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 *** *********************** PYROXFERROITE 1 (Fe++,Mn)(7)[Si(7)O(21)] Triclinic P 1(-) Z = 2 P1(-) 28 .1 .10 Ref.Str.: Burnham C.W. (1971) * Proceedings of the Second Lunar Science Conference, 47-57 R: Apollo 11 microgabbro sample 10047, Mare Tranquillitatis, Moon. N.A.D. Initial data from BDM-file Lattice parameters (cub. angs.,degr.): a = 6.6213 alpha = 114.27 b = 7.5506 beta = 82.68 c = 17.3806 gamma = 94.58 Unit cell volume (cub. angs.) = 785.35 Molar volume ( cub.cm/mol.) = 236.52 Co-ordinates, thermal parameters, occupation for atomic positions: NoP x/a y/b z/c B(j) atom / occupation 1 0.0431 0.4591 0.3953 0.0 Fe = 1.00 2 0.1604 0.336 0.1887 0.0 Fe = 0.92, Ca = 0.08 3 0.0663 0.4341 0.8963 0.0 Fe = 1.00 4 0.1626 0.3098 0.6945 0.0 Fe = 0.96, Ca = 0.04 5 0.271 0.2218 0.9892 0.0 Fe = 0.72, Ca = 0.28 6 0.8086 0.8308 0.517 0.0 Fe = 0.81, Ca = 0.19 7 0.6226 0.8638 0.7111 0.0 Fe = 0.65, Ca = 0.35 8 0.2431 0.8551 0.5661 0.0 Si = 1.00 9 0.1262 0.9578 0.75 0.0 Si = 1.00 10 0.3251 0.7544 0.8399 0.0 Si = 1.00 11 0.7843 0.1336 0.9673 0.0 Si = 1.00 12 0.5812 0.3419 0.8786 0.0 Si = 1.00 13 0.682 0.2381 0.6884 0.0 Si = 1.00 14 0.491 0.4119 0.5887 0.0 Si = 1.00 15 0.0563 0.7004 0.5297 0.0 O = 1.00 16 0.0633 0.196 0.273 0.0 O = 1.00 17 0.1534 0.5817 0.8123 0.0 O = 1.00 18 0.0338 0.7069 0.0183 0.0 O = 1.00 19 0.2407 0.4938 0.1061 0.0 O = 1.00 20 0.132 0.6077 0.3051 0.0 O = 1.00 21 0.3481 0.4167 0.3963 0.0 O = 1.00 22 0.2503 0.4417 0.5942 0.0 O = 1.00 23 0.1783 0.0628 0.5724 0.0 O = 1.00 24 0.0744 0.182 0.7787 0.0 O = 1.00 25 0.546 0.706 0.7907 0.0 O = 1.00 26 0.8408 0.91 0.9245 0.0 O = 1.00 27 0.3561 0.4066 0.92 0.0 O = 1.00 28 0.735 0.0164 0.6307 0.0 O = 1.00 29 0.2878 0.8866 0.6621 0.0 O = 1.00 30 0.2501 0.9367 0.8214 0.0 O = 1.00 31 0.3422 0.8445 0.9417 0.0 O = 1.00 32 0.6225 0.1803 0.9148 0.0 O = 1.00 33 0.588 0.2196 0.7763 0.0 O = 1.00 34 0.4916 0.3146 0.6584 0.0 O = 1.00 35 0.5465 0.2317 0.496 0.0 O = 1.00 Co-ordinates for all atomic positions : No NoP x/a y/b z/c 1 1 0.0431 0.4591 0.3953 2 2 0.1604 0.336 0.1887 3 3 0.0663 0.4341 0.8963 4 4 0.1626 0.3098 0.6945 5 5 0.271 0.2218 0.9892 6 6 0.8086 0.8308 0.517 7 7 0.6226 0.8638 0.7111 8 8 0.2431 0.8551 0.5661 9 9 0.1262 0.9578 0.75 10 10 0.3251 0.7544 0.8399 11 11 0.7843 0.1336 0.9673 12 12 0.5812 0.3419 0.8786 13 13 0.682 0.2381 0.6884 14 14 0.491 0.4119 0.5887 15 15 0.0563 0.7004 0.5297 16 16 0.0633 0.196 0.273 17 17 0.1534 0.5817 0.8123 18 18 0.0338 0.7069 0.0183 19 19 0.2407 0.4938 0.1061 20 20 0.132 0.6077 0.3051 21 21 0.3481 0.4167 0.3963 22 22 0.2503 0.4417 0.5942 23 23 0.1783 0.0628 0.5724 24 24 0.0744 0.182 0.7787 25 25 0.546 0.706 0.7907 26 26 0.8408 0.91 0.9245 27 27 0.3561 0.4066 0.92 28 28 0.735 0.0164 0.6307 29 29 0.2878 0.8866 0.6621 30 30 0.2501 0.9367 0.8214 31 31 0.3422 0.8445 0.9417 32 32 0.6225 0.1803 0.9148 33 33 0.588 0.2196 0.7763 34 34 0.4916 0.3146 0.6584 35 35 0.5465 0.2317 0.496 36 1 0.9569 0.5409 0.6047 37 2 0.8396 0.664 0.8113 38 3 0.9337 0.5659 0.1037 39 4 0.8374 0.6902 0.3055 40 5 0.729 0.7782 0.0108 41 6 0.1914 0.1692 0.483 42 7 0.3774 0.1362 0.2889 43 8 0.7569 0.1449 0.4339 44 9 0.8738 0.0422 0.25 45 10 0.6749 0.2456 0.1601 46 11 0.2157 0.8664 0.0327 47 12 0.4188 0.6581 0.1214 48 13 0.318 0.7619 0.3116 49 14 0.509 0.5881 0.4113 50 15 0.9437 0.2996 0.4703 51 16 0.9367 0.804 0.727 52 17 0.8466 0.4183 0.1877 53 18 0.9662 0.2931 0.9817 54 19 0.7593 0.5062 0.8939 55 20 0.868 0.3923 0.6949 56 21 0.6519 0.5833 0.6037 57 22 0.7497 0.5583 0.4058 58 23 0.8217 0.9372 0.4276 59 24 0.9256 0.818 0.2213 60 25 0.454 0.294 0.2093 61 26 0.1592 0.09 0.0755 62 27 0.6439 0.5934 0.08 63 28 0.265 0.9836 0.3693 64 29 0.7122 0.1134 0.3379 65 30 0.7499 0.0633 0.1786 66 31 0.6578 0.1555 0.0583 67 32 0.3775 0.8197 0.0852 68 33 0.412 0.7804 0.2237 69 34 0.5084 0.6854 0.3416 70 35 0.4535 0.7683 0.504 X-ray density (g/cm cub.) = 3.84 MU (1/cm) = 217.068 Mass attenuation coefficient (cm**2/g) = 56.507 Selected interatomic distances (cation-anion,anion-anion): NoP Atom Rad.sph. C.N. Distance NoP N. (angs.) (angs.) 1 Fe 2.592 6 2.3048 15 2.232 16 2.2735 20 2.0731 21 2.128 15 2.0971 22 2 Fe ,Ca 2.88 6 2.1453 16 2.2077 19 2.2114 20 2.2198 17 2.0921 25 2.0782 26 3 Fe 2.592 6 2.1741 17 2.2693 18 2.1434 24 2.0567 27 2.1706 18 2.1557 19 4 Fe ,Ca 2.88 6 2.2234 17 2.3335 22 2.1712 23 2.0657 24 2.1905 34 2.0928 20 5 Fe ,Ca 2.88 7 2.2177 19 2.1892 27 2.8379 30 2.6836 31 2.4908 32 2.1628 18 2.1482 26 6 Fe ,Ca 2.88 5 2.0583 15 1.922 28 2.2172 22 2.012 23 2.3817 35 7 Fe ,Ca 2.88 7 2.1612 25 2.1808 28 2.5162 29 2.8647 30 2.4665 33 2.237 16 2.1752 21 8 Si 2.1 4 1.6297 15 1.6155 23 1.6482 29 1.6482 35 9 Si 2.1 4 1.6085 24 1.6638 29 1.6374 30 1.6113 16 10 Si 2.1 4 1.6159 17 1.5856 25 1.6608 30 1.6296 31 11 Si 2.1 4 1.5941 26 1.6366 32 1.6004 18 1.6432 31 12 Si 2.1 4 1.5912 27 1.6394 32 1.6287 33 1.6049 19 13 Si 2.1 4 1.5985 28 1.631 33 1.6511 34 1.6074 20 14 Si 2.1 4 1.6126 22 1.6555 34 1.646 35 1.5656 21 15 O 3.264 10 3.0223 21 3.0478 22 2.6118 23 3.1171 28 2.7417 29 2.8369 15 3.1939 16 3.0472 21 2.9625 22 2.6558 35 16 O 3.264 10 2.9317 20 2.9186 21 3.1939 15 3.1695 17 2.7332 24 2.8468 25 3.1772 26 3.2054 28 2.5971 29 2.6807 30 17 O 3.264 9 2.8461 24 2.726 25 3.17 26 3.1639 27 2.6502 30 2.6852 31 3.1695 16 2.9377 19 2.8164 20 18 O 3.264 9 3.114 19 3.0888 26 3.0453 27 2.6698 31 2.9296 18 2.8536 19 2.7401 26 2.8717 27 2.609 32 19 O 3.264 10 3.114 18 3.2 20 3.0298 27 2.9377 17 2.8536 18 3.1743 24 2.8892 26 2.7478 27 2.7024 32 2.5904 33 20 O 3.264 11 2.9317 16 3.2 19 3.0701 21 2.8164 17 2.9779 22 3.2081 23 3.0438 24 3.0965 25 2.7064 28 2.7571 33 2.6118 34 21 O 3.264 11 3.0223 15 2.9186 16 3.0701 20 3.089 35 3.0472 15 2.7847 22 2.9936 25 3.12 28 3.2302 29 2.6705 34 2.6441 35 22 O 3.264 8 3.0478 15 2.7373 23 3.0695 29 2.5095 34 2.5871 35 2.9625 15 2.9779 20 2.7847 21 23 O 3.264 8 2.6118 15 2.7373 22 3.0225 28 2.6216 29 2.8243 34 3.0667 35 3.2081 20 2.7568 35 24 O 3.264 8 2.8461 17 3.1024 27 2.6714 29 2.6511 30 3.2626 33 2.7332 16 3.1743 19 3.0438 20 25 O 3.264 8 2.726 17 3.0533 26 2.583 30 2.621 31 2.9337 34 2.8468 16 3.0965 20 2.9936 21 26 O 3.264 9 3.17 17 3.0888 18 3.0533 25 3.0934 30 2.6643 32 3.1772 16 2.7401 18 2.8892 19 2.5318 31 27 O 3.264 9 3.1639 17 3.0453 18 3.0298 19 3.1024 24 3.1777 31 2.5204 32 2.657 33 2.8717 18 2.7478 19 28 O 3.264 9 3.1171 15 3.0225 23 3.097 29 2.4749 33 2.7183 34 3.2054 16 2.7064 20 3.12 21 2.9883 35 29 O 3.264 10 2.7417 15 3.0695 22 2.6216 23 2.6714 24 3.097 28 2.6171 30 3.2121 33 2.5971 16 3.2302 21 2.6312 35 30 O 3.264 9 2.6502 17 2.6511 24 2.583 25 3.0934 26 2.6171 29 2.611 31 3.1528 32 3.2171 33 2.6807 16 31 O 3.264 9 2.6852 17 2.6698 18 2.621 25 3.1777 27 2.611 30 3.1772 32 2.5318 26 3.2205 31 2.6172 32 32 O 3.264 8 2.6643 26 2.5204 27 3.1528 30 3.1772 31 2.5832 33 2.609 18 2.7024 19 2.6172 31 33 O 3.264 9 3.2626 24 2.657 27 2.4749 28 3.2121 29 3.2171 30 2.5832 32 2.5953 34 2.5904 19 2.7571 20 34 O 3.264 8 2.5095 22 2.8243 23 2.9337 25 2.7183 28 2.5953 33 2.6103 35 2.6118 20 2.6705 21 35 O 3.264 9 3.089 21 2.5871 22 3.0667 23 2.6103 34 2.6558 15 2.6441 21 2.7568 23 2.9883 28 2.6312 29 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 0 0 1 3.254 6.508 0.032 617.82 2 7.8 12.1 2 0 0 2 6.518 13.036 0.063 152.24 2 3.2 0.5 3 0 -1 1 6.829 13.658 0.066 138.49 2 1.3 0.1 4 0 1 0 7.47 14.94 0.073 115.38 2 51.4 99.0 5 0 -1 2 7.672 15.343 0.075 109.27 2 6.6 1.6 6 1 0 0 7.831 15.663 0.076 104.77 2 68.0 157.1 7 1 0 1 8.167 16.333 0.079 96.17 2 13.6 5.8 8 -1 0 1 8.799 17.597 0.086 82.54 2 6.5 1.1 9 0 1 1 9.298 18.596 0.09 73.68 2 19.4 9.0 10 0 -1 3 9.623 19.247 0.093 68.64 2 6.3 0.9 11 1 0 2 9.673 19.347 0.094 67.91 2 6.8 1.0 12 0 0 3 9.804 19.608 0.095 66.06 2 27.0 15.6 13 1 -1 1 9.978 19.956 0.097 63.7 2 6.1 0.8 14 1 -1 2 10.32 20.64 0.1 59.41 2 15.1 4.4 15 -1 1 0 10.687 21.375 0.104 55.25 2 6.6 0.8 16 -1 0 2 10.731 21.463 0.104 54.78 2 10.7 2.0 17 -1 -1 1 10.843 21.687 0.105 53.61 2 5.5 0.5 18 1 1 0 11.021 22.041 0.107 51.83 2 128.0 275.6 19 1 -1 3 11.626 23.252 0.113 46.36 2 31.3 14.7 20 -1 -1 2 11.636 23.273 0.113 46.28 2 1.1 0.0 21 0 1 2 11.791 23.581 0.114 45.02 2 10.7 1.7 22 1 0 3 11.93 23.86 0.116 43.92 2 0.4 0.0 23 1 1 1 12.128 24.255 0.117 42.44 2 10.3 1.5 24 0 -1 4 12.18 24.36 0.118 42.05 2 2.0 0.1 25 -1 1 1 12.276 24.552 0.119 41.37 2 51.7 35.9 26 0 0 4 13.123 26.245 0.127 35.95 2 9.7 1.1 27 -1 0 3 13.232 26.463 0.128 35.32 2 37.6 16.2 28 -1 -1 3 13.235 26.47 0.128 35.3 2 12.1 1.7 29 1 -1 4 13.635 27.269 0.132 33.15 2 14.1 2.1 30 0 -2 2 13.758 27.516 0.133 32.52 2 31.8 10.7 31 1 1 2 13.957 27.915 0.135 31.54 2 9.1 0.8 32 0 -2 1 14.041 28.081 0.136 31.15 2 56.3 32.0 33 0 -2 3 14.263 28.526 0.138 30.12 2 35.3 12.1 34 -1 1 2 14.473 28.946 0.14 29.19 2 29.3 8.1 35 1 0 4 14.616 29.232 0.141 28.59 2 12.3 1.4 36 0 1 3 14.636 29.272 0.141 28.51 2 63.6 37.4 37 0 -1 5 15.062 30.123 0.145 26.81 2 20.8 3.8 38 0 2 0 15.071 30.141 0.145 26.78 2 97.1 81.9 39 1 -2 2 15.314 30.628 0.148 25.87 2 70.7 41.9 40 -1 -1 4 15.408 30.817 0.149 25.53 2 5.7 0.3 41 0 -2 4 15.485 30.971 0.149 25.26 2 40.2 13.2 42 1 -2 3 15.597 31.193 0.15 24.87 2 93.4 70.4 43 1 -2 1 15.748 31.497 0.152 24.36 2 28.2 6.3 44 2 0 0 15.814 31.629 0.152 24.14 2 90.0 63.4 45 2 0 1 15.815 31.629 0.152 24.14 2 58.3 26.6 46 -1 0 4 16.062 32.124 0.155 23.34 2 44.6 15.0 47 1 -1 5 16.107 32.214 0.155 23.2 2 5.7 0.2 48 1 1 3 16.288 32.575 0.157 22.65 2 88.1 57.0 49 -1 -2 2 16.482 32.964 0.159 22.08 2 21.3 3.2 50 0 0 5 16.487 32.974 0.159 22.06 2 16.8 2.0 51 -2 0 1 16.504 33.009 0.159 22.01 2 118.2 99.8 52 2 0 2 16.505 33.011 0.159 22.01 2 69.8 34.8 53 -1 -2 1 16.555 33.11 0.159 21.87 2 8.9 0.6 54 1 -2 4 16.563 33.126 0.159 21.84 2 30.9 6.7 55 0 2 1 16.722 33.445 0.161 21.39 2 129.7 116.7 56 2 -1 1 16.748 33.496 0.161 21.32 2 50.3 17.5 57 2 -1 2 16.796 33.592 0.162 21.19 2 201.7 279.6 58 -1 2 0 16.85 33.699 0.162 21.04 2 9.9 0.7 59 -1 1 3 17.07 34.14 0.164 20.46 2 27.8 5.1 60 -1 -2 3 17.078 34.156 0.164 20.44 2 25.0 4.2 61 0 -2 5 17.288 34.576 0.166 19.9 2 78.7 40.0 62 1 2 0 17.289 34.578 0.166 19.9 2 152.6 150.3 63 -2 1 0 17.359 34.718 0.167 19.72 2 7.1 0.3 64 2 -1 3 17.498 34.996 0.168 19.38 2 194.6 237.9 65 1 0 5 17.563 35.127 0.169 19.22 2 23.6 3.5 66 0 1 4 17.694 35.389 0.17 18.91 2 325.5 649.7 67 2 1 0 17.787 35.574 0.171 18.7 2 256.2 397.9 68 -2 0 2 17.814 35.628 0.171 18.64 2 7.5 0.3 69 2 0 3 17.815 35.631 0.171 18.63 2 96.6 56.4 70 -2 -1 1 17.832 35.664 0.171 18.6 2 30.7 5.7 71 -1 -1 5 17.973 35.946 0.172 18.28 2 37.9 8.5 72 1 -2 5 18.116 36.232 0.174 17.96 2 26.5 4.1 73 0 -1 6 18.145 36.289 0.174 17.9 2 53.3 16.5 74 -1 -2 4 18.286 36.571 0.175 17.6 2 40.8 9.5 75 2 1 1 18.368 36.737 0.176 17.43 2 91.3 47.1 76 -2 -1 2 18.499 36.999 0.177 17.15 2 29.1 4.7 77 -1 2 1 18.513 37.026 0.177 17.13 2 1.7 0.0 78 -2 1 1 18.572 37.144 0.178 17.01 2 26.7 3.9 79 1 2 1 18.616 37.231 0.178 16.92 2 101.2 56.2 80 2 -1 4 18.791 37.581 0.18 16.57 2 59.2 18.8 81 0 2 2 18.853 37.706 0.181 16.45 2 53.5 15.2 82 1 -1 6 18.89 37.78 0.181 16.38 2 61.0 19.8 83 1 1 4 18.962 37.923 0.182 16.25 2 53.5 15.1 84 -1 0 5 19.108 38.215 0.183 15.97 2 11.6 0.7 85 2 1 2 19.528 39.056 0.187 15.22 2 55.1 15.0 86 0 -2 6 19.533 39.065 0.187 15.21 2 399.8 788.6 87 -2 0 3 19.635 39.271 0.188 15.04 2 35.8 6.2 88 2 0 4 19.637 39.274 0.188 15.04 2 6.6 0.2 89 -2 -1 3 19.735 39.47 0.189 14.87 2 72.2 25.1 90 0 0 6 19.911 39.821 0.19 14.58 2 9.4 0.4 91 -1 1 4 19.94 39.88 0.191 14.53 2 238.1 267.1 92 -1 -2 5 20.009 40.018 0.191 14.42 2 53.7 13.5 93 1 -2 6 20.139 40.279 0.192 14.21 2 58.1 15.5 94 2 -2 2 20.276 40.551 0.194 14.0 2 239.1 259.7 95 -2 1 2 20.295 40.59 0.194 13.97 2 7.8 0.3 96 2 -2 3 20.357 40.713 0.194 13.88 2 40.6 7.4 97 1 2 2 20.437 40.873 0.195 13.76 2 39.5 7.0 98 2 -1 5 20.579 41.157 0.196 13.55 2 34.7 5.3 99 -1 2 2 20.623 41.246 0.197 13.48 2 37.3 6.1 100 1 0 6 20.695 41.39 0.198 13.38 2 31.9 4.4 101 2 -2 1 20.757 41.515 0.198 13.29 2 31.8 4.4 102 -1 -1 6 20.815 41.631 0.199 13.2 2 54.9 12.9 103 0 -3 3 20.9 41.799 0.199 13.09 2 101.6 43.8 104 0 1 5 20.908 41.816 0.199 13.07 2 43.9 8.2 105 2 -2 4 20.996 41.991 0.2 12.95 2 11.3 0.5 106 0 -3 2 21.057 42.115 0.201 12.87 2 194.2 157.4 107 2 1 3 21.186 42.372 0.202 12.69 2 33.0 4.5 108 0 -3 4 21.292 42.584 0.203 12.55 2 3.7 0.1 109 0 2 3 21.346 42.692 0.203 12.48 2 40.2 6.5 110 0 -1 7 21.378 42.757 0.204 12.44 2 29.7 3.6 111 -2 -1 4 21.457 42.913 0.204 12.34 2 174.4 121.6 112 0 -3 1 21.756 43.511 0.207 11.96 2 74.4 21.5 113 -2 2 0 21.771 43.543 0.207 11.94 2 17.8 1.2 114 1 -3 3 21.788 43.576 0.207 11.92 2 30.4 3.6 115 -2 0 4 21.864 43.728 0.208 11.83 2 125.8 60.7 116 2 0 5 21.866 43.733 0.208 11.82 2 1.4 0.0 117 1 1 5 21.886 43.772 0.208 11.8 2 9.6 0.4 118 1 -1 7 21.899 43.797 0.208 11.78 2 25.9 2.6 119 -2 -2 1 22.026 44.052 0.21 11.63 2 54.1 11.0 120 1 -3 4 22.036 44.071 0.21 11.62 2 2.7 0.0 121 1 -3 2 22.073 44.146 0.21 11.58 2 98.2 36.2 122 -2 -2 2 22.102 44.203 0.21 11.54 2 45.6 7.8 123 0 -2 7 22.113 44.226 0.21 11.53 2 46.7 8.2 124 -1 -2 6 22.151 44.301 0.211 11.48 2 101.7 38.5 125 2 -2 5 22.153 44.305 0.211 11.48 2 17.1 1.1 126 0 -3 5 22.212 44.423 0.211 11.41 2 37.3 5.2 127 -1 0 6 22.317 44.635 0.212 11.29 2 10.6 0.4 128 -2 1 3 22.433 44.865 0.213 11.16 2 6.8 0.2 129 2 2 0 22.478 44.956 0.214 11.11 2 76.1 20.8 130 1 -2 7 22.533 45.065 0.214 11.05 2 20.7 1.5 131 1 2 3 22.657 45.313 0.215 10.91 2 9.0 0.3 132 -2 -2 3 22.7 45.4 0.216 10.87 2 62.4 13.7 133 2 -1 6 22.769 45.538 0.216 10.79 2 79.0 21.8 134 1 -3 5 22.802 45.605 0.217 10.76 2 28.0 2.7 135 1 -3 1 22.876 45.751 0.217 10.68 2 7.2 0.2 136 0 3 0 22.955 45.91 0.218 10.6 2 69.9 16.8 137 -1 1 5 23.018 46.036 0.219 10.53 2 32.8 3.7 138 -1 2 3 23.085 46.17 0.219 10.46 2 16.2 0.9 139 -1 -3 3 23.096 46.192 0.219 10.45 2 110.6 41.4 140 -1 -3 2 23.114 46.229 0.219 10.43 2 20.2 1.4 141 2 1 4 23.258 46.516 0.221 10.29 2 20.9 1.5 142 -2 2 1 23.262 46.524 0.221 10.28 2 11.3 0.4 143 0 0 7 23.41 46.821 0.222 10.14 2 43.5 6.2 144 2 2 1 23.433 46.865 0.222 10.11 2 33.5 3.7 145 -2 -1 5 23.581 47.162 0.224 9.97 2 18.9 1.2 146 -1 -3 4 23.585 47.17 0.224 9.97 2 5.2 0.1 147 0 -3 6 23.609 47.218 0.224 9.94 2 118.9 45.6 148 -1 -3 1 23.639 47.279 0.224 9.91 2 32.1 3.3 149 2 -2 6 23.768 47.536 0.225 9.79 2 49.7 7.9 150 -2 -2 4 23.791 47.581 0.225 9.77 2 73.2 17.0 151 -1 -1 7 23.873 47.745 0.226 9.7 2 26.4 2.2 152 1 0 7 23.979 47.958 0.227 9.6 2 3.4 0.0 153 3 0 1 24.005 48.009 0.227 9.58 2 5.8 0.1 154 1 -3 6 24.049 48.099 0.228 9.53 2 57.4 10.2 155 0 2 4 24.122 48.243 0.228 9.47 2 277.0 235.7 156 3 0 0 24.128 48.256 0.229 9.46 2 39.6 4.8 157 -1 3 0 24.155 48.31 0.229 9.44 2 13.4 0.6 158 0 1 6 24.257 48.513 0.23 9.35 2 43.1 5.6 159 3 0 2 24.375 48.751 0.231 9.25 2 86.6 22.5 160 -2 0 5 24.419 48.837 0.231 9.21 2 25.8 2.0 161 2 0 6 24.421 48.842 0.231 9.21 2 227.2 154.1 162 3 -1 2 24.505 49.01 0.232 9.14 2 307.6 280.3 163 -1 -3 5 24.559 49.117 0.232 9.09 2 21.3 1.3 164 3 -1 1 24.592 49.184 0.233 9.06 2 5.2 0.1 165 0 3 1 24.599 49.198 0.233 9.06 2 28.3 2.4 166 -1 -2 7 24.63 49.26 0.233 9.03 2 53.4 8.3 167 1 3 0 24.646 49.293 0.233 9.02 2 4.2 0.1 168 -3 0 1 24.741 49.481 0.234 8.94 2 109.4 34.7 169 0 -1 8 24.746 49.492 0.234 8.94 2 4.4 0.1 170 2 2 2 24.846 49.692 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37.306 74.612 0.339 3.66 2 26.6 0.8 513 -3 3 2 37.345 74.689 0.339 3.66 2 330.1 129.2 514 4 1 4 37.346 74.692 0.339 3.66 2 14.3 0.2 515 3 3 2 37.347 74.694 0.339 3.66 2 38.5 1.8 516 3 -4 6 37.348 74.696 0.339 3.66 2 30.4 1.1 517 -2 1 8 37.395 74.789 0.339 3.65 2 144.9 24.8 518 0 2 8 37.436 74.872 0.34 3.64 2 55.7 3.7 519 1 -5 3 37.473 74.946 0.34 3.63 2 27.4 0.9 520 -4 -2 1 37.522 75.045 0.34 3.63 2 49.4 2.9 521 0 -5 7 37.523 75.046 0.34 3.63 2 71.9 6.1 522 0 4 3 37.537 75.073 0.341 3.62 2 26.6 0.8 523 -4 -1 4 37.562 75.124 0.341 3.62 2 14.0 0.2 524 1 -5 7 37.637 75.274 0.341 3.61 2 19.9 0.5 525 4 2 0 37.659 75.318 0.342 3.6 2 45.0 2.4 526 -4 0 4 37.724 75.447 0.342 3.59 2 5.3 0.0 527 4 0 6 37.727 75.454 0.342 3.59 2 23.9 0.7 528 -4 -2 2 37.767 75.535 0.342 3.58 2 4.7 0.0 529 0 -5 2 37.796 75.591 0.343 3.58 2 63.1 4.6 530 0 3 6 37.807 75.615 0.343 3.58 2 14.7 0.3 531 -4 1 3 37.816 75.632 0.343 3.57 2 8.0 0.1 532 2 -3 11 37.873 75.746 0.343 3.57 2 6.0 0.0 533 2 4 1 37.893 75.785 0.343 3.56 2 48.6 2.7 534 1 2 8 37.901 75.801 0.343 3.56 2 21.5 0.5 535 2 -1 11 37.916 75.831 0.344 3.56 2 3.3 0.0 536 -4 2 1 37.921 75.841 0.344 3.56 2 21.3 0.5 537 -1 -1 11 37.953 75.907 0.344 3.55 2 41.3 2.0 538 2 1 9 38.006 76.013 0.344 3.54 2 22.7 0.6 539 3 -4 2 38.055 76.111 0.345 3.53 2 1.3 0.0 540 4 -1 7 38.091 76.182 0.345 3.53 2 2.8 0.0 541 -2 -2 10 38.108 76.215 0.345 3.53 2 177.9 36.2 542 3 -4 7 38.125 76.249 0.345 3.52 2 27.0 0.8 543 4 2 1 38.176 76.352 0.346 3.52 2 46.5 2.5 544 3 -2 10 38.202 76.405 0.346 3.51 2 41.6 2.0 545 -1 -3 11 38.291 76.583 0.346 3.5 2 23.3 0.6 546 -3 -1 8 38.303 76.605 0.346 3.49 2 40.9 1.9 547 3 0 9 38.328 76.655 0.347 3.49 2 36.4 1.5 548 -1 -5 4 38.339 76.678 0.347 3.49 2 87.6 8.7 549 1 -2 12 38.353 76.706 0.347 3.49 2 13.6 0.2 550 4 -2 7 38.357 76.715 0.347 3.49 2 21.4 0.5 551 -1 -5 5 38.38 76.76 0.347 3.48 2 65.0 4.8 552 1 -5 2 38.384 76.768 0.347 3.48 2 57.1 3.7 553 -4 -2 3 38.392 76.783 0.347 3.48 2 12.3 0.2 554 2 -4 10 38.453 76.907 0.348 3.47 2 27.1 0.8 555 2 3 5 38.47 76.941 0.348 3.47 2 19.6 0.4 556 -2 -1 10 38.518 77.037 0.348 3.46 2 15.2 0.3 557 1 3 6 38.523 77.046 0.348 3.46 2 39.7 1.8 558 0 -2 12 38.523 77.047 0.348 3.46 2 10.2 0.1 559 1 4 3 38.601 77.202 0.349 3.45 2 11.3 0.1 560 0 -5 8 38.61 77.219 0.349 3.45 2 115.9 15.0 561 1 -5 8 38.628 77.256 0.349 3.44 2 142.9 22.8 562 0 0 11 38.635 77.269 0.349 3.44 2 8.1 0.1 563 -3 -2 8 38.659 77.319 0.349 3.44 2 78.2 6.8 564 4 -3 4 38.661 77.323 0.349 3.44 2 123.8 17.1 565 -1 4 3 38.663 77.326 0.349 3.44 2 76.9 6.6 566 -1 -5 3 38.678 77.355 0.349 3.44 2 129.8 18.8 567 1 0 11 38.685 77.371 0.349 3.44 2 72.1 5.8 568 4 -3 3 38.769 77.538 0.35 3.42 2 29.7 1.0 569 -1 -4 10 38.776 77.551 0.35 3.42 2 49.7 2.7 570 -1 -5 6 38.799 77.598 0.35 3.42 2 71.5 5.7 571 -3 2 5 38.808 77.615 0.35 3.42 2 25.0 0.7 572 1 -4 11 38.853 77.706 0.351 3.41 2 23.9 0.6 573 -2 -4 8 38.866 77.733 0.351 3.41 2 58.0 3.7 574 3 -1 10 38.928 77.857 0.351 3.4 2 33.5 1.2 575 4 -3 5 38.932 77.864 0.351 3.4 2 129.2 18.4 576 -3 -3 7 38.933 77.866 0.351 3.4 2 32.7 1.2 577 0 -5 1 38.988 77.975 0.352 3.39 2 14.9 0.2 578 4 1 5 39.029 78.058 0.352 3.39 2 2.3 0.0 579 1 -3 12 39.036 78.072 0.352 3.38 2 121.7 16.3 580 0 -4 11 39.055 78.109 0.352 3.38 2 38.5 1.6 581 4 2 2 39.069 78.137 0.352 3.38 2 22.5 0.6 582 3 3 3 39.07 78.141 0.352 3.38 2 100.9 11.2 583 -1 2 8 39.162 78.323 0.353 3.37 2 188.4 38.8 584 0 1 10 39.167 78.333 0.353 3.37 2 34.2 1.3 585 3 -4 1 39.177 78.355 0.353 3.36 2 25.5 0.7 586 3 2 6 39.229 78.458 0.354 3.36 2 57.2 3.6 587 4 -3 2 39.254 78.508 0.354 3.35 2 1.9 0.0 588 0 -3 12 39.268 78.537 0.354 3.35 2 49.9 2.7 589 3 -4 8 39.273 78.546 0.354 3.35 2 134.6 19.7 590 -1 3 6 39.277 78.554 0.354 3.35 2 10.3 0.1 591 2 -5 5 39.285 78.569 0.354 3.35 2 60.4 4.0 592 -4 -1 5 39.295 78.59 0.354 3.35 2 49.9 2.7 593 -2 2 7 39.332 78.664 0.354 3.34 2 0.1 0.0 594 1 1 10 39.374 78.748 0.355 3.34 2 129.5 18.2 595 3 1 8 39.386 78.773 0.355 3.34 2 36.6 1.4 596 -4 -2 4 39.39 78.779 0.355 3.33 2 343.3 127.5 597 -1 -5 2 39.392 78.784 0.355 3.33 2 308.3 102.8 598 2 -5 6 39.419 78.839 0.355 3.33 2 11.1 0.1 599 -2 4 2 39.423 78.845 0.355 3.33 2 26.0 0.7 600 3 -3 10 39.461 78.921 0.355 3.33 2 22.3 0.5 601 2 -5 4 39.526 79.053 0.356 3.32 2 144.7 22.5 602 -4 2 2 39.568 79.136 0.356 3.31 2 76.4 6.3 603 4 -3 6 39.578 79.156 0.356 3.31 2 20.8 0.5 604 -1 -5 7 39.593 79.186 0.356 3.31 2 34.5 1.3 605 -2 3 5 39.6 79.199 0.356 3.31 2 3.2 0.0 606 -3 3 3 39.632 79.264 0.357 3.3 2 42.5 1.9 607 1 -1 12 39.652 79.303 0.357 3.3 2 61.1 4.0 608 1 -5 1 39.664 79.329 0.357 3.3 2 62.5 4.2 609 2 4 2 39.675 79.35 0.357 3.3 2 57.5 3.5 610 -2 -3 10 39.68 79.361 0.357 3.3 2 79.0 6.7 611 0 -1 12 39.758 79.516 0.358 3.29 2 10.5 0.1 612 -4 0 5 39.803 79.607 0.358 3.28 2 92.5 9.1 613 4 0 7 39.807 79.614 0.358 3.28 2 48.2 2.5 614 -4 1 4 39.867 79.735 0.358 3.27 2 17.5 0.3 615 -3 0 8 39.926 79.853 0.359 3.26 2 147.8 23.1 616 2 -5 7 39.929 79.859 0.359 3.26 2 24.9 0.7 617 1 -5 9 39.987 79.973 0.359 3.26 2 91.9 8.9 618 0 -5 9 40.062 80.124 0.36 3.25 2 61.9 4.0 619 -3 1 7 40.066 80.132 0.36 3.25 2 57.6 3.5 620 4 -2 8 40.107 80.215 0.36 3.24 2 149.7 23.6 621 4 -3 1 40.112 80.225 0.36 3.24 2 13.5 0.2 622 2 -5 3 40.143 80.286 0.36 3.24 2 84.8 7.5 623 4 -1 8 40.192 80.385 0.361 3.23 2 42.5 1.9 624 0 4 4 40.262 80.525 0.361 3.22 2 22.5 0.5 625 4 2 3 40.33 80.66 0.362 3.21 2 107.4 12.0 626 2 -2 12 40.354 80.708 0.362 3.21 2 241.3 60.6 627 -1 -5 1 40.477 80.954 0.363 3.2 2 4.4 0.0 628 -3 -4 3 40.519 81.037 0.363 3.19 2 9.6 0.1 629 2 2 8 40.532 81.064 0.363 3.19 2 22.5 0.5 630 0 5 0 40.543 81.086 0.363 3.19 2 12.8 0.2 631 4 -3 7 40.595 81.19 0.364 3.18 2 30.4 1.0 632 -3 4 0 40.664 81.328 0.364 3.18 2 24.1 0.6 633 -3 -4 2 40.692 81.385 0.364 3.17 2 20.5 0.4 634 -3 -4 4 40.718 81.437 0.365 3.17 2 14.2 0.2 635 -1 0 11 40.749 81.499 0.365 3.17 2 135.0 18.7 636 -4 -2 5 40.755 81.509 0.365 3.17 2 87.4 7.8 637 -1 -5 8 40.756 81.513 0.365 3.16 2 42.8 1.9 638 3 -4 9 40.786 81.572 0.365 3.16 2 47.3 2.3 639 2 -5 8 40.811 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12 41.966 83.932 0.374 3.04 2 131.0 16.9 683 4 -3 8 41.978 83.957 0.374 3.04 2 2.9 0.0 684 -1 -1 12 42.014 84.027 0.374 3.04 2 17.2 0.3 685 2 -5 9 42.06 84.121 0.374 3.03 2 16.4 0.3 686 3 -3 11 42.061 84.122 0.374 3.03 2 38.1 1.4 687 3 2 7 42.072 84.143 0.375 3.03 2 157.9 24.5 688 3 4 0 42.155 84.309 0.375 3.02 2 101.0 10.0 689 4 -2 9 42.21 84.42 0.376 3.02 2 107.6 11.3 690 3 -1 11 42.226 84.453 0.376 3.02 2 4.4 0.0 691 -4 0 6 42.227 84.453 0.376 3.02 2 16.4 0.3 692 4 0 8 42.231 84.462 0.376 3.02 2 35.1 1.2 693 -3 -4 6 42.233 84.465 0.376 3.02 2 45.1 2.0 694 -4 -3 2 42.242 84.485 0.376 3.02 2 10.2 0.1 695 1 -2 13 42.245 84.49 0.376 3.02 2 72.4 5.1 696 -3 3 4 42.256 84.513 0.376 3.02 2 19.8 0.4 697 -2 -5 4 42.263 84.526 0.376 3.01 2 4.6 0.0 698 -4 1 5 42.263 84.527 0.376 3.01 2 35.0 1.2 699 -1 -5 9 42.284 84.568 0.376 3.01 2 70.8 4.9 700 -2 -1 11 42.287 84.575 0.376 3.01 2 114.3 12.8 701 -4 -3 1 42.349 84.697 0.377 3.01 2 45.7 2.0 702 -2 -5 5 42.395 84.791 0.377 3.0 2 21.2 0.4 703 0 5 1 42.456 84.912 0.377 3.0 2 21.7 0.5 704 -4 -2 6 42.48 84.961 0.378 3.0 2 56.5 3.1 705 2 -5 1 42.483 84.966 0.378 3.0 2 7.1 0.0 706 -2 -5 3 42.502 85.003 0.378 2.99 2 54.3 2.9 707 0 -2 13 42.504 85.009 0.378 2.99 2 54.5 2.9 708 -4 -3 3 42.507 85.014 0.378 2.99 2 45.7 2.0 709 -3 4 1 42.51 85.02 0.378 2.99 2 18.8 0.3 710 1 -3 13 42.57 85.14 0.378 2.99 2 104.9 10.7 711 3 1 9 42.624 85.247 0.379 2.98 2 86.0 7.2 712 4 -1 9 42.639 85.277 0.379 2.98 2 55.4 3.0 713 3 -4 10 42.658 85.316 0.379 2.98 2 28.3 0.8 714 5 0 1 42.668 85.336 0.379 2.98 2 13.6 0.2 715 5 -1 2 42.736 85.471 0.379 2.97 2 22.2 0.5 716 -2 -3 11 42.741 85.482 0.379 2.97 2 68.6 4.5 717 5 0 2 42.761 85.522 0.38 2.97 2 42.5 1.7 718 4 3 0 42.825 85.651 0.38 2.97 2 121.1 14.1 719 -1 3 7 42.833 85.666 0.38 2.97 2 14.7 0.2 720 5 -1 3 42.855 85.71 0.38 2.97 2 23.4 0.5 721 -2 3 6 42.873 85.746 0.38 2.96 2 9.6 0.1 722 1 0 12 42.888 85.775 0.38 2.96 2 23.1 0.5 723 0 -3 13 42.891 85.782 0.38 2.96 2 12.4 0.1 724 -2 -5 6 42.898 85.796 0.381 2.96 2 89.9 7.8 725 -4 3 1 42.929 85.857 0.381 2.96 2 33.4 1.1 726 0 0 12 42.93 85.861 0.381 2.96 2 21.7 0.5 727 5 0 0 42.945 85.891 0.381 2.96 2 17.0 0.3 728 5 -1 1 42.986 85.973 0.381 2.96 2 47.8 2.2 729 -2 2 8 43.006 86.013 0.381 2.95 2 28.5 0.8 730 -2 -5 2 43.11 86.22 0.382 2.95 2 140.9 19.0 731 -1 2 9 43.116 86.233 0.382 2.95 2 2.0 0.0 732 -4 -3 4 43.141 86.283 0.382 2.94 2 107.6 11.1 733 -2 -4 10 43.183 86.367 0.383 2.94 2 50.1 2.4 734 5 0 3 43.224 86.448 0.383 2.94 2 22.1 0.5 735 -1 5 1 43.307 86.613 0.383 2.93 2 40.3 1.5 736 0 4 5 43.315 86.631 0.383 2.93 2 18.9 0.3 737 5 -1 4 43.344 86.689 0.384 2.93 2 11.4 0.1 738 -3 0 9 43.366 86.733 0.384 2.93 2 50.2 2.4 739 -3 -3 9 43.381 86.761 0.384 2.93 2 9.8 0.1 740 0 1 11 43.425 86.85 0.384 2.92 2 58.8 3.3 741 3 4 1 43.438 86.875 0.384 2.92 2 44.0 1.8 742 4 1 7 43.449 86.898 0.384 2.92 2 19.0 0.3 743 -3 1 8 43.478 86.956 0.385 2.92 2 242.9 55.8 744 2 -4 12 43.52 87.04 0.385 2.92 2 91.8 8.0 745 1 1 11 43.536 87.073 0.385 2.91 2 97.3 8.9 746 -3 -4 7 43.541 87.083 0.385 2.91 2 107.2 10.9 747 3 3 5 43.569 87.138 0.385 2.91 2 17.2 0.3 748 -5 0 1 43.592 87.184 0.385 2.91 2 16.9 0.3 749 -5 1 0 43.607 87.214 0.386 2.91 2 3.3 0.0 750 4 3 1 43.671 87.342 0.386 2.91 2 19.3 0.4 751 2 -5 10 43.674 87.347 0.386 2.91 2 35.7 1.2 752 4 -3 9 43.724 87.449 0.386 2.9 2 44.4 1.9 753 1 5 1 43.739 87.478 0.386 2.9 2 44.8 1.9 754 -2 -5 7 43.77 87.539 0.387 2.9 2 1.5 0.0 755 1 -5 11 43.783 87.565 0.387 2.9 2 16.9 0.3 756 4 -4 5 43.795 87.589 0.387 2.9 2 76.8 5.5 757 -4 -1 7 43.814 87.629 0.387 2.9 2 72.2 4.9 758 1 -1 13 43.862 87.724 0.387 2.89 2 38.1 1.4 759 3 -5 5 43.872 87.744 0.387 2.89 2 100.6 9.5 760 4 -4 4 43.874 87.747 0.387 2.89 2 0.7 0.0 761 3 -5 6 43.912 87.824 0.388 2.89 2 27.9 0.7 762 -4 2 4 43.924 87.849 0.388 2.89 2 5.1 0.0 763 4 2 5 43.937 87.875 0.388 2.89 2 53.7 2.7 764 0 -5 11 44.042 88.083 0.389 2.88 2 34.5 1.1 765 5 0 4 44.056 88.112 0.389 2.88 2 7.7 0.1 766 0 -1 13 44.059 88.117 0.389 2.88 2 20.1 0.4 767 4 -4 6 44.085 88.171 0.389 2.88 2 30.6 0.9 768 -2 -5 1 44.087 88.174 0.389 2.88 2 43.9 1.8 769 2 -2 13 44.119 88.237 0.389 2.88 2 150.5 21.1 770 -4 -3 5 44.144 88.288 0.389 2.88 2 1.5 0.0 771 1 4 5 44.165 88.331 0.389 2.87 2 25.1 0.6 772 -1 -5 10 44.173 88.347 0.39 2.87 2 20.9 0.4 773 2 2 9 44.189 88.378 0.39 2.87 2 38.9 1.4 774 -2 5 0 44.2 88.4 0.39 2.87 2 1.3 0.0 775 3 -5 4 44.202 88.403 0.39 2.87 2 242.4 54.7 776 5 -1 5 44.202 88.405 0.39 2.87 2 21.0 0.4 777 5 1 0 44.223 88.447 0.39 2.87 2 54.5 2.8 778 5 1 1 44.29 88.579 0.39 2.87 2 61.5 3.5 779 2 4 4 44.294 88.589 0.39 2.87 2 55.0 2.8 780 3 -5 7 44.321 88.642 0.391 2.86 2 67.3 4.2 781 4 -4 3 44.322 88.644 0.391 2.86 2 20.7 0.4 782 2 -3 13 44.381 88.762 0.391 2.86 2 65.6 4.0 783 -1 -4 12 44.388 88.777 0.391 2.86 2 69.8 4.5 784 5 -2 3 44.426 88.851 0.391 2.86 2 12.7 0.1 785 3 -2 12 44.463 88.927 0.392 2.86 2 101.4 9.5 786 -5 -1 1 44.526 89.053 0.392 2.85 2 56.4 2.9 787 -3 -2 10 44.538 89.076 0.392 2.85 2 43.7 1.8 788 -4 -2 7 44.567 89.133 0.392 2.85 2 20.0 0.4 789 5 -2 4 44.571 89.142 0.392 2.85 2 62.0 3.6 790 -1 4 5 44.595 89.19 0.392 2.85 2 3.0 0.0 791 -5 1 1 44.596 89.191 0.392 2.85 2 9.4 0.1 792 -5 0 2 44.607 89.215 0.393 2.85 2 5.0 0.0 793 2 3 7 44.645 89.289 0.393 2.85 2 41.3 1.6 794 5 -2 2 44.649 89.299 0.393 2.85 2 5.2 0.0 795 4 -2 10 44.667 89.335 0.393 2.85 2 58.9 3.2 796 -3 4 2 44.715 89.429 0.393 2.84 2 56.9 3.0 797 5 1 2 44.725 89.45 0.393 2.84 2 41.0 1.6 798 0 5 2 44.727 89.455 0.393 2.84 2 30.6 0.9 799 4 -4 7 44.745 89.49 0.394 2.84 2 7.7 0.1 800 -2 4 4 44.784 89.568 0.394 2.84 2 6.1 0.0 801 1 -4 13 44.834 89.667 0.394 2.84 2 25.0 0.6 802 -3 -1 10 44.876 89.753 0.394 2.83 2 48.3 2.1 803 -4 3 2 44.882 89.763 0.394 2.83 2 63.6 3.7 804 4 3 2 44.885 89.77 0.394 2.83 2 14.8 0.2 805 3 -4 11 44.889 89.778 0.395 2.83 2 9.0 0.1 806 -1 -2 13 44.893 89.787 0.395 2.83 2 9.2 0.1 807 3 -5 3 44.9 89.801 0.395 2.83 2 38.5 1.4 808 -2 0 11 44.971 89.941 0.395 2.83 2 68.3 4.3 809 2 0 12 44.974 89.949 0.395 2.83 2 21.2 0.4 810 -4 0 7 44.999 89.999 0.395 2.83 2 12.0 0.1 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 0 0 1 3.254 6.508 15.75885 12.1 1.5 1.5 5.5 2 0 1 0 7.47 14.94 6.88026 99.0 12.3 12.6 5.6 3 1 0 0 7.831 15.663 6.56437 157.1 19.5 19.9 5.6 4 0 1 1 9.298 18.596 5.53597 9.0 1.1 1.1 5.6 5 0 0 3 9.804 19.608 5.25295 15.6 1.9 2.0 5.6 6 1 1 0 11.021 22.041 4.67906 275.6 34.3 34.8 5.6 7 1 -1 3 11.626 23.252 4.43861 14.8 1.8 1.9 5.6 8 -1 1 1 12.276 24.552 4.20689 35.9 4.5 4.5 5.6 9 -1 0 3 13.232 26.463 3.90786 17.9 2.2 2.2 5.6 10 0 -2 2 13.758 27.516 3.76108 10.7 1.3 1.3 5.6 11 0 -2 1 14.041 28.081 3.68682 32.0 4.0 4.0 5.6 12 0 -2 3 14.263 28.526 3.63049 12.1 1.5 1.5 5.6 13 -1 1 2 14.473 28.946 3.57888 8.1 1.0 1.0 5.6 14 0 1 3 14.636 29.272 3.53997 38.8 4.8 4.9 5.6 15 0 2 0 15.071 30.141 3.44013 85.6 10.7 10.7 5.6 16 1 -2 2 15.314 30.628 3.38666 41.9 5.2 5.3 5.6 17 0 -2 4 15.485 30.971 3.35012 13.2 1.6 1.7 5.6 18 1 -2 3 15.597 31.193 3.3268 70.4 8.8 8.8 5.6 19 2 0 0 15.814 31.629 3.28219 90.0 11.2 11.3 5.6 20 -1 0 4 16.062 32.124 3.23287 15.0 1.9 1.9 5.6 21 1 1 3 16.288 32.575 3.18925 57.0 7.1 7.1 5.6 22 2 0 2 16.505 33.011 3.14834 139.8 17.4 17.5 5.6 23 0 2 1 16.722 33.445 3.10862 134.2 16.7 16.8 5.7 24 2 -1 2 16.796 33.592 3.09541 279.6 34.8 35.0 5.7 25 -1 1 3 17.07 34.14 3.04718 9.3 1.2 1.2 5.7 26 1 2 0 17.289 34.578 3.00973 190.3 23.7 23.8 5.7 27 2 -1 3 17.498 34.996 2.97483 237.9 29.6 29.7 5.7 28 0 1 4 17.694 35.389 2.9429 649.7 80.9 81.1 5.7 29 2 1 0 17.787 35.574 2.92804 454.7 56.6 56.8 5.7 30 -1 -1 5 17.973 35.946 2.89873 8.5 1.1 1.1 5.7 31 0 -1 6 18.145 36.289 2.87222 16.5 2.1 2.1 5.7 32 -1 -2 4 18.286 36.571 2.85084 9.5 1.2 1.2 5.7 33 2 1 1 18.368 36.737 2.83842 47.1 5.9 5.9 5.7 34 1 2 1 18.616 37.231 2.80204 56.2 7.0 7.0 5.7 35 2 -1 4 18.791 37.581 2.77687 18.8 2.3 2.3 5.7 36 0 2 2 18.853 37.706 2.76799 15.2 1.9 1.9 5.7 37 1 -1 6 18.89 37.78 2.76279 19.8 2.5 2.5 5.7 38 1 1 4 18.962 37.923 2.75273 15.1 1.9 1.9 5.7 39 0 -2 6 19.533 39.065 2.67527 803.6 100.0 100.0 5.7 40 -2 -1 3 19.735 39.47 2.64892 25.1 3.1 3.1 5.7 41 -1 1 4 19.94 39.88 2.62275 267.1 33.2 33.2 5.7 42 -1 -2 5 20.009 40.018 2.6141 13.5 1.7 1.7 5.7 43 1 -2 6 20.139 40.279 2.59788 15.5 1.9 1.9 5.7 44 2 -2 2 20.276 40.551 2.58116 260.0 32.4 32.3 5.7 45 -1 -1 6 20.815 41.631 2.51707 12.9 1.6 1.6 5.7 46 0 -3 3 20.9 41.799 2.50739 52.0 6.5 6.5 5.7 47 0 -3 2 21.057 42.115 2.48944 157.4 19.6 19.5 5.7 48 -2 -1 4 21.457 42.913 2.44523 121.6 15.1 15.1 5.7 49 0 -3 1 21.756 43.511 2.41322 22.7 2.8 2.8 5.7 50 -2 0 4 21.864 43.728 2.40182 61.0 7.6 7.6 5.7 51 -2 -2 1 22.026 44.052 2.38504 11.1 1.4 1.4 5.7 52 1 -3 2 22.073 44.146 2.3802 44.0 5.5 5.4 5.7 53 0 -2 7 22.113 44.226 2.37616 8.2 1.0 1.0 5.7 54 -1 -2 6 22.151 44.301 2.37232 39.6 4.9 4.9 5.7 55 2 2 0 22.478 44.956 2.33953 20.8 2.6 2.6 5.7 56 -2 -2 3 22.7 45.4 2.3178 13.7 1.7 1.7 5.7 57 2 -1 6 22.769 45.538 2.31115 21.8 2.7 2.7 5.7 58 0 3 0 22.955 45.91 2.29342 16.8 2.1 2.1 5.7 59 -1 -3 3 23.096 46.192 2.2802 42.8 5.3 5.3 5.7 60 0 0 7 23.41 46.821 2.25126 9.9 1.2 1.2 5.7 61 0 -3 6 23.609 47.218 2.23341 46.8 5.8 5.8 5.7 62 -2 -2 4 23.791 47.581 2.21732 24.8 3.1 3.1 5.7 63 1 -3 6 24.049 48.099 2.19486 10.2 1.3 1.3 5.7 64 0 2 4 24.122 48.243 2.18869 240.5 29.9 29.6 5.7 65 3 0 2 24.375 48.751 2.16728 22.5 2.8 2.8 5.7 66 2 0 6 24.421 48.842 2.16346 156.1 19.4 19.2 5.7 67 3 -1 2 24.505 49.01 2.15649 280.3 34.9 34.5 5.7 68 -1 -2 7 24.63 49.26 2.14625 8.4 1.0 1.0 5.7 69 -3 0 1 24.741 49.481 2.13725 34.7 4.3 4.3 5.7 70 1 2 4 25.2 50.401 2.10073 130.9 16.3 16.1 5.8 71 2 -1 7 25.287 50.575 2.09398 8.4 1.0 1.0 5.8 72 -3 -1 1 25.79 51.581 2.05585 22.5 2.8 2.8 5.8 73 2 -3 2 25.877 51.753 2.04947 42.5 5.3 5.2 5.8 74 -1 -3 6 25.976 51.952 2.04216 180.6 22.5 22.2 5.8 75 1 3 1 26.094 52.188 2.03358 10.0 1.2 1.2 5.8 76 2 2 3 26.666 53.332 1.99307 8.3 1.0 1.0 5.8 77 3 -2 2 27.102 54.204 1.96336 52.7 6.6 6.4 5.8 78 2 0 7 27.246 54.492 1.95376 32.4 4.0 4.0 5.8 79 -3 0 3 27.316 54.631 1.94918 10.3 1.3 1.3 5.8 80 -2 1 5 27.664 55.329 1.9265 35.0 4.4 4.3 5.8 81 1 2 5 28.017 56.033 1.90421 18.0 2.2 2.2 5.8 82 0 -4 5 28.746 57.493 1.85985 12.0 1.5 1.5 5.8 83 -2 -1 7 28.782 57.565 1.85771 11.6 1.4 1.4 5.8 84 -1 2 5 28.824 57.648 1.85527 55.9 7.0 6.8 5.8 85 -3 -1 4 28.94 57.88 1.84846 41.2 5.1 5.0 5.8 86 0 -4 2 29.027 58.054 1.84341 35.1 4.4 4.3 5.8 87 -3 -2 1 29.148 58.297 1.8364 9.2 1.1 1.1 5.8 88 -3 0 4 29.197 58.394 1.83362 18.8 2.3 2.3 5.8 89 -2 -3 5 29.315 58.63 1.82688 16.7 2.1 2.0 5.8 90 -2 -2 7 29.521 59.043 1.81525 50.2 6.2 6.1 5.8 91 3 -2 6 29.566 59.131 1.81277 9.5 1.2 1.2 5.8 92 -2 3 1 29.622 59.245 1.80962 11.6 1.4 1.4 5.8 93 1 -4 6 29.828 59.657 1.79826 15.7 2.0 1.9 5.8 94 -3 2 1 29.885 59.771 1.79515 23.0 2.9 2.8 5.8 95 -3 -2 3 29.916 59.833 1.79345 9.3 1.2 1.1 5.8 96 -1 -2 9 30.399 60.799 1.76762 8.1 1.0 1.0 5.8 97 2 -3 8 30.446 60.891 1.7652 22.5 2.8 2.7 5.8 98 -2 -3 6 30.685 61.37 1.75275 36.9 4.6 4.5 5.8 99 -1 -4 2 30.757 61.514 1.74906 25.9 3.2 3.1 5.8 100 -3 -2 4 30.928 61.855 1.74034 25.5 3.2 3.1 5.8 101 -2 3 2 31.638 63.275 1.70522 177.9 22.1 21.5 5.9 102 0 -1 10 31.899 63.798 1.69269 164.4 20.5 19.8 5.9 103 2 -4 5 32.003 64.007 1.68776 19.0 2.4 2.3 5.9 104 1 -4 8 32.363 64.727 1.67099 26.5 3.3 3.2 5.9 105 1 3 4 32.634 65.267 1.65867 186.4 23.2 22.4 5.9 106 4 0 2 33.028 66.056 1.64106 138.4 17.2 16.6 5.9 107 4 -1 1 33.24 66.48 1.63178 12.9 1.6 1.5 5.9 108 -2 0 8 33.597 67.195 1.61643 19.4 2.4 2.3 5.9 109 4 0 3 33.632 67.263 1.61499 13.3 1.7 1.6 5.9 110 3 1 6 33.841 67.683 1.60615 70.9 8.8 8.5 5.9 111 -1 -1 10 34.14 68.28 1.59378 90.7 11.3 10.9 5.9 112 0 0 10 34.582 69.165 1.57589 57.2 7.1 6.8 5.9 113 2 -4 8 34.76 69.52 1.56885 125.2 15.6 15.0 5.9 114 -2 -2 9 34.964 69.928 1.56085 8.9 1.1 1.1 5.9 115 3 3 0 34.994 69.988 1.55969 50.5 6.3 6.0 5.9 116 4 1 2 35.077 70.153 1.55647 10.3 1.3 1.2 5.9 117 0 4 2 35.133 70.265 1.55431 18.5 2.3 2.2 5.9 118 4 -2 2 35.192 70.385 1.55201 16.4 2.0 2.0 5.9 119 3 -3 8 35.274 70.549 1.54887 66.6 8.3 7.9 5.9 120 2 3 4 35.868 71.735 1.52661 20.8 2.6 2.5 5.9 121 -2 -4 6 35.969 71.939 1.52286 60.5 7.5 7.2 5.9 122 -1 3 5 36.018 72.035 1.52111 15.2 1.9 1.8 5.9 123 -4 1 2 36.115 72.229 1.51757 20.8 2.6 2.5 5.9 124 -3 -2 7 36.214 72.428 1.51397 43.4 5.4 5.2 5.9 125 1 -5 5 36.788 73.577 1.49361 9.1 1.1 1.1 6.0 126 3 -4 4 36.937 73.873 1.48846 22.8 2.8 2.7 6.0 127 2 0 10 37.123 74.245 1.48207 11.9 1.5 1.4 6.0 128 2 2 7 37.183 74.367 1.47999 23.8 3.0 2.8 6.0 129 -2 -4 7 37.236 74.473 1.47819 25.7 3.2 3.0 6.0 130 -3 3 2 37.345 74.689 1.47453 132.3 16.5 15.7 6.0 131 -2 1 8 37.395 74.789 1.47284 24.8 3.1 2.9 6.0 132 0 -5 7 37.523 75.046 1.46854 9.8 1.2 1.2 6.0 133 -2 -2 10 38.108 76.215 1.44936 37.0 4.6 4.4 6.0 134 -1 -5 4 38.339 76.678 1.44194 9.4 1.2 1.1 6.0 135 -1 -5 5 38.38 76.76 1.44065 8.6 1.1 1.0 6.0 136 1 -5 8 38.628 77.256 1.43283 37.9 4.7 4.5 6.0 137 -1 -5 3 38.678 77.355 1.43128 55.1 6.9 6.5 6.0 138 -1 -5 6 38.799 77.598 1.42751 8.4 1.0 1.0 6.0 139 4 -3 5 38.932 77.864 1.42341 20.8 2.6 2.4 6.0 140 1 -3 12 39.036 78.072 1.42021 17.9 2.2 2.1 6.0 141 3 3 3 39.07 78.141 1.41916 11.2 1.4 1.3 6.0 142 -1 2 8 39.162 78.323 1.41638 40.7 5.1 4.8 6.0 143 2 -5 5 39.285 78.569 1.41266 29.2 3.6 3.4 6.0 144 -1 -5 2 39.392 78.784 1.40944 249.9 31.1 29.3 6.0 145 2 -5 4 39.526 79.053 1.40542 22.5 2.8 2.6 6.0 146 -2 -3 10 39.68 79.361 1.40087 20.3 2.5 2.4 6.0 147 -4 0 5 39.803 79.607 1.39726 11.6 1.4 1.4 6.0 148 -3 0 8 39.926 79.853 1.39367 23.8 3.0 2.8 6.0 149 1 -5 9 39.987 79.973 1.39192 8.9 1.1 1.0 6.0 150 4 -2 8 40.107 80.215 1.38843 23.8 3.0 2.8 6.0 151 2 -2 12 40.354 80.708 1.38139 72.6 9.0 8.5 6.1 152 -1 0 11 40.749 81.499 1.37029 28.4 3.5 3.3 6.1 153 2 -5 8 40.811 81.622 1.36858 10.3 1.3 1.2 6.1 154 2 -3 12 40.966 81.931 1.36432 10.3 1.3 1.2 6.1 155 4 1 6 41.064 82.128 1.36163 56.3 7.0 6.6 6.1 156 2 1 10 41.734 83.468 1.34369 9.5 1.2 1.1 6.1 157 0 -4 12 41.966 83.932 1.33763 23.8 3.0 2.8 6.1 158 3 2 7 42.072 84.143 1.3349 25.9 3.2 3.0 6.1 159 3 4 0 42.155 84.309 1.33276 10.0 1.2 1.2 6.1 160 4 -2 9 42.21 84.42 1.33133 14.8 1.8 1.7 6.1 161 -2 -1 11 42.287 84.575 1.32936 17.7 2.2 2.0 6.1 162 -4 -2 6 42.48 84.961 1.32446 11.3 1.4 1.3 6.1 163 1 -3 13 42.57 85.14 1.3222 10.7 1.3 1.2 6.1 164 3 1 9 42.624 85.247 1.32086 10.1 1.3 1.2 6.1 165 4 3 0 42.825 85.651 1.31584 14.8 1.8 1.7 6.1 166 -2 -5 2 43.11 86.22 1.30883 19.0 2.4 2.2 6.1 167 -4 -3 4 43.141 86.283 1.30807 11.1 1.4 1.3 6.1 168 -3 1 8 43.478 86.956 1.29994 55.8 6.9 6.4 6.1 169 -3 -4 7 43.541 87.083 1.29843 27.8 3.5 3.2 6.1 170 4 -4 5 43.795 87.589 1.29243 10.4 1.3 1.2 6.2 171 3 -5 5 43.872 87.744 1.29061 10.9 1.4 1.2 6.2 172 2 -2 13 44.119 88.237 1.28488 21.1 2.6 2.4 6.2 173 3 -5 4 44.202 88.403 1.28296 59.3 7.4 6.8 6.2 174 -1 -4 12 44.388 88.777 1.27868 8.5 1.1 1.0 6.2 175 3 -2 12 44.463 88.927 1.27698 9.5 1.2 1.1 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) |