Institute of Experimental Mineralogy
Russian Academy of Sciences
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142432, Chernogolovka, Moscow district
A.V. Chichagov +7(496)52-22320
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*** W W W - X R A Y P O L ***
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DICKITE
4, at 4.1 GPa, f-kaolinite-halloysite, sf-kaolinite
Al(2)[Si(2)O(5)](OH)(4)
Monoclinic C c Z = 4
Cc
17 .6 .1904
Ref.Str.:
P. Dera et al. (2003)
* Amer. Mineral., 88, 1428-1435
Reserv:
from Pensilvania. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.082 alpha = 90.0
b = 8.757 beta = 89.6
c = 13.77 gamma = 90.0
Unit cell volume (cub. angs.) = 612.79
Molar volume ( cub.cm/mol.) = 92.28
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.046 0.488 0.038 0.0 Si = 1.00
2 0.033 0.159 0.037 0.0 Si = 1.00
3 0.879 0.335 0.233 0.0 Al = 1.00
4 0.3864 0.5 0.234 0.0 Al = 1.00
5 0.987 0.324 0.986 0.0 O = 1.00
6 0.316 0.55 0.991 0.0 O = 1.00
7 0.827 0.606 0.996 0.0 O = 1.00
8 0.071 0.478 0.155 0.0 O = 1.00
9 0.002 0.17 0.155 0.0 O = 1.00
10 0.578 0.36 0.161 0.0 OH = 1.00
11 0.197 0.353 0.304 0.0 OH = 1.00
12 0.19 0.984 0.303 0.0 OH = 1.00
13 0.262 0.666 0.301 0.0 OH = 1.00
14 0.496 0.2556 0.142 0.0 H = 1.00
15 0.2349 0.2821 0.3511 0.0 H = 1.00
16 0.2329 0.6345 0.3701 0.0 H = 1.00
17 0.2518 0.017 0.3557 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.046 0.488 0.038
2 2 0.033 0.159 0.037
3 3 0.879 0.335 0.233
4 4 0.3864 0.5 0.234
5 5 0.987 0.324 0.986
6 6 0.316 0.55 0.991
7 7 0.827 0.606 0.996
8 8 0.071 0.478 0.155
9 9 0.002 0.17 0.155
10 10 0.578 0.36 0.161
11 11 0.197 0.353 0.304
12 12 0.19 0.984 0.303
13 13 0.262 0.666 0.301
14 14 0.496 0.2556 0.142
15 15 0.2349 0.2821 0.3511
16 16 0.2329 0.6345 0.3701
17 17 0.2518 0.017 0.3557
18 1 0.046 0.512 0.538
19 2 0.033 0.841 0.537
20 3 0.879 0.665 0.733
21 4 0.3864 0.5 0.734
22 5 0.987 0.676 0.486
23 6 0.316 0.45 0.491
24 7 0.827 0.394 0.496
25 8 0.071 0.522 0.655
26 9 0.002 0.83 0.655
27 10 0.578 0.64 0.661
28 11 0.197 0.647 0.804
29 12 0.19 0.016 0.803
30 13 0.262 0.334 0.801
31 14 0.496 0.7444 0.642
32 15 0.2349 0.7179 0.8511
33 16 0.2329 0.3655 0.8701
34 17 0.2518 0.983 0.8557
35 1 0.546 0.012 0.538
36 2 0.533 0.341 0.537
37 3 0.379 0.165 0.733
38 4 0.8864 0.0 0.734
39 5 0.487 0.176 0.486
40 6 0.816 0.95 0.491
41 7 0.327 0.894 0.496
42 8 0.571 0.022 0.655
43 9 0.502 0.33 0.655
44 10 0.078 0.14 0.661
45 11 0.697 0.147 0.804
46 12 0.69 0.516 0.803
47 13 0.762 0.834 0.801
48 14 0.996 0.2444 0.642
49 15 0.7349 0.2179 0.8511
50 16 0.7329 0.8655 0.8701
51 17 0.7518 0.483 0.8557
52 1 0.546 0.988 0.038
53 2 0.533 0.659 0.037
54 3 0.379 0.835 0.233
55 4 0.8864 0.0 0.234
56 5 0.487 0.824 0.986
57 6 0.816 0.05 0.991
58 7 0.327 0.106 0.996
59 8 0.571 0.978 0.155
60 9 0.502 0.67 0.155
61 10 0.078 0.86 0.161
62 11 0.697 0.853 0.304
63 12 0.69 0.484 0.303
64 13 0.762 0.166 0.301
65 14 0.996 0.7556 0.142
66 15 0.7349 0.7821 0.3511
67 16 0.7329 0.1345 0.3701
68 17 0.7518 0.517 0.3557
X-ray density (g/cm cub.) = 2.84
MU (1/cm) = 83.766 Mass attenuation coefficient (cm**2/g) = 29.485
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Si 2.148 4
1.6334 5
1.6075 6
1.6279 7
1.6193 8
2 Si 2.148 4
1.6242 5
1.6342 9
1.5932 6
1.6597 7
3 Al 2.364 6
1.9129 8
1.9033 9
1.8417 10
1.9012 11
1.8818 12
1.8474 13
4 Al 2.364 6
1.9529 8
1.8569 10
1.8707 11
1.8319 13
1.9328 9
1.823 12
5 O 3.312 9
2.592 6
2.6032 7
2.7259 8
2.6912 9
3.187 10
2.8984 13
3.3025 11
2.5527 6
2.5792 7
6 O 3.312 10
2.592 5
2.6442 7
2.5335 7
2.6473 8
3.1725 10
2.782 11
3.2416 13
3.2147 12
2.5527 5
2.6697 9
7 O 3.312 8
2.6032 5
2.5335 6
2.6442 6
2.7614 8
3.2535 11
2.8626 12
2.5792 5
2.7902 9
8 O 3.312 10
2.7259 5
2.6473 6
2.7614 7
2.7199 9
2.7778 10
2.7109 10
2.4158 11
2.7788 13
2.7613 9
2.8018 12
9 O 3.312 10
2.6912 5
2.7199 8
2.7232 10
2.7907 11
2.7832 12
2.6697 6
2.7902 7
2.7613 8
2.7433 10
2.3444 13
10 OH 3.36 10
3.187 5
3.1725 6
2.7109 8
2.7778 8
2.7232 9
2.7526 11
3.3464 8
2.7433 9
2.3113 12
2.739 13
11 OH 3.36 12
2.4158 8
2.7907 9
2.7526 10
3.2316 12
2.761 13
2.782 6
3.2535 7
3.3025 5
2.7555 12
2.8205 12
3.3055 13
2.7517 13
12 OH 3.36 11
2.7832 9
3.2316 11
2.8088 13
3.2147 6
2.8626 7
2.8018 8
2.3113 10
2.8205 11
2.7555 11
3.3151 13
2.6968 13
13 OH 3.36 11
2.7788 8
2.761 11
2.8088 12
2.8984 5
3.2416 6
2.3444 9
2.739 10
2.7517 11
3.3055 11
2.6968 12
3.3151 12
14 H 1.68 1
1.039 10
15 H 1.68 1
0.9192 11
16 H 1.68 1
1.0007 13
17 H 1.68 1
0.8438 12
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 0 0 2 6.424 12.847 0.073 156.81 2 81.1 549.8
2 1 1 0 10.093 20.186 0.114 62.21 4 33.3 73.6
3 0 2 0 10.132 20.265 0.114 61.71 2 72.6 173.3
4 1 1 1 10.582 21.163 0.119 56.4 4 114.6 789.1
5 1 1 -1 10.619 21.238 0.12 55.99 4 49.3 145.2
6 0 2 1 10.638 21.276 0.12 55.78 4 66.0 258.6
7 1 1 2 11.967 23.934 0.135 43.64 4 46.0 98.2
8 1 1 -2 12.034 24.067 0.135 43.13 4 58.4 156.6
9 0 2 2 12.034 24.067 0.135 43.13 4 18.0 14.8
10 0 0 4 12.93 25.86 0.145 37.09 2 164.9 536.9
11 1 1 3 13.999 27.999 0.157 31.34 4 19.7 13.0
12 0 2 3 14.071 28.143 0.158 31.0 4 86.6 247.5
13 1 1 -3 14.086 28.172 0.158 30.93 4 78.5 203.0
14 1 1 4 16.462 32.925 0.184 22.13 4 33.3 26.1
15 0 2 4 16.537 33.074 0.185 21.92 4 43.7 44.5
16 1 1 -4 16.562 33.124 0.185 21.85 4 5.5 0.7
17 2 0 0 17.647 35.294 0.197 19.03 2 60.8 37.5
18 1 3 0 17.717 35.434 0.198 18.86 4 54.4 59.5
19 1 3 1 18.013 36.025 0.201 18.19 4 13.2 3.4
20 1 3 -1 18.036 36.071 0.201 18.14 4 7.0 0.9
21 2 0 2 18.808 37.616 0.209 16.54 2 159.3 223.5
22 2 0 -2 18.897 37.794 0.21 16.37 2 127.4 141.4
23 1 3 2 18.897 37.794 0.21 16.37 4 119.6 249.5
24 1 3 -2 18.941 37.882 0.211 16.29 4 162.2 456.2
25 1 1 5 19.218 38.437 0.214 15.77 4 52.3 46.0
26 0 2 5 19.295 38.589 0.214 15.63 4 17.9 5.3
27 1 1 -5 19.327 38.655 0.215 15.57 4 46.4 35.8
28 0 0 6 19.612 39.223 0.218 15.08 2 105.0 88.6
29 1 3 3 20.305 40.61 0.225 13.96 4 14.9 3.3
30 1 3 -3 20.367 40.734 0.226 13.86 4 9.4 1.3
31 2 2 0 20.518 41.035 0.228 13.64 4 9.6 1.4
32 0 4 0 20.6 41.201 0.228 13.51 2 6.6 0.3
33 2 2 1 20.769 41.538 0.23 13.27 4 10.2 1.5
34 2 2 -1 20.81 41.619 0.231 13.21 4 24.0 8.1
35 0 4 1 20.871 41.742 0.231 13.13 4 13.6 2.6
36 2 2 2 21.548 43.095 0.238 12.22 4 25.9 8.7
37 2 2 -2 21.627 43.254 0.239 12.12 4 8.8 1.0
38 0 4 2 21.667 43.333 0.24 12.07 4 14.5 2.7
39 2 0 4 22.057 44.114 0.244 11.6 2 143.2 126.6
40 1 3 4 22.154 44.309 0.245 11.48 4 89.6 98.2
41 1 1 6 22.191 44.383 0.245 11.44 4 12.4 1.9
42 2 0 -4 22.212 44.425 0.245 11.41 2 84.5 43.4
43 1 3 -4 22.232 44.464 0.246 11.39 4 146.0 258.7
44 0 2 6 22.269 44.538 0.246 11.35 4 25.8 8.0
45 1 1 -6 22.307 44.615 0.246 11.3 4 23.0 6.4
46 2 2 3 22.811 45.621 0.252 10.75 4 7.6 0.7
47 2 2 -3 22.924 45.849 0.253 10.63 4 50.8 29.2
48 0 4 3 22.943 45.887 0.253 10.61 4 59.7 40.3
49 1 3 5 24.369 48.738 0.268 9.25 4 16.2 2.6
50 1 3 -5 24.459 48.919 0.269 9.18 4 13.8 1.9
51 2 2 4 24.5 49.0 0.269 9.14 4 31.0 9.4
52 2 2 -4 24.643 49.287 0.271 9.02 4 47.3 21.5
53 0 4 4 24.644 49.287 0.271 9.02 4 8.2 0.6
54 1 1 7 25.343 50.687 0.278 8.46 4 25.3 5.8
55 0 2 7 25.422 50.844 0.279 8.4 4 44.7 17.9
56 1 1 -7 25.466 50.932 0.279 8.37 4 21.2 4.0
57 2 2 5 26.558 53.115 0.29 7.61 4 84.3 57.6
58 0 0 8 26.585 53.17 0.29 7.59 2 72.7 21.4
59 0 4 5 26.71 53.42 0.292 7.51 4 48.9 19.1
60 2 2 -5 26.727 53.454 0.292 7.5 4 36.7 10.8
61 2 0 6 26.789 53.578 0.293 7.46 2 150.4 89.9
62 1 3 6 26.89 53.78 0.294 7.4 4 16.8 2.2
63 2 0 -6 26.991 53.981 0.295 7.33 2 18.5 1.3
64 1 3 -6 26.991 53.981 0.295 7.33 4 151.3 178.8
65 3 1 0 27.591 55.181 0.301 6.97 4 34.7 8.9
66 2 4 0 27.673 55.347 0.301 6.93 4 13.4 1.3
67 1 5 0 27.723 55.446 0.302 6.9 4 33.5 8.2
68 3 1 1 27.784 55.568 0.303 6.87 4 71.4 37.3
69 3 1 -1 27.833 55.666 0.303 6.84 4 40.4 11.9
70 2 4 1 27.874 55.749 0.303 6.81 4 52.9 20.3
71 2 4 -1 27.907 55.814 0.304 6.8 4 77.1 43.1
72 1 5 1 27.932 55.864 0.304 6.78 4 54.3 21.3
73 1 5 -1 27.948 55.896 0.304 6.77 4 17.0 2.1
74 3 1 2 28.407 56.813 0.309 6.53 4 18.0 2.3
75 3 1 -2 28.504 57.008 0.31 6.48 4 23.3 3.7
76 2 4 2 28.504 57.008 0.31 6.48 4 25.8 4.6
77 2 4 -2 28.569 57.137 0.31 6.45 4 34.0 8.0
78 1 5 2 28.569 57.137 0.31 6.45 4 33.2 7.5
79 1 5 -2 28.601 57.202 0.311 6.43 4 55.0 20.7
80 1 1 8 28.661 57.322 0.311 6.4 4 20.8 3.0
81 0 2 8 28.742 57.483 0.312 6.36 4 14.5 1.4
82 1 1 -8 28.79 57.58 0.313 6.33 4 9.5 0.6
83 2 2 6 28.935 57.87 0.314 6.26 4 44.4 13.2
84 0 4 6 29.095 58.19 0.316 6.18 4 43.2 12.3
85 2 2 -6 29.127 58.254 0.316 6.17 4 29.6 5.8
86 3 1 3 29.442 58.883 0.319 6.02 4 70.0 31.4
87 2 4 3 29.545 59.089 0.32 5.97 4 54.2 18.7
88 3 1 -3 29.584 59.168 0.32 5.96 4 47.7 14.5
89 1 5 3 29.616 59.231 0.321 5.94 4 31.1 6.1
90 2 4 -3 29.639 59.279 0.321 5.93 4 21.9 3.0
91 1 5 -3 29.663 59.326 0.321 5.92 4 66.0 27.5
92 1 3 7 29.676 59.352 0.321 5.92 4 16.6 1.7
93 1 3 -7 29.786 59.572 0.322 5.87 4 6.3 0.3
94 3 1 4 30.863 61.726 0.333 5.42 4 30.2 5.3
95 2 4 4 30.971 61.942 0.334 5.38 4 18.0 1.9
96 3 1 -4 31.048 62.095 0.335 5.35 4 23.5 3.1
97 1 5 4 31.048 62.096 0.335 5.35 4 30.0 5.1
98 2 4 -4 31.094 62.188 0.335 5.33 4 32.6 6.0
99 1 5 -4 31.109 62.218 0.335 5.33 4 17.3 1.7
100 2 2 7 31.598 63.196 0.34 5.15 4 19.5 2.1
101 3 3 0 31.718 63.437 0.341 5.1 4 191.8 199.9
102 0 4 7 31.765 63.53 0.342 5.09 4 80.1 34.8
103 2 2 -7 31.81 63.62 0.342 5.07 4 100.4 54.4
104 0 6 0 31.855 63.71 0.343 5.06 2 189.0 96.2
105 3 3 1 31.896 63.792 0.343 5.04 4 14.6 1.2
106 3 3 -1 31.941 63.882 0.343 5.03 4 10.9 0.6
107 0 6 1 32.055 64.109 0.345 4.99 4 22.7 2.7
108 1 1 9 32.147 64.294 0.345 4.96 4 21.5 2.4
109 0 2 9 32.23 64.459 0.346 4.93 4 20.5 2.2
110 1 1 -9 32.282 64.564 0.347 4.91 4 34.4 6.2
111 3 3 2 32.47 64.94 0.348 4.85 4 51.1 13.5
112 3 3 -2 32.56 65.119 0.349 4.82 4 77.0 30.4
113 2 0 8 32.6 65.201 0.35 4.81 2 104.0 27.7
114 3 1 5 32.644 65.287 0.35 4.79 4 30.6 4.8
115 0 6 2 32.649 65.299 0.35 4.79 4 63.7 20.7
116 1 3 8 32.705 65.41 0.351 4.78 4 203.9 211.6
117 2 4 5 32.756 65.511 0.351 4.76 4 51.8 13.6
118 1 3 -8 32.824 65.649 0.352 4.74 4 108.0 58.8
119 1 5 5 32.838 65.675 0.352 4.73 4 36.3 6.6
120 2 0 -8 32.839 65.678 0.352 4.73 2 192.8 93.7
121 3 1 -5 32.867 65.735 0.352 4.73 4 38.5 7.4
122 2 4 -5 32.905 65.809 0.353 4.71 4 57.6 16.7
123 1 5 -5 32.912 65.824 0.353 4.71 4 42.1 8.9
124 3 3 3 33.43 66.859 0.358 4.56 4 18.8 1.7
125 3 3 -3 33.562 67.125 0.359 4.52 4 12.2 0.7
126 0 6 3 33.629 67.257 0.359 4.5 4 29.5 4.2
127 0 0 10 34.015 68.029 0.363 4.39 2 74.5 13.0
128 2 2 8 34.525 69.051 0.368 4.26 4 54.3 13.4
129 0 4 8 34.7 69.399 0.37 4.22 4 8.4 0.3
130 2 2 -8 34.757 69.515 0.37 4.2 4 51.3 11.8
131 3 1 6 34.758 69.517 0.37 4.2 4 27.6 3.4
132 3 3 4 34.76 69.519 0.37 4.2 4 90.5 36.7
133 2 4 6 34.874 69.749 0.371 4.18 4 21.6 2.1
134 3 3 -4 34.933 69.867 0.372 4.16 4 75.3 25.1
135 1 5 6 34.961 69.922 0.372 4.15 4 18.6 1.5
136 0 6 4 34.977 69.954 0.372 4.15 4 81.3 29.2
137 3 1 -6 35.019 70.037 0.372 4.14 4 26.2 3.0
138 2 4 -6 35.048 70.095 0.373 4.13 4 16.6 1.2
139 1 5 -6 35.048 70.095 0.373 4.13 4 30.8 4.2
140 1 1 10 35.817 71.634 0.38 3.96 4 13.6 0.8
141 0 2 10 35.903 71.806 0.381 3.94 4 28.1 3.3
142 1 1 -10 35.96 71.92 0.381 3.93 4 9.5 0.4
143 1 3 9 35.972 71.943 0.381 3.93 4 15.9 1.1
144 1 3 -9 36.1 72.2 0.382 3.9 4 11.0 0.5
145 3 3 5 36.443 72.886 0.386 3.83 4 13.2 0.7
146 3 3 -5 36.656 73.312 0.388 3.79 4 9.8 0.4
147 0 6 5 36.677 73.354 0.388 3.78 4 22.4 2.0
148 3 1 7 37.189 74.379 0.392 3.68 4 35.8 5.0
149 2 4 7 37.309 74.618 0.393 3.66 4 33.6 4.4
150 4 0 0 37.322 74.644 0.394 3.66 2 62.3 7.6
151 1 5 7 37.401 74.801 0.394 3.65 4 31.3 3.8
152 3 1 -7 37.485 74.969 0.395 3.63 4 54.1 11.3
153 2 6 0 37.491 74.982 0.395 3.63 4 66.2 16.9
154 1 5 -7 37.499 74.998 0.395 3.63 4 21.4 1.8
155 2 4 -7 37.506 75.012 0.395 3.63 4 36.3 5.1
156 2 6 1 37.663 75.325 0.397 3.6 4 25.7 2.5
157 2 6 -1 37.691 75.381 0.397 3.6 4 28.0 3.0
158 2 2 9 37.713 75.427 0.397 3.59 4 74.1 21.0
159 0 4 9 37.896 75.791 0.399 3.56 4 77.9 23.0
160 2 2 -9 37.965 75.931 0.399 3.55 4 15.2 0.9
161 4 0 2 38.007 76.015 0.4 3.54 2 78.9 11.7
162 4 0 -2 38.119 76.238 0.401 3.52 2 153.3 44.1
163 2 6 2 38.203 76.406 0.401 3.51 4 143.3 76.8
164 2 6 -2 38.259 76.518 0.402 3.5 4 75.7 21.4
165 3 3 6 38.465 76.93 0.404 3.47 4 54.3 10.9
166 3 3 -6 38.716 77.431 0.406 3.43 4 58.8 12.6
167 0 6 6 38.716 77.431 0.406 3.43 4 46.3 7.8
168 2 6 3 39.108 78.217 0.409 3.37 4 25.2 2.3
169 4 2 0 39.146 78.293 0.41 3.37 4 40.9 6.0
170 2 6 -3 39.191 78.383 0.41 3.36 4 27.6 2.7
171 3 5 0 39.243 78.487 0.411 3.35 4 58.9 12.4
172 4 2 1 39.302 78.603 0.411 3.35 4 71.9 18.4
173 1 7 0 39.354 78.709 0.412 3.34 4 15.1 0.8
174 4 2 -1 39.357 78.714 0.412 3.34 4 31.3 3.5
175 2 0 10 39.375 78.751 0.412 3.34 2 72.6 9.4
176 3 5 1 39.406 78.811 0.412 3.33 4 81.8 23.7
177 3 5 -1 39.447 78.894 0.412 3.33 4 20.1 1.4
178 1 3 10 39.486 78.972 0.413 3.32 4 108.1 41.3
179 1 7 1 39.53 79.06 0.413 3.32 4 95.5 32.2
180 1 7 -1 39.544 79.088 0.413 3.31 4 64.2 14.5
181 1 3 -10 39.624 79.249 0.414 3.3 4 70.3 17.4
182 2 0 -10 39.652 79.304 0.414 3.3 2 126.7 28.2
183 1 1 11 39.702 79.404 0.415 3.29 4 50.4 8.9
184 0 2 11 39.792 79.583 0.415 3.28 4 30.2 3.2
185 4 2 2 39.822 79.643 0.416 3.28 4 36.9 4.8
186 1 1 -11 39.854 79.707 0.416 3.27 4 32.0 3.6
187 3 1 8 39.928 79.857 0.417 3.26 4 6.5 0.1
188 4 2 -2 39.932 79.864 0.417 3.26 4 56.4 11.1
189 3 5 2 39.932 79.864 0.417 3.26 4 14.9 0.8
190 3 5 -2 40.015 80.03 0.417 3.25 4 36.7 4.7
191 2 4 8 40.052 80.105 0.418 3.25 4 17.1 1.0
192 1 7 2 40.07 80.14 0.418 3.25 4 33.4 3.8
193 1 7 -2 40.098 80.195 0.418 3.24 4 16.9 1.0
194 1 5 8 40.149 80.298 0.419 3.24 4 42.4 6.2
195 4 0 4 40.151 80.302 0.419 3.24 2 80.3 11.1
196 3 1 -8 40.259 80.518 0.419 3.22 4 14.3 0.7
197 1 5 -8 40.259 80.518 0.419 3.22 4 9.9 0.3
198 2 4 -8 40.273 80.545 0.42 3.22 4 15.2 0.8
199 4 0 -4 40.371 80.742 0.42 3.21 2 42.9 3.1
200 2 6 4 40.371 80.742 0.42 3.21 4 41.3 5.8
201 2 6 -4 40.481 80.962 0.421 3.2 4 77.6 20.5
202 4 2 3 40.703 81.406 0.423 3.17 4 48.3 7.9
203 3 3 7 40.817 81.635 0.424 3.16 4 11.4 0.4
204 3 5 3 40.82 81.64 0.424 3.16 4 57.4 11.1
205 4 2 -3 40.868 81.735 0.425 3.15 4 70.8 16.8
206 3 5 -3 40.943 81.886 0.425 3.14 4 37.1 4.6
207 1 7 3 40.971 81.942 0.426 3.14 4 22.4 1.7
208 1 7 -3 41.012 82.024 0.426 3.14 4 58.8 11.5
209 0 6 7 41.085 82.169 0.427 3.13 4 18.0 1.1
210 3 3 -7 41.105 82.21 0.427 3.13 4 10.4 0.4
211 2 2 10 41.173 82.347 0.427 3.12 4 24.4 2.0
212 0 4 10 41.365 82.73 0.429 3.1 4 34.9 4.0
213 2 2 -10 41.447 82.894 0.43 3.09 4 35.2 4.1
214 4 2 4 41.941 83.883 0.434 3.04 4 22.0 1.6
215 2 6 5 41.986 83.972 0.434 3.04 4 18.4 1.1
216 3 5 4 42.064 84.129 0.435 3.03 4 44.1 6.3
217 2 6 -5 42.122 84.244 0.435 3.03 4 23.5 1.8
218 4 2 -4 42.16 84.319 0.436 3.02 4 14.3 0.7
219 0 0 12 42.166 84.333 0.436 3.02 2 98.4 15.6
220 3 5 -4 42.228 84.456 0.436 3.02 4 36.7 4.3
221 1 7 4 42.228 84.456 0.436 3.02 4 20.1 1.3
222 1 7 -4 42.283 84.565 0.437 3.01 4 12.3 0.5
223 3 1 9 42.981 85.962 0.443 2.96 4 16.9 0.9
224 2 4 9 43.11 86.22 0.444 2.95 4 75.3 17.8
225 1 5 9 43.212 86.424 0.444 2.94 4 38.4 4.6
226 1 3 11 43.278 86.555 0.445 2.93 4 19.6 1.2
227 1 5 -9 43.334 86.669 0.445 2.93 4 14.4 0.6
228 3 1 -9 43.348 86.696 0.446 2.93 4 40.4 5.1
229 2 4 -9 43.355 86.71 0.446 2.93 4 18.3 1.0
230 1 3 -11 43.427 86.854 0.446 2.92 4 12.5 0.5
231 3 3 8 43.501 87.001 0.447 2.92 4 50.8 8.0
232 4 2 5 43.533 87.066 0.447 2.92 4 36.2 4.1
233 3 5 5 43.662 87.325 0.448 2.91 4 35.7 3.9
234 4 0 6 43.705 87.41 0.449 2.9 2 29.1 1.3
235 0 6 8 43.786 87.572 0.449 2.9 4 44.5 6.1
236 4 2 -5 43.805 87.609 0.449 2.9 4 30.0 2.8
237 3 3 -8 43.827 87.653 0.449 2.9 4 50.6 7.9
238 1 7 5 43.839 87.678 0.45 2.89 4 49.0 7.4
239 1 1 12 43.849 87.698 0.45 2.89 4 6.5 0.1
240 3 5 -5 43.866 87.732 0.45 2.89 4 42.9 5.7
241 1 7 -5 43.907 87.814 0.45 2.89 4 43.7 5.9
242 0 2 12 43.944 87.888 0.45 2.89 4 14.1 0.6
243 2 6 6 43.95 87.9 0.451 2.89 4 129.3 51.4
244 1 1 -12 44.012 88.023 0.451 2.88 4 29.4 2.7
245 4 0 -6 44.031 88.062 0.451 2.88 2 121.9 22.8
246 2 6 -6 44.113 88.225 0.452 2.88 4 12.3 0.5
247 4 4 0 44.507 89.013 0.455 2.85 4 21.0 1.3
248 4 4 1 44.659 89.318 0.456 2.85 4 52.4 8.3
249 4 4 -1 44.713 89.426 0.457 2.84 4 41.6 5.2
250 0 8 0 44.724 89.448 0.457 2.84 2 36.4 2.0
251 0 8 1 44.903 89.807 0.458 2.83 4 33.3 3.4
252 2 2 11 44.936 89.873 0.458 2.83 4 38.6 4.5
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 0 0 2 6.424 12.847 6.88483 549.8 69.7 70.0 5.6
2 1 1 0 10.093 20.186 4.39537 73.6 9.3 9.3 5.6
3 0 2 0 10.132 20.265 4.3785 173.3 22.0 22.0 5.6
4 1 1 1 10.582 21.163 4.19456 789.1 100.0 100.0 5.6
5 0 2 1 10.638 21.276 4.17263 403.8 51.2 51.2 5.6
6 1 1 2 11.967 23.934 3.71495 98.2 12.4 12.4 5.6
7 1 1 -2 12.034 24.067 3.69465 171.5 21.7 21.7 5.6
8 0 0 4 12.93 25.86 3.44242 536.9 68.0 67.8 5.6
9 1 1 3 13.999 27.999 3.18415 13.0 1.6 1.6 5.6
10 0 2 3 14.071 28.143 3.16816 450.6 57.1 56.8 5.6
11 1 1 4 16.462 32.925 2.71813 26.1 3.3 3.3 5.6
12 0 2 4 16.537 33.074 2.70618 45.2 5.7 5.7 5.6
13 2 0 0 17.647 35.294 2.54094 37.5 4.8 4.7 5.7
14 1 3 0 17.717 35.434 2.53116 59.5 7.5 7.5 5.7
15 2 0 2 18.808 37.616 2.3892 223.5 28.3 27.9 5.7
16 1 3 2 18.897 37.794 2.37838 390.9 49.5 48.9 5.7
17 1 3 -2 18.941 37.882 2.37303 456.2 57.8 57.0 5.7
18 1 1 5 19.218 38.437 2.34007 46.0 5.8 5.7 5.7
19 1 1 -5 19.327 38.655 2.32739 35.8 4.5 4.5 5.7
20 0 0 6 19.612 39.223 2.29494 88.6 11.2 11.1 5.7
21 2 2 -1 20.81 41.619 2.16818 8.1 1.0 1.0 5.7
22 2 2 2 21.548 43.095 2.09728 8.7 1.1 1.1 5.7
23 2 0 4 22.057 44.114 2.0512 126.6 16.0 15.7 5.7
24 1 3 4 22.154 44.309 2.04263 98.2 12.4 12.2 5.7
25 1 3 -4 22.232 44.464 2.03586 303.9 38.5 37.7 5.7
26 0 2 6 22.269 44.538 2.03266 8.0 1.0 1.0 5.7
27 0 4 3 22.943 45.887 1.97599 69.5 8.8 8.6 5.7
28 2 2 4 24.5 49.0 1.85747 9.4 1.2 1.2 5.7
29 2 2 -4 24.643 49.287 1.84733 22.1 2.8 2.7 5.7
30 0 2 7 25.422 50.844 1.79433 17.9 2.3 2.2 5.8
31 2 2 5 26.558 53.115 1.72284 79.0 10.0 9.7 5.8
32 0 4 5 26.71 53.42 1.71373 29.9 3.8 3.7 5.8
33 2 0 6 26.789 53.578 1.70906 89.9 11.4 11.0 5.8
34 1 3 -6 26.991 53.981 1.69723 180.1 22.8 22.1 5.8
35 3 1 0 27.591 55.181 1.66313 8.9 1.1 1.1 5.8
36 1 5 0 27.723 55.446 1.65582 8.2 1.0 1.0 5.8
37 3 1 1 27.784 55.568 1.65248 37.3 4.7 4.6 5.8
38 3 1 -1 27.833 55.666 1.64978 11.9 1.5 1.5 5.8
39 2 4 1 27.874 55.749 1.64754 20.3 2.6 2.5 5.8
40 2 4 -1 27.907 55.814 1.64576 64.4 8.2 7.9 5.8
41 2 4 2 28.504 57.008 1.6141 8.3 1.1 1.0 5.8
42 2 4 -2 28.569 57.137 1.61075 15.5 2.0 1.9 5.8
43 1 5 -2 28.601 57.202 1.60909 20.7 2.6 2.5 5.8
44 2 2 6 28.935 57.87 1.59208 13.2 1.7 1.6 5.8
45 0 4 6 29.095 58.19 1.58408 12.3 1.6 1.5 5.8
46 3 1 3 29.442 58.883 1.56709 31.4 4.0 3.8 5.8
47 2 4 3 29.545 59.089 1.56212 18.7 2.4 2.3 5.8
48 3 1 -3 29.584 59.168 1.56022 14.5 1.8 1.8 5.8
49 1 5 3 29.616 59.231 1.5587 9.1 1.2 1.1 5.8
50 1 5 -3 29.663 59.326 1.55644 29.3 3.7 3.6 5.8
51 1 5 4 31.048 62.096 1.4935 8.3 1.1 1.0 5.8
52 3 3 0 31.718 63.437 1.46512 199.9 25.3 24.2 5.9
53 0 4 7 31.765 63.53 1.4632 34.8 4.4 4.2 5.9
54 2 2 -7 31.81 63.62 1.46133 54.4 6.9 6.6 5.9
55 0 6 0 31.855 63.71 1.4595 96.2 12.2 11.6 5.9
56 3 3 2 32.47 64.94 1.4348 13.5 1.7 1.6 5.9
57 3 3 -2 32.56 65.119 1.43128 30.4 3.9 3.7 5.9
58 2 0 8 32.6 65.201 1.42968 27.7 3.5 3.3 5.9
59 0 6 2 32.649 65.299 1.42777 25.5 3.2 3.1 5.9
60 1 3 8 32.705 65.41 1.42561 211.6 26.8 25.5 5.9
61 2 4 5 32.756 65.511 1.42366 13.6 1.7 1.6 5.9
62 2 0 -8 32.839 65.678 1.42044 166.6 21.1 20.1 5.9
63 2 4 -5 32.905 65.809 1.41793 25.6 3.2 3.1 5.9
64 0 0 10 34.015 68.029 1.37697 13.0 1.6 1.6 5.9
65 2 2 8 34.525 69.051 1.35907 13.4 1.7 1.6 5.9
66 3 3 4 34.76 69.519 1.35104 51.9 6.6 6.2 5.9
67 3 3 -4 34.933 69.867 1.34518 26.6 3.4 3.2 5.9
68 0 6 4 34.977 69.954 1.34372 29.2 3.7 3.5 5.9
69 1 5 -6 35.048 70.095 1.34135 8.4 1.1 1.0 5.9
70 4 0 0 37.322 74.644 1.27047 12.0 1.5 1.4 6.0
71 2 6 0 37.491 74.982 1.26558 35.1 4.5 4.2 6.0
72 2 2 9 37.713 75.427 1.25922 26.6 3.4 3.1 6.0
73 0 4 9 37.896 75.791 1.25407 23.0 2.9 2.7 6.0
74 4 0 2 38.007 76.015 1.25093 11.7 1.5 1.4 6.0
75 4 0 -2 38.119 76.238 1.24782 44.1 5.6 5.2 6.0
76 2 6 2 38.203 76.406 1.2455 76.8 9.7 9.1 6.0
77 2 6 -2 38.259 76.518 1.24396 21.4 2.7 2.5 6.0
78 3 3 6 38.465 76.93 1.23832 10.9 1.4 1.3 6.0
79 3 3 -6 38.716 77.431 1.23155 20.5 2.6 2.4 6.0
80 3 5 0 39.243 78.487 1.21761 12.4 1.6 1.5 6.0
81 4 2 1 39.302 78.603 1.2161 18.4 2.3 2.2 6.0
82 3 5 1 39.406 78.811 1.21341 36.6 4.6 4.3 6.0
83 1 3 10 39.486 78.972 1.21134 41.3 5.2 4.9 6.0
84 1 7 1 39.53 79.06 1.21021 46.8 5.9 5.5 6.0
85 2 0 -10 39.652 79.304 1.20711 45.6 5.8 5.4 6.0
86 1 1 11 39.702 79.404 1.20583 8.9 1.1 1.0 6.0
87 4 2 2 39.822 79.643 1.20281 8.0 1.0 0.9 6.0
88 4 2 -2 39.932 79.864 1.20004 11.8 1.5 1.4 6.0
89 4 0 4 40.151 80.302 1.1946 17.3 2.2 2.0 6.0
90 2 6 4 40.371 80.742 1.18919 9.0 1.1 1.1 6.1
91 2 6 -4 40.481 80.962 1.18651 20.5 2.6 2.4 6.1
92 3 5 3 40.82 81.64 1.17837 11.1 1.4 1.3 6.1
93 4 2 -3 40.868 81.735 1.17723 16.8 2.1 2.0 6.1
94 1 7 -3 41.012 82.024 1.17382 11.5 1.5 1.3 6.1
95 0 0 12 42.166 84.333 1.14747 15.6 2.0 1.8 6.1
96 2 4 9 43.11 86.22 1.12713 17.8 2.3 2.1 6.1
97 3 3 8 43.501 87.001 1.119 8.0 1.0 0.9 6.1
98 0 6 8 43.786 87.572 1.11318 8.9 1.1 1.0 6.2
99 3 3 -8 43.827 87.653 1.11235 15.4 2.0 1.8 6.2
100 2 6 6 43.95 87.9 1.10987 51.4 6.5 5.9 6.2
101 4 0 -6 44.031 88.062 1.10824 25.5 3.2 2.9 6.2
102 4 4 1 44.659 89.318 1.09588 8.3 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)
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