1 -1 18.555 37.11 0.207 17.04 12 34.5 2.6 81 4 1 1 18.555 37.11 0.207 17.04 12 24.5 1.3 82 3 2 -3 18.641 37.281 0.207 16.87 12 16.2 0.6 83 3 2 3 18.641 37.281 0.207 16.87 12 19.5 0.8 84 2 0 8 18.665 37.33 0.208 16.82 12 20.7 0.9 85 2 2 -6 18.816 37.631 0.209 16.53 6 22.5 0.5 86 2 2 6 18.816 37.631 0.209 16.53 6 29.4 0.9 87 4 1 -2 18.923 37.846 0.211 16.32 12 11.8 0.3 88 4 1 2 18.923 37.846 0.211 16.32 12 10.5 0.2 89 3 0 7 19.064 38.127 0.212 16.05 12 107.9 23.8 90 4 0 5 19.253 38.506 0.214 15.71 12 130.6 34.1 91 3 1 -6 19.258 38.516 0.214 15.7 12 38.8 3.0 92 3 1 6 19.258 38.516 0.214 15.7 12 36.9 2.7 93 1 0 9 19.397 38.793 0.216 15.45 12 25.9 1.3 94 3 2 -4 19.487 38.974 0.217 15.29 12 17.9 0.6 95 3 2 4 19.487 38.974 0.217 15.29 12 23.9 1.1 96 4 1 -3 19.523 39.047 0.217 15.23 12 65.1 8.2 97 4 1 3 19.523 39.047 0.217 15.23 12 59.0 6.7 98 2 1 -8 19.976 39.951 0.222 14.48 12 3.6 0.0 99 2 1 8 19.976 39.951 0.222 14.48 12 4.5 0.0 100 5 0 0 20.179 40.359 0.224 14.15 6 105.3 10.0 101 5 0 1 20.294 40.589 0.225 13.97 12 13.9 0.3 102 4 1 -4 20.339 40.677 0.226 13.91 12 40.6 2.9 103 4 1 4 20.339 40.677 0.226 13.91 12 38.3 2.6 104 3 2 -5 20.532 41.064 0.228 13.62 12 23.5 1.0 105 3 2 5 20.532 41.064 0.228 13.62 12 29.2 1.5 106 4 0 6 20.536 41.073 0.228 13.61 12 13.3 0.3 107 5 0 2 20.636 41.272 0.229 13.46 12 15.7 0.4 108 2 0 9 20.668 41.336 0.229 13.42 12 11.8 0.2 109 3 1 -7 20.767 41.534 0.23 13.27 12 52.2 4.6 110 3 1 7 20.767 41.534 0.23 13.27 12 50.2 4.3 111 3 0 8 20.811 41.621 0.231 13.21 12 206.8 71.9 112 3 3 0 21.008 42.015 0.233 12.94 6 589.7 286.1 113 0 0 10 21.159 42.318 0.234 12.73 2 195.9 10.4 114 5 0 3 21.196 42.392 0.235 12.68 12 26.0 1.1 115 4 1 -5 21.349 42.698 0.236 12.48 12 12.7 0.3 116 4 1 5 21.349 42.698 0.236 12.48 12 16.7 0.4 117 4 2 0 21.412 42.824 0.237 12.4 12 110.8 19.4 118 3 3 -2 21.45 42.9 0.237 12.35 6 17.6 0.2 119 3 3 2 21.45 42.9 0.237 12.35 6 24.7 0.5 120 4 2 -1 21.522 43.043 0.238 12.25 12 18.7 0.5 121 4 2 1 21.522 43.043 0.238 12.25 12 23.7 0.9 122 1 0 10 21.561 43.122 0.239 12.2 12 62.8 6.1 123 3 2 -6 21.752 43.505 0.241 11.96 12 17.2 0.5 124 3 2 6 21.752 43.505 0.241 11.96 12 17.3 0.5 125 4 2 -2 21.848 43.695 0.242 11.85 12 3.5 0.0 126 4 2 2 21.848 43.695 0.242 11.85 12 5.7 0.0 127 2 1 -9 21.878 43.756 0.242 11.81 12 67.9 6.9 128 2 1 9 21.878 43.756 0.242 11.81 12 65.5 6.4 129 5 0 4 21.96 43.92 0.243 11.71 12 22.6 0.8 130 4 0 7 21.973 43.945 0.243 11.7 12 108.9 17.6 131 2 2 -8 22.014 44.029 0.243 11.65 6 180.4 24.1 132 2 2 8 22.014 44.029 0.243 11.65 6 182.2 24.6 133 1 1 -10 22.347 44.695 0.247 11.26 6 83.8 5.0 134 1 1 10 22.347 44.695 0.247 11.26 6 81.5 4.8 135 4 2 -3 22.383 44.765 0.247 11.22 12 29.1 1.2 136 4 2 3 22.383 44.765 0.247 11.22 12 30.6 1.3 137 3 1 -8 22.404 44.808 0.247 11.19 12 39.6 2.2 138 3 1 8 22.404 44.808 0.247 11.19 12 33.4 1.6 139 4 1 -6 22.534 45.067 0.249 11.05 12 41.4 2.4 140 4 1 6 22.534 45.067 0.249 11.05 12 33.2 1.6 141 5 1 0 22.59 45.18 0.249 10.99 12 169.4 40.1 142 3 0 9 22.656 45.311 0.25 10.92 12 11.1 0.2 143 5 1 -1 22.695 45.39 0.25 10.87 12 30.2 1.3 144 5 1 1 22.695 45.39 0.25 10.87 12 21.3 0.6 145 2 0 10 22.733 45.465 0.251 10.83 12 54.6 4.1 146 3 3 -4 22.735 45.471 0.251 10.83 6 118.9 9.7 147 3 3 4 22.735 45.471 0.251 10.83 6 118.5 9.7 148 5 0 5 22.912 45.824 0.253 10.64 12 81.9 9.1 149 5 1 -2 23.008 46.015 0.254 10.54 12 17.3 0.4 150 5 1 2 23.008 46.015 0.254 10.54 12 13.2 0.2 151 4 2 -4 23.115 46.231 0.255 10.43 12 91.9 11.2 152 4 2 4 23.115 46.231 0.255 10.43 12 94.3 11.8 153 3 2 -7 23.128 46.256 0.255 10.42 12 54.1 3.9 154 3 2 7 23.128 46.256 0.255 10.42 12 56.2 4.2 155 5 1 -3 23.522 47.044 0.259 10.03 12 8.4 0.1 156 5 1 3 23.522 47.044 0.259 10.03 12 13.8 0.2 157 4 0 8 23.542 47.085 0.259 10.01 12 268.3 91.6 158 1 0 11 23.766 47.532 0.262 9.79 12 24.8 0.8 159 2 1 -10 23.859 47.718 0.263 9.71 12 20.9 0.5 160 2 1 10 23.859 47.718 0.263 9.71 12 21.0 0.5 161 4 1 -7 23.874 47.747 0.263 9.69 12 32.5 1.3 162 4 1 7 23.874 47.747 0.263 9.69 12 21.0 0.5 163 4 2 -5 24.032 48.064 0.264 9.55 12 13.4 0.2 164 4 2 5 24.032 48.064 0.264 9.55 12 15.9 0.3 165 5 0 6 24.036 48.072 0.264 9.55 12 42.1 2.2 166 3 1 -9 24.152 48.304 0.266 9.44 12 65.3 5.1 167 3 1 9 24.152 48.304 0.266 9.44 12 66.3 5.3 168 5 1 -4 24.228 48.456 0.266 9.38 12 149.3 26.6 169 5 1 4 24.228 48.456 0.266 9.38 12 149.2 26.6 170 6 0 0 24.453 48.907 0.269 9.18 6 124.5 9.0 171 6 0 1 24.552 49.104 0.27 9.1 12 95.5 10.6 172 3 0 10 24.588 49.176 0.27 9.07 12 60.6 4.2 173 3 2 -8 24.64 49.281 0.271 9.02 12 48.3 2.7 174 3 2 8 24.64 49.281 0.271 9.02 12 52.1 3.1 175 3 3 -6 24.761 49.522 0.272 8.92 6 60.4 2.1 176 3 3 6 24.761 49.522 0.272 8.92 6 52.7 1.6 177 4 3 0 24.813 49.626 0.272 8.88 12 52.4 3.1 178 6 0 2 24.847 49.694 0.273 8.85 12 11.4 0.1 179 2 0 11 24.856 49.713 0.273 8.85 12 25.8 0.8 180 4 3 -1 24.911 49.822 0.273 8.8 12 78.8 6.9 181 4 3 1 24.911 49.822 0.273 8.8 12 82.1 7.5 182 5 1 -5 25.114 50.227 0.275 8.64 12 23.2 0.6 183 5 1 5 25.114 50.227 0.275 8.64 12 19.7 0.4 184 4 2 -6 25.118 50.235 0.276 8.64 12 29.3 0.9 185 4 2 6 25.118 50.235 0.276 8.64 12 32.5 1.2 186 4 3 -2 25.203 50.406 0.276 8.57 12 23.1 0.6 187 4 3 2 25.203 50.406 0.276 8.57 12 15.7 0.3 188 4 0 9 25.23 50.46 0.277 8.55 12 144.7 22.8 189 5 0 7 25.315 50.63 0.278 8.48 12 44.1 2.1 190 6 0 3 25.333 50.666 0.278 8.47 12 78.2 6.6 191 4 1 -8 25.352 50.705 0.278 8.46 12 274.3 80.9 192 4 1 8 25.352 50.705 0.278 8.46 12 276.7 82.3 193 5 2 0 25.522 51.044 0.28 8.33 12 153.2 24.9 194 5 2 -1 25.618 51.235 0.281 8.26 12 32.4 1.1 195 5 2 1 25.618 51.235 0.281 8.26 12 23.6 0.6 196 2 2 -10 25.652 51.304 0.281 8.23 6 50.1 1.3 197 2 2 10 25.652 51.304 0.281 8.23 6 46.6 1.1 198 0 0 12 25.667 51.335 0.281 8.22 2 96.5 1.6 199 4 3 -3 25.684 51.368 0.281 8.21 12 56.7 3.4 200 4 3 3 25.684 51.368 0.281 8.21 12 60.5 3.8 201 5 2 -2 25.904 51.807 0.284 8.05 12 20.9 0.4 202 5 2 2 25.904 51.807 0.284 8.05 12 19.5 0.4 203 2 1 -11 25.913 51.825 0.284 8.05 12 100.3 10.3 204 2 1 11 25.913 51.825 0.284 8.05 12 96.2 9.5 205 3 1 -10 26.0 52.0 0.285 7.98 12 33.8 1.2 206 3 1 10 26.0 52.0 0.285 7.98 12 36.1 1.3 207 6 0 4 26.002 52.005 0.285 7.98 12 113.9 13.2 208 1 0 12 26.015 52.03 0.285 7.97 12 183.6 34.2 209 5 1 -6 26.166 52.332 0.286 7.87 12 13.7 0.2 210 5 1 6 26.166 52.332 0.286 7.87 12 9.7 0.1 211 3 2 -9 26.275 52.551 0.287 7.79 12 46.6 2.1 212 3 2 9 26.275 52.551 0.287 7.79 12 54.1 2.9 213 4 3 -4 26.347 52.694 0.288 7.75 12 169.4 28.3 214 4 3 4 26.347 52.694 0.288 7.75 12 167.9 27.8 215 4 2 -7 26.358 52.716 0.288 7.74 12 32.0 1.0 216 4 2 7 26.358 52.716 0.288 7.74 12 36.3 1.3 217 5 2 -3 26.376 52.751 0.288 7.73 12 55.3 3.0 218 5 2 3 26.376 52.751 0.288 7.73 12 53.1 2.8 219 3 0 11 26.6 53.2 0.291 7.58 12 42.4 1.7 220 1 1 -12 26.701 53.401 0.292 7.52 6 51.6 1.3 221 1 1 12 26.701 53.401 0.292 7.52 6 57.3 1.6 222 5 0 8 26.735 53.471 0.292 7.49 12 10.2 0.1 223 6 0 5 26.845 53.691 0.293 7.42 12 36.1 1.2 224 6 1 0 26.898 53.797 0.294 7.39 12 59.2 3.3 225 4 1 -9 26.956 53.913 0.294 7.35 12 21.5 0.4 226 4 1 9 26.956 53.913 0.294 7.35 12 8.4 0.1 227 6 1 -1 26.991 53.982 0.295 7.33 12 8.2 0.1 228 6 1 1 26.991 53.982 0.295 7.33 12 18.7 0.3 229 4 0 10 27.024 54.048 0.295 7.31 12 43.8 1.8 230 5 2 -4 27.026 54.053 0.295 7.31 12 24.9 0.6 231 5 2 4 27.026 54.053 0.295 7.31 12 22.2 0.5 232 2 0 12 27.039 54.078 0.295 7.3 12 34.2 1.1 233 4 3 -5 27.182 54.365 0.297 7.22 12 47.2 2.0 234 4 3 5 27.182 54.365 0.297 7.22 12 46.3 2.0 235 6 1 -2 27.267 54.533 0.297 7.16 12 21.2 0.4 236 6 1 2 27.267 54.533 0.297 7.16 12 15.2 0.2 237 5 1 -7 27.373 54.746 0.298 7.1 12 46.8 2.0 238 5 1 7 27.373 54.746 0.298 7.1 12 41.4 1.5 239 3 3 -8 27.408 54.817 0.299 7.08 6 20.2 0.2 240 3 3 8 27.408 54.817 0.299 7.08 6 30.9 0.4 241 6 1 -3 27.722 55.445 0.302 6.9 12 6.0 0.0 242 6 1 3 27.722 55.445 0.302 6.9 12 19.6 0.3 243 4 2 -8 27.741 55.481 0.302 6.89 12 55.3 2.7 244 4 2 8 27.741 55.481 0.302 6.89 12 53.9 2.5 245 5 2 -5 27.848 55.696 0.303 6.83 12 95.4 7.9 246 5 2 5 27.848 55.696 0.303 6.83 12 100.8 8.8 247 6 0 6 27.852 55.703 0.303 6.83 12 27.9 0.7 248 3 1 -11 27.939 55.879 0.304 6.78 12 40.2 1.4 249 3 1 11 27.939 55.879 0.304 6.78 12 42.3 1.5 250 3 2 -10 28.022 56.045 0.305 6.73 12 32.3 0.9 251 3 2 10 28.022 56.045 0.305 6.73 12 34.0 1.0 252 2 1 -12 28.037 56.074 0.305 6.73 12 204.5 35.8 253 2 1 12 28.037 56.074 0.305 6.73 12 204.4 35.7 254 4 3 -6 28.18 56.361 0.307 6.65 12 17.9 0.3 255 4 3 6 28.18 56.361 0.307 6.65 12 18.5 0.3 256 5 0 9 28.284 56.569 0.308 6.59 12 2.5 0.0 257 1 0 13 28.313 56.626 0.308 6.58 12 86.4 6.2 258 6 1 -4 28.352 56.704 0.308 6.56 12 162.4 22.0 259 6 1 4 28.352 56.704 0.308 6.56 12 161.0 21.6 260 4 4 0 28.554 57.108 0.31 6.45 6 483.7 96.0 261 4 1 -10 28.675 57.35 0.311 6.39 12 42.8 1.5 262 4 1 10 28.675 57.35 0.311 6.39 12 49.2 2.0 263 3 0 12 28.689 57.378 0.312 6.38 12 8.4 0.1 264 5 1 -8 28.722 57.444 0.312 6.37 12 89.9 6.5 265 5 1 8 28.722 57.444 0.312 6.37 12 87.5 6.2 266 5 2 -6 28.831 57.661 0.313 6.31 12 21.7 0.4 267 5 2 6 28.831 57.661 0.313 6.31 12 16.3 0.2 268 5 3 0 28.878 57.756 0.313 6.29 12 45.3 1.6 269 7 0 0 28.878 57.756 0.313 6.29 6 74.2 2.2 270 4 4 -2 28.908 57.817 0.314 6.28 6 25.1 0.3 271 4 4 2 28.908 57.817 0.314 6.28 6 24.7 0.2 272 4 0 11 28.917 57.833 0.314 6.27 12 56.5 2.5 273 5 3 -1 28.966 57.932 0.314 6.25 12 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1.4 295 6 2 -1 29.922 59.843 0.324 5.81 12 44.0 1.4 296 6 2 1 29.922 59.843 0.324 5.81 12 45.2 1.5 297 5 0 10 29.953 59.905 0.324 5.79 12 18.2 0.2 298 4 4 -4 29.955 59.91 0.324 5.79 6 94.3 3.3 299 4 4 4 29.955 59.91 0.324 5.79 6 97.9 3.5 300 5 2 -7 29.965 59.931 0.324 5.79 12 31.2 0.7 301 5 2 7 29.965 59.931 0.324 5.79 12 37.6 1.0 302 3 1 -12 29.967 59.933 0.324 5.79 12 94.1 6.5 303 3 1 12 29.967 59.933 0.324 5.79 12 97.7 7.0 304 6 1 -6 30.104 60.209 0.326 5.73 12 21.0 0.3 305 6 1 6 30.104 60.209 0.326 5.73 12 17.7 0.2 306 6 2 -2 30.18 60.36 0.326 5.7 12 28.7 0.6 307 6 2 2 30.18 60.36 0.326 5.7 12 16.3 0.2 308 5 1 -9 30.204 60.408 0.327 5.69 12 15.5 0.2 309 5 1 9 30.204 60.408 0.327 5.69 12 5.7 0.0 310 2 1 -13 30.232 60.463 0.327 5.68 12 7.1 0.0 311 2 1 13 30.232 60.463 0.327 5.68 12 11.1 0.1 312 5 3 -4 30.269 60.538 0.327 5.66 12 75.1 4.1 313 5 3 4 30.269 60.538 0.327 5.66 12 79.5 4.5 314 7 0 4 30.269 60.538 0.327 5.66 12 155.3 17.3 315 6 0 8 30.313 60.625 0.328 5.64 12 281.0 56.7 316 0 0 14 30.354 60.708 0.328 5.62 2 29.3 0.1 317 4 1 -11 30.501 61.002 0.329 5.56 12 35.2 0.9 318 4 1 11 30.501 61.002 0.329 5.56 12 37.7 1.0 319 3 3 -10 30.579 61.158 0.33 5.53 6 82.7 2.4 320 3 3 10 30.579 61.158 0.33 5.53 6 84.8 2.5 321 6 2 -3 30.608 61.215 0.331 5.52 12 57.5 2.3 322 6 2 3 30.608 61.215 0.331 5.52 12 58.6 2.4 323 4 3 -8 30.625 61.249 0.331 5.51 12 26.8 0.5 324 4 3 8 30.625 61.249 0.331 5.51 12 23.2 0.4 325 1 0 14 30.666 61.331 0.331 5.5 12 19.9 0.3 326 3 0 13 30.855 61.709 0.333 5.42 12 77.6 4.2 327 4 2 -10 30.89 61.779 0.333 5.41 12 21.8 0.3 328 4 2 10 30.89 61.779 0.333 5.41 12 21.6 0.3 329 4 0 12 30.903 61.806 0.333 5.4 12 271.7 50.7 330 5 3 -5 31.035 62.07 0.335 5.35 12 145.1 14.3 331 5 3 5 31.035 62.07 0.335 5.35 12 145.6 14.4 332 7 0 5 31.035 62.07 0.335 5.35 12 89.0 5.4 333 6 2 -4 31.2 62.401 0.336 5.29 12 133.9 12.1 334 6 2 4 31.2 62.401 0.336 5.29 12 132.4 11.8 335 6 1 -7 31.211 62.421 0.336 5.29 12 27.5 0.5 336 6 1 7 31.211 62.421 0.336 5.29 12 24.1 0.4 337 5 2 -8 31.243 62.486 0.337 5.28 12 36.2 0.9 338 5 2 8 31.243 62.486 0.337 5.28 12 36.4 0.9 339 1 1 -14 31.284 62.567 0.337 5.26 6 28.8 0.3 340 1 1 14 31.284 62.567 0.337 5.26 6 11.2 0.0 341 7 1 0 31.391 62.782 0.338 5.22 12 234.0 36.4 342 7 1 -1 31.475 62.95 0.339 5.19 12 33.5 0.7 343 7 1 1 31.475 62.95 0.339 5.19 12 40.6 1.1 344 2 0 14 31.59 63.18 0.34 5.15 12 26.4 0.5 345 4 4 -6 31.652 63.305 0.341 5.13 6 24.6 0.2 346 4 4 6 31.652 63.305 0.341 5.13 6 21.4 0.1 347 7 1 -2 31.726 63.452 0.341 5.1 12 9.0 0.1 348 7 1 2 31.726 63.452 0.341 5.1 12 8.8 0.1 349 5 0 11 31.734 63.467 0.341 5.1 12 33.7 0.7 350 6 0 9 31.749 63.499 0.342 5.09 12 49.8 1.6 351 5 1 -10 31.81 63.621 0.342 5.07 12 51.1 1.7 352 5 1 10 31.81 63.621 0.342 5.07 12 49.3 1.6 353 3 2 -12 31.824 63.648 0.342 5.07 12 38.1 0.9 354 3 2 12 31.824 63.648 0.342 5.07 12 23.7 0.4 355 6 2 -5 31.954 63.907 0.344 5.02 12 14.4 0.1 356 6 2 5 31.954 63.907 0.344 5.02 12 15.5 0.2 357 5 3 -6 31.957 63.914 0.344 5.02 12 19.7 0.2 358 5 3 6 31.957 63.914 0.344 5.02 12 23.9 0.4 359 7 0 6 31.957 63.914 0.344 5.02 12 14.3 0.1 360 4 3 -9 32.053 64.106 0.344 4.99 12 29.2 0.5 361 4 3 9 32.053 64.106 0.344 4.99 12 34.3 0.7 362 3 1 -13 32.08 64.16 0.345 4.98 12 106.9 7.2 363 3 1 13 32.08 64.16 0.345 4.98 12 108.9 7.5 364 7 1 -3 32.142 64.283 0.345 4.96 12 19.9 0.3 365 7 1 3 32.142 64.283 0.345 4.96 12 14.4 0.1 366 4 1 -12 32.429 64.859 0.348 4.86 12 35.6 0.8 367 4 1 12 32.429 64.859 0.348 4.86 12 24.0 0.4 368 6 1 -8 32.46 64.92 0.348 4.85 12 12.4 0.1 369 6 1 8 32.46 64.92 0.348 4.85 12 9.2 0.1 370 2 1 -14 32.5 64.999 0.349 4.84 12 42.8 1.1 371 2 1 14 32.5 64.999 0.349 4.84 12 43.4 1.2 372 5 4 0 32.605 65.21 0.35 4.81 12 20.6 0.3 373 4 2 -11 32.641 65.282 0.35 4.8 12 76.2 3.5 374 4 2 11 32.641 65.282 0.35 4.8 12 72.2 3.2 375 5 2 -9 32.656 65.313 0.35 4.79 12 25.3 0.4 376 5 2 9 32.656 65.313 0.35 4.79 12 22.2 0.3 377 5 4 -1 32.687 65.374 0.351 4.78 12 17.9 0.2 378 5 4 1 32.687 65.374 0.351 4.78 12 17.1 0.2 379 7 1 -4 32.719 65.438 0.351 4.77 12 18.2 0.2 380 7 1 4 32.719 65.438 0.351 4.77 12 20.3 0.3 381 6 2 -6 32.861 65.722 0.352 4.73 12 17.4 0.2 382 6 2 6 32.861 65.722 0.352 4.73 12 24.1 0.3 383 5 4 -2 32.933 65.866 0.353 4.71 12 19.5 0.2 384 5 4 2 32.933 65.866 0.353 4.71 12 21.3 0.3 385 4 0 13 32.982 65.964 0.353 4.69 12 201.7 24.3 386 5 3 -7 33.028 66.056 0.354 4.68 12 86.8 4.5 387 5 3 7 33.028 66.056 0.354 4.68 12 78.9 3.7 388 7 0 7 33.028 66.056 0.354 4.68 12 8.5 0.0 389 1 0 15 33.08 66.16 0.354 4.66 12 18.3 0.2 390 3 0 14 33.099 66.197 0.354 4.65 12 27.0 0.4 391 6 3 0 33.203 66.406 0.355 4.62 12 49.4 1.4 392 6 3 -1 33.284 66.569 0.356 4.6 12 50.0 1.5 393 6 3 1 33.284 66.569 0.356 4.6 12 54.5 1.7 394 6 0 10 33.314 66.627 0.357 4.59 12 17.7 0.2 395 5 4 -3 33.341 66.681 0.357 4.58 12 39.3 0.9 396 5 4 3 33.341 66.681 0.357 4.58 12 41.4 1.0 397 7 1 -5 33.453 66.907 0.358 4.55 12 30.5 0.5 398 7 1 5 33.453 66.907 0.358 4.55 12 35.8 0.7 399 8 0 0 33.5 67.0 0.358 4.54 6 162.9 7.7 400 6 3 -2 33.528 67.056 0.359 4.53 12 19.6 0.2 401 6 3 2 33.528 67.056 0.359 4.53 12 23.0 0.3 402 5 1 -11 33.536 67.071 0.359 4.53 12 23.6 0.3 403 5 1 11 33.536 67.071 0.359 4.53 12 23.6 0.3 404 8 0 1 33.581 67.162 0.359 4.51 12 108.5 6.8 405 4 3 -10 33.61 67.22 0.359 4.51 12 37.4 0.8 406 4 3 10 33.61 67.22 0.359 4.51 12 41.9 1.0 407 5 0 12 33.623 67.246 0.359 4.5 12 58.1 1.9 408 8 0 2 33.823 67.647 0.361 4.45 12 6.8 0.0 409 6 1 -9 33.846 67.692 0.362 4.44 12 41.3 1.0 410 6 1 9 33.846 67.692 0.362 4.44 12 51.8 1.5 411 3 2 -13 33.872 67.744 0.362 4.43 12 15.3 0.1 412 3 2 13 33.872 67.744 0.362 4.43 12 23.3 0.3 413 5 4 -4 33.907 67.815 0.362 4.42 12 53.5 1.6 414 5 4 4 33.907 67.815 0.362 4.42 12 49.5 1.4 415 6 2 -7 33.917 67.834 0.362 4.42 12 31.0 0.5 416 6 2 7 33.917 67.834 0.362 4.42 12 29.0 0.5 417 6 3 -3 33.932 67.864 0.362 4.42 12 20.3 0.2 418 6 3 3 33.932 67.864 0.362 4.42 12 12.9 0.1 419 4 4 -8 33.948 67.896 0.362 4.41 6 497.6 69.5 420 4 4 8 33.948 67.896 0.362 4.41 6 498.9 69.9 421 2 0 15 33.969 67.937 0.363 4.41 12 38.4 0.8 422 2 2 -14 33.987 67.974 0.363 4.4 6 5.5 0.0 423 2 2 14 33.987 67.974 0.363 4.4 6 10.6 0.0 424 5 2 -10 34.199 68.398 0.365 4.35 12 42.0 1.0 425 5 2 10 34.199 68.398 0.365 4.35 12 41.7 1.0 426 3 3 -12 34.212 68.424 0.365 4.34 6 109.0 3.3 427 3 3 12 34.212 68.424 0.365 4.34 6 103.3 2.9 428 8 0 3 34.226 68.452 0.365 4.34 12 95.3 5.0 429 5 3 -8 34.242 68.484 0.365 4.33 12 58.4 1.9 430 5 3 8 34.242 68.484 0.365 4.33 12 55.9 1.7 431 7 0 8 34.242 68.484 0.365 4.33 12 2.8 0.0 432 3 1 -14 34.281 68.561 0.366 4.32 12 18.1 0.2 433 3 1 14 34.281 68.561 0.366 4.32 12 15.1 0.1 434 7 1 -6 34.34 68.681 0.366 4.31 12 19.6 0.2 435 7 1 6 34.34 68.681 0.366 4.31 12 14.0 0.1 436 7 2 0 34.383 68.766 0.367 4.3 12 114.6 7.2 437 4 1 -13 34.459 68.918 0.367 4.28 12 51.5 1.4 438 4 1 13 34.459 68.918 0.367 4.28 12 57.6 1.8 439 7 2 -1 34.463 68.926 0.367 4.28 12 6.5 0.0 440 7 2 1 34.463 68.926 0.367 4.28 12 5.0 0.0 441 6 3 -4 34.494 68.988 0.368 4.27 12 53.1 1.5 442 6 3 4 34.494 68.988 0.368 4.27 12 52.8 1.5 443 4 2 -12 34.505 69.009 0.368 4.27 12 26.3 0.4 444 4 2 12 34.505 69.009 0.368 4.27 12 10.8 0.1 445 5 4 -5 34.629 69.259 0.369 4.24 12 122.3 8.1 446 5 4 5 34.629 69.259 0.369 4.24 12 124.7 8.4 447 7 2 -2 34.703 69.405 0.37 4.22 12 4.8 0.0 448 7 2 2 34.703 69.405 0.37 4.22 12 10.0 0.1 449 8 0 4 34.786 69.571 0.37 4.2 12 451.4 108.7 450 2 1 -15 34.846 69.692 0.371 4.18 12 20.2 0.2 451 2 1 15 34.846 69.692 0.371 4.18 12 23.3 0.3 452 6 0 11 35.001 70.002 0.372 4.14 12 44.4 1.0 453 7 2 -3 35.1 70.201 0.373 4.12 12 16.3 0.1 454 7 2 3 35.1 70.201 0.373 4.12 12 21.9 0.3 455 6 2 -8 35.116 70.233 0.373 4.12 12 57.5 1.7 456 6 2 8 35.116 70.233 0.373 4.12 12 63.5 2.1 457 4 0 14 35.154 70.309 0.374 4.11 12 37.5 0.7 458 6 3 -5 35.21 70.421 0.374 4.1 12 29.4 0.4 459 6 3 5 35.21 70.421 0.374 4.1 12 33.6 0.6 460 0 0 16 35.277 70.554 0.375 4.08 2 793.6 54.5 461 4 3 -11 35.291 70.581 0.375 4.08 12 40.3 0.8 462 4 3 11 35.291 70.581 0.375 4.08 12 28.9 0.4 463 6 1 -10 35.363 70.727 0.376 4.06 12 23.9 0.3 464 6 1 10 35.363 70.727 0.376 4.06 12 23.8 0.3 465 7 1 -7 35.375 70.75 0.376 4.06 12 44.7 1.0 466 7 1 7 35.375 70.75 0.376 4.06 12 45.1 1.0 467 5 1 -12 35.376 70.752 0.376 4.06 12 96.8 4.8 468 5 1 12 35.376 70.752 0.376 4.06 12 100.3 5.2 469 3 0 15 35.426 70.851 0.376 4.05 12 71.9 2.7 470 8 0 5 35.499 70.999 0.377 4.03 12 169.3 14.7 471 5 4 -6 35.502 71.005 0.377 4.03 12 8.5 0.0 472 5 4 6 35.502 71.005 0.377 4.03 12 10.9 0.1 473 1 0 16 35.566 71.131 0.378 4.01 12 35.7 0.7 474 5 3 -9 35.594 71.188 0.378 4.01 12 79.5 3.2 475 5 3 9 35.594 71.188 0.378 4.01 12 81.1 3.4 476 7 0 9 35.594 71.188 0.378 4.01 12 45.0 1.0 477 5 0 13 35.619 71.239 0.378 4.0 12 47.8 1.2 478 7 2 -4 35.654 71.308 0.378 3.99 12 86.4 3.8 479 7 2 4 35.654 71.308 0.378 3.99 12 82.8 3.5 480 5 2 -11 35.867 71.734 0.38 3.95 12 39.3 0.8 481 5 2 11 35.867 71.734 0.38 3.95 12 39.6 0.8 482 3 2 -14 36.019 72.038 0.382 3.92 12 9.5 0.0 483 3 2 14 36.019 72.038 0.382 3.92 12 10.3 0.1 484 6 3 -6 36.077 72.155 0.382 3.9 12 14.3 0.1 485 6 3 6 36.077 72.155 0.382 3.9 12 9.9 0.0 486 8 1 0 36.119 72.238 0.383 3.89 12 43.2 0.9 487 1 1 -16 36.14 72.28 0.383 3.89 6 212.9 11.2 488 1 1 16 36.14 72.28 0.383 3.89 6 213.2 11.2 489 8 1 -1 36.198 72.395 0.383 3.88 12 44.2 1.0 490 8 1 1 36.198 72.395 0.383 3.88 12 53.1 1.4 491 7 2 -5 36.36 72.721 0.385 3.84 12 13.6 0.1 492 7 2 5 36.36 72.721 0.385 3.84 12 2.6 0.0 493 8 0 6 36.363 72.727 0.385 3.84 12 13.4 0.1 494 2 0 16 36.426 72.852 0.385 3.83 12 33.0 0.5 495 8 1 -2 36.432 72.864 0.385 3.83 12 8.2 0.0 496 8 1 2 36.432 72.864 0.385 3.83 12 10.8 0.1 497 6 2 -9 36.454 72.908 0.386 3.83 12 64.8 2.0 498 6 2 9 36.454 72.908 0.386 3.83 12 68.7 2.3 499 4 2 -13 36.479 72.958 0.386 3.82 12 16.4 0.1 500 4 2 13 36.479 72.958 0.386 3.82 12 16.6 0.1 501 5 4 -7 36.523 73.046 0.386 3.81 12 45.7 1.0 502 5 4 7 36.523 73.046 0.386 3.81 12 46.3 1.0 503 7 1 -8 36.553 73.106 0.387 3.81 12 293.4 41.7 504 7 1 8 36.553 73.106 0.387 3.81 12 292.9 41.5 505 3 1 -15 36.573 73.146 0.387 3.8 12 38.6 0.7 506 3 1 15 36.573 73.146 0.387 3.8 12 37.4 0.7 507 4 1 -14 36.59 73.181 0.387 3.8 12 26.8 0.3 508 4 1 14 36.59 73.181 0.387 3.8 12 19.8 0.2 509 5 5 0 36.69 73.38 0.388 3.78 6 57.7 0.8 510 4 4 -10 36.796 73.592 0.389 3.76 6 76.9 1.4 511 4 4 10 36.796 73.592 0.389 3.76 6 76.7 1.4 512 6 0 12 36.809 73.617 0.389 3.76 12 89.3 3.8 513 8 1 -3 36.822 73.644 0.389 3.75 12 20.3 0.2 514 8 1 3 36.822 73.644 0.389 3.75 12 24.9 0.3 515 6 4 0 36.974 73.949 0.39 3.72 12 82.6 3.2 516 5 5 -2 37.001 74.002 0.391 3.72 6 23.1 0.1 517 5 5 2 37.001 74.002 0.391 3.72 6 29.7 0.2 518 6 1 -11 37.009 74.017 0.391 3.72 12 64.8 2.0 519 6 1 11 37.009 74.017 0.391 3.72 12 65.3 2.0 520 6 4 -1 37.052 74.104 0.391 3.71 12 32.8 0.5 521 6 4 1 37.052 74.104 0.391 3.71 12 35.1 0.6 522 5 3 -10 37.08 74.16 0.391 3.7 12 33.9 0.5 523 5 3 10 37.08 74.16 0.391 3.7 12 38.6 0.7 524 7 0 10 37.08 74.16 0.391 3.7 12 43.3 0.9 525 6 3 -7 37.091 74.183 0.391 3.7 12 78.2 2.9 526 6 3 7 37.091 74.183 0.391 3.7 12 68.6 2.2 527 4 3 -12 37.092 74.185 0.391 3.7 12 140.0 9.2 528 4 3 12 37.092 74.185 0.391 3.7 12 140.6 9.3 529 7 2 -6 37.216 74.433 0.393 3.68 12 10.5 0.1 530 7 2 6 37.216 74.433 0.393 3.68 12 17.2 0.1 531 2 1 -16 37.278 74.557 0.393 3.67 12 6.9 0.0 532 2 1 16 37.278 74.557 0.393 3.67 12 39.9 0.7 533 6 4 -2 37.285 74.569 0.393 3.67 12 14.4 0.1 534 6 4 2 37.285 74.569 0.393 3.67 12 10.6 0.1 535 5 1 -13 37.331 74.662 0.394 3.66 12 11.4 0.1 536 5 1 13 37.331 74.662 0.394 3.66 12 13.4 0.1 537 8 1 -4 37.365 74.73 0.394 3.65 12 152.9 10.9 538 8 1 4 37.365 74.73 0.394 3.65 12 155.8 11.3 539 8 0 7 37.374 74.749 0.394 3.65 12 98.8 4.5 540 4 0 15 37.424 74.848 0.394 3.64 12 124.7 7.2 541 5 2 -12 37.658 75.315 0.397 3.6 12 19.5 0.2 542 5 2 12 37.658 75.315 0.397 3.6 12 21.5 0.2 543 6 4 -3 37.671 75.342 0.397 3.6 12 10.6 0.1 544 6 4 3 37.671 75.342 0.397 3.6 12 11.2 0.1 545 5 4 -8 37.687 75.373 0.397 3.6 12 63.9 1.9 546 5 4 8 37.687 75.373 0.397 3.6 12 57.1 1.5 547 5 0 14 37.724 75.447 0.397 3.59 12 22.1 0.2 548 7 3 0 37.822 75.644 0.398 3.57 12 32.6 0.5 549 3 0 16 37.843 75.686 0.398 3.57 12 170.2 13.2 550 7 1 -9 37.87 75.741 0.398 3.57 12 41.0 0.8 551 7 1 9 37.87 75.741 0.398 3.57 12 28.6 0.4 552 7 3 -1 37.899 75.798 0.399 3.56 12 28.5 0.4 553 7 3 1 37.899 75.798 0.399 3.56 12 24.0 0.3 554 6 2 -10 37.927 75.854 0.399 3.56 12 22.2 0.2 555 6 2 10 37.927 75.854 0.399 3.56 12 28.1 0.4 556 5 5 -4 37.929 75.858 0.399 3.56 6 32.0 0.2 557 5 5 4 37.929 75.858 0.399 3.56 6 31.8 0.2 558 8 1 -5 38.059 76.119 0.4 3.53 12 76.1 2.6 559 8 1 5 38.059 76.119 0.4 3.53 12 62.8 1.8 560 7 3 -2 38.13 76.26 0.401 3.52 12 29.5 0.4 561 7 3 2 38.13 76.26 0.401 3.52 12 24.9 0.3 562 1 0 17 38.133 76.266 0.401 3.52 12 33.9 0.5 563 6 4 -4 38.21 76.42 0.402 3.51 12 25.7 0.3 564 6 4 4 38.21 76.42 0.402 3.51 12 26.4 0.3 565 7 2 -7 38.219 76.438 0.402 3.51 12 11.7 0.1 566 7 2 7 38.219 76.438 0.402 3.51 12 11.2 0.1 567 6 3 -8 38.249 76.498 0.402 3.5 12 318.3 45.2 568 6 3 8 38.249 76.498 0.402 3.5 12 320.0 45.6 569 3 2 -15 38.268 76.537 0.402 3.5 12 47.8 1.0 570 3 2 15 38.268 76.537 0.402 3.5 12 46.5 1.0 571 3 3 -14 38.286 76.571 0.402 3.5 6 14.2 0.0 572 3 3 14 38.286 76.571 0.402 3.5 6 8.0 0.0 573 9 0 0 38.384 76.768 0.403 3.48 6 466.9 48.3 574 9 0 1 38.46 76.921 0.404 3.47 12 21.9 0.2 575 7 3 -3 38.514 77.027 0.404 3.46 12 8.4 0.0 576 7 3 3 38.514 77.027 0.404 3.46 12 9.3 0.0 577 8 0 8 38.529 77.058 0.404 3.46 12 132.9 7.8 578 4 2 -14 38.566 77.132 0.405 3.45 12 2.8 0.0 579 4 2 14 38.566 77.132 0.405 3.45 12 0.8 0.0 580 2 2 -16 38.684 77.368 0.406 3.44 6 86.2 1.6 581 2 2 16 38.684 77.368 0.406 3.44 6 83.5 1.5 582 9 0 2 38.69 77.38 0.406 3.44 12 18.2 0.1 583 5 3 -11 38.697 77.395 0.406 3.43 12 61.7 1.7 584 5 3 11 38.697 77.395 0.406 3.43 12 65.3 1.9 585 7 0 11 38.697 77.395 0.406 3.43 12 52.8 1.2 586 6 0 13 38.736 77.472 0.406 3.43 12 92.0 3.7 587 6 1 -12 38.78 77.56 0.407 3.42 12 173.9 13.2 588 6 1 12 38.78 77.56 0.407 3.42 12 170.8 12.7 589 4 1 -15 38.828 77.656 0.407 3.41 12 23.2 0.2 590 4 1 15 38.828 77.656 0.407 3.41 12 18.7 0.2 591 6 4 -5 38.899 77.798 0.408 3.4 12 25.8 0.3 592 6 4 5 38.899 77.798 0.408 3.4 12 29.0 0.4 593 8 1 -6 38.902 77.804 0.408 3.4 12 18.4 0.1 594 8 1 6 38.902 77.804 0.408 3.4 12 22.1 0.2 595 3 1 -16 38.963 77.927 0.408 3.39 12 5.5 0.0 596 3 1 16 38.963 77.927 0.408 3.39 12 20.5 0.2 597 2 0 17 38.973 77.945 0.408 3.39 12 22.5 0.2 598 5 4 -9 38.991 77.982 0.408 3.39 12 15.1 0.1 599 5 4 9 38.991 77.982 0.408 3.39 12 12.0 0.1 600 4 3 -13 39.015 78.03 0.409 3.39 12 97.8 4.1 601 4 3 13 39.015 78.03 0.409 3.39 12 99.0 4.2 602 7 3 -4 39.049 78.097 0.409 3.38 12 160.2 11.0 603 7 3 4 39.049 78.097 0.409 3.38 12 159.3 10.9 604 9 0 3 39.072 78.144 0.409 3.38 12 28.5 0.3 605 8 2 0 39.222 78.443 0.41 3.36 12 25.9 0.3 606 8 2 -1 39.298 78.595 0.411 3.35 12 5.5 0.0 607 8 2 1 39.298 78.595 0.411 3.35 12 13.9 0.1 608 7 1 -10 39.325 78.65 0.411 3.34 12 56.4 1.4 609 7 1 10 39.325 78.65 0.411 3.34 12 56.9 1.4 610 7 2 -8 39.366 78.731 0.412 3.34 12 111.7 5.3 611 7 2 8 39.366 78.731 0.412 3.34 12 109.9 5.1 612 5 1 -14 39.402 78.805 0.412 3.33 12 16.5 0.1 613 5 1 14 39.402 78.805 0.412 3.33 12 26.6 0.3 614 5 5 -6 39.459 78.918 0.413 3.33 6 19.5 0.1 615 5 5 6 39.459 78.918 0.413 3.33 6 9.7 0.0 616 8 2 -2 39.526 79.052 0.413 3.32 12 18.7 0.1 617 8 2 2 39.526 79.052 0.413 3.32 12 23.3 0.2 618 6 2 -11 39.533 79.066 0.413 3.32 12 60.0 1.5 619 6 2 11 39.533 79.066 0.413 3.32 12 62.1 1.6 620 6 3 -9 39.547 79.095 0.413 3.31 12 33.6 0.5 621 6 3 9 39.547 79.095 0.413 3.31 12 39.7 0.7 622 5 2 -13 39.572 79.143 0.414 3.31 12 40.9 0.7 623 5 2 13 39.572 79.143 0.414 3.31 12 48.6 1.0 624 9 0 4 39.605 79.21 0.414 3.31 12 81.1 2.8 625 7 3 -5 39.734 79.467 0.415 3.29 12 7.0 0.0 626 7 3 5 39.734 79.467 0.415 3.29 12 9.4 0.0 627 6 4 -6 39.737 79.473 0.415 3.29 12 5.8 0.0 628 6 4 6 39.737 79.473 0.415 3.29 12 9.5 0.0 629 4 0 16 39.798 79.595 0.415 3.28 12 196.3 16.1 630 2 1 -17 39.807 79.613 0.416 3.28 12 76.9 2.5 631 2 1 17 39.807 79.613 0.416 3.28 12 74.4 2.3 632 8 0 9 39.825 79.65 0.416 3.28 12 110.7 5.1 633 8 1 -7 39.892 79.783 0.416 3.27 12 42.9 0.8 634 8 1 7 39.892 79.783 0.416 3.27 12 41.6 0.7 635 8 2 -3 39.906 79.811 0.416 3.27 12 24.6 0.3 636 8 2 3 39.906 79.811 0.416 3.27 12 26.4 0.3 637 5 0 15 39.94 79.88 0.417 3.26 12 20.1 0.2 638 4 4 -12 40.169 80.339 0.419 3.23 6 51.7 0.5 639 4 4 12 40.169 80.339 0.419 3.23 6 55.7 0.6 640 9 0 5 40.288 80.575 0.42 3.22 12 4.9 0.0 641 3 0 17 40.36 80.72 0.42 3.21 12 14.5 0.1 642 5 4 -10 40.434 80.868 0.421 3.2 12 23.2 0.2 643 5 4 10 40.434 80.868 0.421 3.2 12 25.3 0.3 644 8 2 -4 40.436 80.872 0.421 3.2 12 62.1 1.6 645 8 2 4 40.436 80.872 0.421 3.2 12 60.4 1.5 646 5 3 -12 40.446 80.892 0.421 3.2 12 64.0 1.7 647 5 3 12 40.446 80.892 0.421 3.2 12 61.4 1.5 648 7 0 12 40.446 80.892 0.421 3.2 12 142.8 8.3 649 0 0 18 40.521 81.041 0.422 3.19 2 126.2 1.1 650 7 3 -6 40.567 81.134 0.422 3.19 12 4.4 0.0 651 7 3 6 40.567 81.134 0.422 3.19 12 4.4 0.0 652 3 2 -16 40.627 81.255 0.423 3.18 12 34.0 0.5 653 3 2 16 40.627 81.255 0.423 3.18 12 31.7 0.4 654 7 2 -9 40.654 81.309 0.423 3.18 12 14.8 0.1 655 7 2 9 40.654 81.309 0.423 3.18 12 20.5 0.2 656 6 1 -13 40.679 81.357 0.423 3.17 12 33.7 0.5 657 6 1 13 40.679 81.357 0.423 3.17 12 37.6 0.6 658 6 4 -7 40.721 81.442 0.423 3.17 12 23.7 0.2 659 6 4 7 40.721 81.442 0.423 3.17 12 24.6 0.2 660 4 2 -15 40.769 81.538 0.424 3.16 12 31.0 0.4 661 4 2 15 40.769 81.538 0.424 3.16 12 31.5 0.4 662 6 0 14 40.786 81.573 0.424 3.16 12 31.9 0.4 663 1 0 18 40.796 81.593 0.424 3.16 12 24.1 0.2 664 7 1 -11 40.916 81.832 0.425 3.15 12 6.4 0.0 665 7 1 11 40.916 81.832 0.425 3.15 12 14.8 0.1 666 6 3 -10 40.985 81.971 0.426 3.14 12 45.3 0.8 667 6 3 10 40.985 81.971 0.426 3.14 12 44.0 0.8 668 8 1 -8 41.026 82.051 0.426 3.14 12 17.1 0.1 669 8 1 8 41.026 82.051 0.426 3.14 12 14.7 0.1 670 4 3 -14 41.062 82.124 0.426 3.13 12 6.0 0.0 671 4 3 14 41.062 82.124 0.426 3.13 12 9.7 0.0 672 8 2 -5 41.115 82.23 0.427 3.13 12 53.1 1.1 673 8 2 5 41.115 82.23 0.427 3.13 12 48.8 0.9 674 9 0 6 41.118 82.236 0.427 3.13 12 58.0 1.3 675 6 5 0 41.158 82.316 0.427 3.12 12 67.8 1.8 676 9 1 0 41.158 82.316 0.427 3.12 12 78.0 2.4 677 4 1 -16 41.178 82.357 0.427 3.12 12 44.3 0.8 678 4 1 16 41.178 82.357 0.427 3.12 12 34.6 0.5 679 6 5 -1 41.233 82.467 0.428 3.11 12 32.3 0.4 680 6 5 1 41.233 82.467 0.428 3.11 12 33.4 0.4 681 9 1 -1 41.233 82.467 0.428 3.11 12 36.2 0.5 682 9 1 1 41.233 82.467 0.428 3.11 12 30.0 0.4 683 8 0 10 41.261 82.521 0.428 3.11 12 36.5 0.5 684 6 2 -12 41.273 82.545 0.428 3.11 12 87.4 3.0 685 6 2 12 41.273 82.545 0.428 3.11 12 91.0 3.3 686 1 1 -18 41.347 82.694 0.429 3.1 6 35.8 0.3 687 1 1 18 41.347 82.694 0.429 3.1 6 35.1 0.2 688 6 5 -2 41.459 82.919 0.43 3.09 12 14.7 0.1 689 6 5 2 41.459 82.919 0.43 3.09 12 14.8 0.1 690 9 1 -2 41.459 82.919 0.43 3.09 12 17.8 0.1 691 9 1 2 41.459 82.919 0.43 3.09 12 18.5 0.1 692 3 1 -17 41.462 82.925 0.43 3.09 12 41.9 0.7 693 3 1 17 41.462 82.925 0.43 3.09 12 40.9 0.7 694 7 3 -7 41.547 83.093 0.431 3.08 12 9.0 0.0 695 7 3 7 41.547 83.093 0.431 3.08 12 21.8 0.2 696 5 5 -8 41.576 83.151 0.431 3.08 6 35.6 0.2 697 5 5 8 41.576 83.151 0.431 3.08 6 34.1 0.2 698 5 1 -15 41.595 83.189 0.431 3.08 12 32.9 0.4 699 5 1 15 41.595 83.189 0.431 3.08 12 30.2 0.4 700 5 2 -14 41.612 83.224 0.431 3.08 12 9.6 0.0 701 5 2 14 41.612 83.224 0.431 3.08 12 11.4 0.1 702 2 0 18 41.622 83.244 0.431 3.07 12 42.9 0.7 703 7 4 0 41.708 83.416 0.432 3.07 12 236.8 21.9 704 7 4 -1 41.783 83.566 0.433 3.06 12 36.7 0.5 705 7 4 1 41.783 83.566 0.433 3.06 12 35.9 0.5 706 6 5 -3 41.835 83.67 0.433 3.05 12 71.0 2.0 707 6 5 3 41.835 83.67 0.433 3.05 12 69.4 1.9 708 9 1 -3 41.835 83.67 0.433 3.05 12 21.3 0.2 709 9 1 3 41.835 83.67 0.433 3.05 12 16.2 0.1 710 6 4 -8 41.85 83.7 0.433 3.05 12 29.0 0.3 711 6 4 8 41.85 83.7 0.433 3.05 12 33.3 0.4 712 8 2 -6 41.942 83.884 0.434 3.04 12 12.9 0.1 713 8 2 6 41.942 83.884 0.434 3.04 12 15.8 0.1 714 7 4 -2 42.008 84.017 0.434 3.04 12 19.8 0.2 715 7 4 2 42.008 84.017 0.434 3.04 12 23.2 0.2 716 5 4 -11 42.015 84.031 0.434 3.04 12 2.0 0.0 717 5 4 11 42.015 84.031 0.434 3.04 12 14.6 0.1 718 7 2 -10 42.084 84.169 0.435 3.03 12 35.2 0.5 719 7 2 10 42.084 84.169 0.435 3.03 12 33.9 0.4 720 9 0 7 42.095 84.191 0.435 3.03 12 32.7 0.4 721 5 0 16 42.276 84.553 0.437 3.01 12 41.8 0.7 722 4 0 17 42.285 84.571 0.437 3.01 12 79.4 2.4 723 8 1 -9 42.303 84.607 0.437 3.01 12 42.7 0.7 724 8 1 9 42.303 84.607 0.437 3.01 12 38.5 0.6 725 5 3 -13 42.327 84.655 0.437 3.01 12 60.3 1.4 726 5 3 13 42.327 84.655 0.437 3.01 12 66.4 1.7 727 7 0 13 42.327 84.655 0.437 3.01 12 149.9 8.6 728 6 5 -4 42.36 84.721 0.437 3.01 12 12.5 0.1 729 6 5 4 42.36 84.721 0.437 3.01 12 18.6 0.1 730 9 1 -4 42.36 84.721 0.437 3.01 12 77.5 2.3 731 9 1 4 42.36 84.721 0.437 3.01 12 75.6 2.2 732 7 4 -3 42.383 84.767 0.438 3.0 12 12.4 0.1 733 7 4 3 42.383 84.767 0.438 3.0 12 5.2 0.0 734 2 1 -18 42.444 84.889 0.438 3.0 12 9.0 0.0 735 2 1 18 42.444 84.889 0.438 3.0 12 9.1 0.0 736 6 3 -11 42.563 85.126 0.439 2.99 12 14.6 0.1 737 6 3 11 42.563 85.126 0.439 2.99 12 4.6 0.0 738 7 1 -12 42.644 85.288 0.44 2.98 12 12.4 0.1 739 7 1 12 42.644 85.288 0.44 2.98 12 12.2 0.1 740 7 3 -8 42.672 85.344 0.44 2.98 12 39.4 0.6 741 7 3 8 42.672 85.344 0.44 2.98 12 30.6 0.4 742 6 1 -14 42.708 85.416 0.44 2.98 12 28.0 0.3 743 6 1 14 42.708 85.416 0.44 2.98 12 29.5 0.3 744 8 3 0 42.804 85.608 0.441 2.97 12 29.2 0.3 745 3 3 -16 42.824 85.648 0.441 2.97 6 191.8 6.9 746 3 3 16 42.824 85.648 0.441 2.97 6 196.6 7.3 747 8 0 11 42.837 85.674 0.441 2.97 12 74.8 2.1 748 8 3 -1 42.879 85.757 0.442 2.96 12 14.8 0.1 749 8 3 1 42.879 85.757 0.442 2.96 12 13.9 0.1 750 7 4 -4 42.908 85.815 0.442 2.96 12 20.7 0.2 751 7 4 4 42.908 85.815 0.442 2.96 12 21.0 0.2 752 8 2 -7 42.917 85.833 0.442 2.96 12 20.4 0.2 753 8 2 7 42.917 85.833 0.442 2.96 12 25.1 0.2 754 6 0 15 42.965 85.929 0.442 2.96 12 83.7 2.6 755 3 0 18 42.992 85.983 0.443 2.95 12 33.9 0.4 756 6 5 -5 43.034 86.069 0.443 2.95 12 47.3 0.8 757 6 5 5 43.034 86.069 0.443 2.95 12 44.4 0.7 758 9 1 -5 43.034 86.069 0.443 2.95 12 32.0 0.4 759 9 1 5 43.034 86.069 0.443 2.95 12 37.7 0.5 760 4 2 -16 43.097 86.195 0.444 2.95 12 51.6 1.0 761 4 2 16 43.097 86.195 0.444 2.95 12 46.7 0.8 762 8 3 -2 43.103 86.206 0.444 2.95 12 27.7 0.3 763 8 3 2 43.103 86.206 0.444 2.95 12 31.9 0.4 764 3 2 -17 43.106 86.213 0.444 2.95 12 81.7 2.5 765 3 2 17 43.106 86.213 0.444 2.95 12 83.3 2.6 766 6 4 -9 43.124 86.248 0.444 2.94 12 58.3 1.3 767 6 4 9 43.124 86.248 0.444 2.94 12 58.7 1.3 768 6 2 -13 43.148 86.296 0.444 2.94 12 2.2 0.0 769 6 2 13 43.148 86.296 0.444 2.94 12 3.9 0.0 770 9 0 8 43.219 86.438 0.445 2.94 12 145.9 8.0 771 4 3 -15 43.238 86.476 0.445 2.94 12 44.7 0.7 772 4 3 15 43.238 86.476 0.445 2.94 12 37.4 0.5 773 8 3 -3 43.477 86.954 0.447 2.92 12 34.4 0.4 774 8 3 3 43.477 86.954 0.447 2.92 12 28.0 0.3 775 1 0 19 43.573 87.146 0.447 2.91 12 14.2 0.1 776 7 4 -5 43.581 87.162 0.447 2.91 12 16.5 0.1 777 7 4 5 43.581 87.162 0.447 2.91 12 18.9 0.1 778 10 0 0 43.624 87.247 0.448 2.91 6 30.2 0.2 779 4 1 -17 43.653 87.305 0.448 2.91 12 24.6 0.2 780 4 1 17 43.653 87.305 0.448 2.91 12 24.5 0.2 781 7 2 -11 43.657 87.313 0.448 2.91 12 50.0 0.9 782 7 2 11 43.657 87.313 0.448 2.91 12 47.7 0.8 783 10 0 1 43.698 87.397 0.448 2.9 12 22.4 0.2 784 8 1 -10 43.725 87.451 0.449 2.9 12 17.6 0.1 785 8 1 10 43.725 87.451 0.449 2.9 12 14.9 0.1 786 5 4 -12 43.737 87.475 0.449 2.9 12 11.8 0.1 787 5 4 12 43.737 87.475 0.449 2.9 12 21.3 0.2 788 5 2 -15 43.784 87.568 0.449 2.9 12 5.4 0.0 789 5 2 15 43.784 87.568 0.449 2.9 12 27.1 0.3 790 2 2 -18 43.811 87.622 0.449 2.9 6 44.4 0.4 791 2 2 18 43.811 87.622 0.449 2.9 6 46.3 0.4 792 6 5 -6 43.857 87.714 0.45 2.89 12 1.1 0.0 793 6 5 6 43.857 87.714 0.45 2.89 12 4.3 0.0 794 9 1 -6 43.857 87.714 0.45 2.89 12 10.4 0.0 795 9 1 6 43.857 87.714 0.45 2.89 12 17.9 0.1 796 5 1 -16 43.917 87.833 0.45 2.89 12 44.6 0.7 797 5 1 16 43.917 87.833 0.45 2.89 12 58.0 1.2 798 10 0 2 43.923 87.845 0.45 2.89 12 8.9 0.0 799 7 3 -9 43.943 87.887 0.45 2.89 12 20.4 0.2 800 7 3 9 43.943 87.887 0.45 2.89 12 24.8 0.2 801 8 3 -4 44.0 88.0 0.451 2.88 12 20.4 0.2 802 8 3 4 44.0 88.0 0.451 2.88 12 37.7 0.5 803 8 2 -8 44.038 88.076 0.451 2.88 12 23.7 0.2 804 8 2 8 44.038 88.076 0.451 2.88 12 15.0 0.1 805 4 4 -14 44.074 88.148 0.452 2.88 6 27.9 0.1 806 4 4 14 44.074 88.148 0.452 2.88 6 33.0 0.2 807 3 1 -18 44.084 88.168 0.452 2.88 12 50.3 0.9 808 3 1 18 44.084 88.168 0.452 2.88 12 51.5 1.0 809 5 5 -10 44.271 88.542 0.453 2.87 6 70.5 0.9 810 5 5 10 44.271 88.542 0.453 2.87 6 69.4 0.9 811 6 3 -12 44.283 88.566 0.453 2.87 12 12.4 0.1 812 6 3 12 44.283 88.566 0.453 2.87 12 14.4 0.1 813 10 0 3 44.296 88.592 0.453 2.87 12 7.6 0.0 814 5 3 -14 44.347 88.694 0.454 2.86 12 19.0 0.1 815 5 3 14 44.347 88.694 0.454 2.86 12 7.6 0.0 816 7 0 14 44.347 88.694 0.454 2.86 12 13.9 0.1 817 2 0 19 44.392 88.783 0.454 2.86 12 9.4 0.0 818 7 4 -6 44.402 88.805 0.454 2.86 12 8.8 0.0 819 7 4 6 44.402 88.805 0.454 2.86 12 4.7 0.0 820 9 2 0 44.442 88.885 0.455 2.86 12 87.3 2.8 821 9 0 9 44.489 88.978 0.455 2.86 12 13.9 0.1 822 7 1 -13 44.513 89.026 0.455 2.85 12 15.8 0.1 823 7 1 13 44.513 89.026 0.455 2.85 12 26.4 0.3 824 9 2 -1 44.517 89.034 0.455 2.85 12 23.9 0.2 825 9 2 1 44.517 89.034 0.455 2.85 12 19.9 0.1 826 6 4 -10 44.544 89.088 0.455 2.85 12 43.4 0.7 827 6 4 10 44.544 89.088 0.455 2.85 12 47.1 0.8 828 8 0 12 44.556 89.112 0.455 2.85 12 362.7 47.7 829 8 3 -5 44.672 89.345 0.456 2.85 12 117.1 5.0 830 8 3 5 44.672 89.345 0.456 2.85 12 120.5 5.3 831 9 2 -2 44.741 89.482 0.457 2.84 12 4.2 0.0 832 9 2 2 44.741 89.482 0.457 2.84 12 9.1 0.0 833 5 0 17 44.744 89.488 0.457 2.84 12 26.3 0.3 834 10 0 4 44.819 89.637 0.458 2.84 12 10.0 0.0 835 6 5 -7 44.828 89.655 0.458 2.84 12 32.4 0.4 836 6 5 7 44.828 89.655 0.458 2.84 12 23.8 0.2 837 9 1 -7 44.828 89.655 0.458 2.84 12 62.7 1.4 838 9 1 7 44.828 89.655 0.458 2.84 12 70.3 1.8 839 6 1 -15 44.875 89.751 0.458 2.83 12 11.5 0.0 840 6 1 15 44.875 89.751 0.458 2.83 12 17.8 0.1 841 4 0 18 44.902 89.805 0.458 2.83 12 25.1 0.2 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 3.956 7.912 11.1648 94.0 9.9 10.0 5.6 2 0 0 2 4.14 8.28 10.67 15.1 1.6 1.6 5.6 3 1 0 1 4.466 8.932 9.89266 85.5 9.0 9.1 5.6 4 1 0 2 5.731 11.462 7.71382 16.0 1.7 1.7 5.6 5 1 1 0 6.863 13.726 6.446 84.1 8.8 8.9 5.6 6 1 0 3 7.377 14.754 5.99919 69.6 7.3 7.4 5.6 7 2 0 0 7.931 15.862 5.5824 11.0 1.2 1.2 5.6 8 1 1 2 8.025 16.051 5.51734 23.1 2.4 2.4 5.6 9 2 0 1 8.2 16.4 5.40067 17.1 1.8 1.8 5.6 10 1 0 4 9.208 18.416 4.81367 470.5 49.4 49.7 5.6 11 2 1 0 10.517 21.035 4.2199 51.3 5.4 5.4 5.6 12 2 1 1 10.724 21.447 4.13973 51.7 5.4 5.4 5.6 13 1 1 4 10.802 21.604 4.10993 10.7 1.1 1.1 5.6 14 1 0 5 11.14 22.281 3.98664 267.4 28.1 28.2 5.6 15 2 1 2 11.32 22.64 3.92415 12.1 1.3 1.3 5.6 16 2 0 4 11.52 23.04 3.85691 16.1 1.7 1.7 5.6 17 3 0 0 11.945 23.89 3.7216 691.2 72.6 72.7 5.6 18 3 0 1 12.128 24.256 3.66627 11.1 1.2 1.2 5.6 19 2 1 3 12.254 24.507 3.62932 50.2 5.3 5.3 5.6 20 2 0 5 13.131 26.262 3.39058 30.7 3.2 3.2 5.6 21 2 1 4 13.458 26.916 3.30969 952.7 100.0 100.0 5.6 22 3 0 3 13.509 27.017 3.29755 20.6 2.2 2.2 5.6 23 3 1 1 14.558 29.116 3.06446 58.4 6.1 6.1 5.6 24 3 0 4 14.617 29.234 3.05232 10.0 1.0 1.0 5.6 25 1 0 7 15.184 30.368 2.94091 29.4 3.1 3.1 5.6 26 3 1 3 15.742 31.483 2.83921 101.6 10.7 10.6 5.6 27 3 0 5 15.939 31.878 2.80499 53.8 5.6 5.6 5.6 28 4 0 0 16.02 32.039 2.7912 68.8 7.2 7.2 5.6 29 4 0 1 16.16 32.32 2.76763 134.0 14.1 14.0 5.6 30 2 2 4 16.214 32.428 2.75867 21.9 2.3 2.3 5.6 31 3 1 4 16.715 33.431 2.67813 152.9 16.1 16.0 5.7 32 0 0 8 16.784 33.568 2.6675 251.7 26.4 26.3 5.7 33 4 0 3 17.245 34.489 2.59833 94.7 9.9 9.9 5.7 34 3 2 0 17.501 35.003 2.56138 14.1 1.5 1.5 5.7 35 3 1 5 17.898 35.797 2.50638 72.9 7.7 7.6 5.7 36 4 0 4 18.147 36.294 2.47317 156.7 16.5 16.3 5.7 37 4 1 0 18.431 36.862 2.43636 42.8 4.5 4.5 5.7 38 3 0 7 19.064 38.127 2.35834 23.8 2.5 2.5 5.7 39 4 0 5 19.253 38.506 2.336 39.8 4.2 4.1 5.7 40 4 1 3 19.523 39.047 2.30491 14.9 1.6 1.6 5.7 41 5 0 0 20.179 40.359 2.23296 10.0 1.0 1.0 5.7 42 3 0 8 20.811 41.621 2.16809 71.9 7.5 7.4 5.7 43 3 3 0 21.008 42.015 2.14867 286.1 30.0 29.6 5.7 44 0 0 10 21.159 42.318 2.134 10.4 1.1 1.1 5.7 45 4 2 0 21.412 42.824 2.10995 19.4 2.0 2.0 5.7 46 2 1 9 21.878 43.756 2.06714 13.4 1.4 1.4 5.7 47 4 0 7 21.973 43.945 2.05866 17.6 1.9 1.8 5.7 48 2 2 8 22.014 44.029 2.05497 48.7 5.1 5.0 5.7 49 1 1 10 22.347 44.695 2.02587 9.8 1.0 1.0 5.7 50 5 1 0 22.59 45.18 2.00526 40.1 4.2 4.1 5.7 51 3 3 4 22.735 45.471 1.99309 23.5 2.5 2.4 5.7 52 4 2 4 23.115 46.231 1.96207 31.1 3.3 3.2 5.7 53 4 0 8 23.542 47.085 1.92846 91.6 9.6 9.4 5.7 54 3 1 9 24.152 48.304 1.88258 10.4 1.1 1.1 5.7 55 5 1 4 24.228 48.456 1.87704 53.2 5.6 5.5 5.7 56 6 0 1 24.552 49.104 1.85377 10.6 1.1 1.1 5.7 57 4 3 1 24.911 49.822 1.82873 14.5 1.5 1.5 5.7 58 4 0 9 25.23 50.46 1.80709 22.8 2.4 2.3 5.8 59 4 1 8 25.352 50.705 1.79894 171.9 18.0 17.6 5.8 60 5 2 0 25.522 51.044 1.7878 24.9 2.6 2.5 5.8 61 4 3 3 25.684 51.368 1.77727 11.2 1.2 1.2 5.8 62 2 1 11 25.913 51.825 1.76265 19.8 2.1 2.0 5.8 63 1 0 12 26.015 52.03 1.7562 49.8 5.2 5.1 5.8 64 4 3 4 26.347 52.694 1.73563 64.2 6.7 6.6 5.8 65 5 2 5 27.848 55.696 1.64897 17.4 1.8 1.8 5.8 66 2 1 12 28.037 56.074 1.63876 71.5 7.5 7.3 5.8 67 6 1 4 28.352 56.704 1.62202 43.6 4.6 4.4 5.8 68 4 4 0 28.554 57.108 1.6115 96.0 10.1 9.8 5.8 69 5 1 8 28.722 57.444 1.60287 12.8 1.3 1.3 5.8 70 7 0 1 28.966 57.932 1.59054 15.6 1.6 1.6 5.8 71 7 0 3 29.665 59.331 1.55633 27.2 2.8 2.8 5.8 72 3 1 12 29.967 59.933 1.54212 22.1 2.3 2.2 5.8 73 7 0 4 30.269 60.538 1.52814 26.0 2.7 2.6 5.8 74 6 0 8 30.313 60.625 1.52616 56.7 5.9 5.7 5.8 75 6 2 3 30.608 61.215 1.51286 9.7 1.0 1.0 5.8 76 4 0 12 30.903 61.806 1.4998 50.7 5.3 5.1 5.8 77 5 3 5 31.035 62.07 1.49405 34.2 3.6 3.4 5.8 78 6 2 4 31.2 62.401 1.48693 24.8 2.6 2.5 5.8 79 7 1 0 31.391 62.782 1.47881 36.4 3.8 3.7 5.9 80 3 1 13 32.08 64.16 1.45035 14.7 1.5 1.5 5.9 81 4 0 13 32.982 65.964 1.41497 24.3 2.5 2.4 5.9 82 4 4 8 33.948 67.896 1.37933 140.2 14.7 14.0 5.9 83 8 0 3 34.226 68.452 1.36949 14.8 1.6 1.5 5.9 84 5 4 5 34.629 69.259 1.3555 16.4 1.7 1.6 5.9 85 8 0 4 34.786 69.571 1.35017 108.7 11.4 10.8 5.9 86 0 0 16 35.277 70.554 1.33375 55.7 5.9 5.5 5.9 87 5 1 12 35.376 70.752 1.3305 12.1 1.3 1.2 5.9 88 8 0 5 35.499 70.999 1.32648 14.8 1.6 1.5 5.9 89 1 1 16 36.14 72.28 1.30608 22.5 2.4 2.2 5.9 90 7 1 8 36.553 73.106 1.29336 84.6 8.9 8.4 6.0 91 4 3 12 37.092 74.185 1.2772 23.6 2.5 2.3 6.0 92 8 1 4 37.365 74.73 1.26922 26.7 2.8 2.6 6.0 93 3 0 16 37.843 75.686 1.25556 14.3 1.5 1.4 6.0 94 6 3 8 38.249 76.498 1.24424 92.8 9.7 9.1 6.0 95 9 0 0 38.384 76.768 1.24053 48.3 5.1 4.7 6.0 96 6 1 12 38.78 77.56 1.22983 25.8 2.7 2.5 6.0 97 7 3 4 39.049 78.097 1.2227 22.3 2.3 2.2 6.0 98 7 2 8 39.366 78.731 1.21444 10.4 1.1 1.0 6.0 99 4 0 16 39.798 79.595 1.20342 26.0 2.7 2.5 6.0 100 7 0 12 40.446 80.892 1.18737 14.6 1.5 1.4 6.1 101 7 4 0 41.708 83.416 1.15774 21.9 2.3 2.1 6.1 102 7 0 13 42.327 84.655 1.14392 11.7 1.2 1.1 6.1 103 3 3 16 42.824 85.648 1.13319 16.3 1.7 1.6 6.1 104 8 0 12 44.556 89.112 1.09788 47.7 5.0 4.6 6.2 105 8 3 5 44.672 89.345 1.09563 10.2 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) |