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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EPIDIDYMITE
2, analogue
K(2)Be(2)Si(6)O(15)
Orthorhombic C mc2(1) Z = 4
R =0.069 NR =540
7 .7 .1994
Ref.Str.:
Naumova I.S., Popedimskaya E.A., Pushcharovskii D.Yu.,
Belov N.V., Altukhova Yu.N. (1976)
* Dokl. Akad. Nauk SSSR
Reserv:
D.T.N.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 7.485 alpha = 90.0
b = 15.453 beta = 90.0
c = 11.148 gamma = 90.0
Unit cell volume (cub. angs.) = 1289.44
Molar volume ( cub.cm/mol.) = 194.17
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.5 0.2818 0.3619 2.48 K = 1.00
2 0.5 0.3987 0.084 0.93 K = 1.00
3 0.1489 0.3798 0.2275 0.26 Be = 1.00
4 0.2117 0.2095 0.1336 0.61 Si = 1.00
5 0.2046 0.0556 0.3103 0.4 Si = 1.00
6 0.0 0.3497 0.4659 0.32 Si = 1.00
7 0.0 0.4545 0.0009 0.52 Si = 1.00
8 0.322 0.2 0.0109 0.67 O = 1.00
9 0.2583 0.1291 0.2164 1.35 O = 1.00
10 0.3245 0.0764 0.4296 0.85 O = 1.00
11 0.2701 0.2958 0.1945 0.72 O = 1.00
12 0.2704 0.4623 0.2631 1.16 O = 1.00
13 0.0 0.216 0.0948 2.36 O = 1.00
14 0.0 0.4063 0.1283 0.68 O = 1.00
15 0.0 0.0715 0.3518 0.13 O = 1.00
16 0.0 0.3542 0.332 0.52 O = 1.00
17 0.0 0.4409 0.5256 0.95 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.5 0.2818 0.3619
2 2 0.5 0.3987 0.084
3 3 0.1489 0.3798 0.2275
4 4 0.2117 0.2095 0.1336
5 5 0.2046 0.0556 0.3103
6 6 0.0 0.3497 0.4659
7 7 0.0 0.4545 0.0009
8 8 0.322 0.2 0.0109
9 9 0.2583 0.1291 0.2164
10 10 0.3245 0.0764 0.4296
11 11 0.2701 0.2958 0.1945
12 12 0.2704 0.4623 0.2631
13 13 0.0 0.216 0.0948
14 14 0.0 0.4063 0.1283
15 15 0.0 0.0715 0.3518
16 16 0.0 0.3542 0.332
17 17 0.0 0.4409 0.5256
18 1 0.5 0.7182 0.8619
19 2 0.5 0.6013 0.584
20 3 0.8511 0.6202 0.7275
21 4 0.7883 0.7905 0.6336
22 5 0.7954 0.9444 0.8103
23 6 0.0 0.6503 0.9659
24 7 0.0 0.5455 0.5009
25 8 0.678 0.8 0.5109
26 9 0.7417 0.8709 0.7164
27 10 0.6755 0.9236 0.9296
28 11 0.7299 0.7042 0.6945
29 12 0.7296 0.5377 0.7631
30 13 0.0 0.784 0.5948
31 14 0.0 0.5937 0.6283
32 15 0.0 0.9285 0.8518
33 16 0.0 0.6458 0.832
34 17 0.0 0.5591 0.0256
35 3 0.8511 0.3798 0.2275
36 4 0.7883 0.2095 0.1336
37 5 0.7954 0.0556 0.3103
38 8 0.678 0.2 0.0109
39 9 0.7417 0.1291 0.2164
40 10 0.6755 0.0764 0.4296
41 11 0.7299 0.2958 0.1945
42 12 0.7296 0.4623 0.2631
43 3 0.1489 0.6202 0.7275
44 4 0.2117 0.7905 0.6336
45 5 0.2046 0.9444 0.8103
46 8 0.322 0.8 0.5109
47 9 0.2583 0.8709 0.7164
48 10 0.3245 0.9236 0.9296
49 11 0.2701 0.7042 0.6945
50 12 0.2704 0.5377 0.7631
51 1 0.0 0.2182 0.8619
52 2 0.0 0.1013 0.584
53 3 0.3511 0.1202 0.7275
54 4 0.2883 0.2905 0.6336
55 5 0.2954 0.4444 0.8103
56 6 0.5 0.1503 0.9659
57 7 0.5 0.0455 0.5009
58 8 0.178 0.3 0.5109
59 9 0.2417 0.3709 0.7164
60 10 0.1755 0.4236 0.9296
61 11 0.2299 0.2042 0.6945
62 12 0.2296 0.0377 0.7631
63 13 0.5 0.284 0.5948
64 14 0.5 0.0937 0.6283
65 15 0.5 0.4285 0.8518
66 16 0.5 0.1458 0.832
67 17 0.5 0.0591 0.0256
68 1 0.0 0.7818 0.3619
69 2 0.0 0.8987 0.084
70 3 0.6489 0.8798 0.2275
71 4 0.7117 0.7095 0.1336
72 5 0.7046 0.5556 0.3103
73 6 0.5 0.8497 0.4659
74 7 0.5 0.9545 0.0009
75 8 0.822 0.7 0.0109
76 9 0.7583 0.6291 0.2164
77 10 0.8245 0.5764 0.4296
78 11 0.7701 0.7958 0.1945
79 12 0.7704 0.9623 0.2631
80 13 0.5 0.716 0.0948
81 14 0.5 0.9063 0.1283
82 15 0.5 0.5715 0.3518
83 16 0.5 0.8542 0.332
84 17 0.5 0.9409 0.5256
85 3 0.6489 0.1202 0.7275
86 4 0.7117 0.2905 0.6336
87 5 0.7046 0.4444 0.8103
88 8 0.822 0.3 0.5109
89 9 0.7583 0.3709 0.7164
90 10 0.8245 0.4236 0.9296
91 11 0.7701 0.2042 0.6945
92 12 0.7704 0.0377 0.7631
93 3 0.3511 0.8798 0.2275
94 4 0.2883 0.7095 0.1336
95 5 0.2954 0.5556 0.3103
96 8 0.178 0.7 0.0109
97 9 0.2417 0.6291 0.2164
98 10 0.1755 0.5764 0.4296
99 11 0.2299 0.7958 0.1945
100 12 0.2296 0.9623 0.2631
X-ray density (g/cm cub.) = 2.6
MU (1/cm) = 124.52 Mass attenuation coefficient (cm**2/g) = 47.91
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 K 3.228 5
2.5477 11
2.5477 11
2.9406 8
2.5966 13
2.9406 8
2 K 3.228 7
2.6471 11
2.8117 12
2.6471 11
2.8117 12
3.0017 10
2.6292 15
3.0017 10
3 Be 2.04 4
1.6258 11
1.6155 12
1.6226 14
1.6601 16
4 Si 2.1 4
1.6044 8
1.5866 9
1.559 11
1.6456 13
5 Si 2.1 4
1.596 9
1.6363 10
1.6185 15
1.5461 12
6 Si 2.1 4
1.4943 16
1.5586 17
1.6176 8
1.6176 8
7 Si 2.1 4
1.6037 14
1.6397 17
1.6079 10
1.6079 10
8 O 3.264 6
2.5838 9
2.5557 11
2.5971 13
2.6647 8
2.5405 16
2.5579 17
9 O 3.264 7
2.5838 8
2.5608 10
2.5891 11
2.7164 13
2.6093 15
2.9945 17
2.6384 12
10 O 3.264 6
2.5608 9
2.5802 15
2.6272 10
2.5892 14
2.6936 17
2.6568 12
11 O 3.264 6
2.5557 8
2.5891 9
2.6842 12
2.616 13
2.7473 14
2.6928 16
12 O 3.264 6
2.6842 11
2.6652 14
2.7344 16
2.6036 15
2.6384 9
2.6568 10
13 O 3.264 7
2.5971 8
2.7164 9
2.616 11
2.9643 14
2.5971 8
2.7164 9
2.616 11
14 O 3.264 9
2.7473 11
2.6652 12
2.9643 13
2.4093 16
2.6241 17
2.7473 11
2.6652 12
2.5892 10
2.5892 10
15 O 3.264 6
2.6093 9
2.5802 10
2.6093 9
2.5802 10
2.6036 12
2.6036 12
16 O 3.264 8
2.6928 11
2.7344 12
2.4093 14
2.5403 17
2.6928 11
2.7344 12
2.5405 8
2.5405 8
17 O 3.264 8
2.5403 16
2.6241 14
2.5579 8
2.9945 9
2.6936 10
2.5579 8
2.9945 9
2.6936 10
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 2 0 5.722 11.443 0.065 198.26 2 23.4 13.0
2 1 1 0 6.566 13.132 0.074 150.0 4 50.5 92.2
3 0 2 1 6.967 13.934 0.079 132.98 4 18.1 10.5
4 1 1 1 7.678 15.356 0.087 109.1 8 20.4 21.9
5 0 0 2 7.943 15.886 0.09 101.78 2 52.4 33.6
6 0 2 2 9.811 19.622 0.111 65.96 4 141.1 316.1
7 1 1 2 10.333 20.666 0.116 59.26 8 104.9 313.6
8 1 3 0 10.459 20.918 0.118 57.79 4 9.8 1.3
9 1 3 1 11.2 22.4 0.126 50.12 8 104.3 262.2
10 0 4 0 11.501 23.002 0.129 47.42 2 15.7 1.4
11 2 0 0 11.877 23.755 0.134 44.33 2 34.4 6.3
12 0 4 1 12.182 24.364 0.137 42.04 4 320.5 1038.6
13 1 3 2 13.188 26.376 0.148 35.57 8 65.7 73.8
14 2 2 0 13.22 26.44 0.148 35.39 4 21.6 4.0
15 0 2 3 13.298 26.596 0.149 34.95 4 54.3 24.8
16 1 1 3 13.694 27.388 0.154 32.84 8 84.2 112.1
17 2 2 1 13.822 27.644 0.155 32.2 8 148.5 341.5
18 0 4 2 14.04 28.079 0.157 31.15 4 21.1 3.3
19 2 0 2 14.354 28.708 0.161 29.72 4 265.1 502.3
20 2 2 2 15.498 30.996 0.173 25.21 8 229.1 636.5
21 1 5 0 15.643 31.286 0.175 24.71 4 48.1 13.8
22 1 3 3 15.994 31.988 0.179 23.56 8 118.9 160.1
23 0 0 4 16.044 32.089 0.179 23.4 2 54.4 8.3
24 1 5 1 16.162 32.324 0.181 23.03 8 101.6 114.5
25 2 4 0 16.652 33.304 0.186 21.59 4 93.3 45.3
26 0 4 3 16.715 33.431 0.187 21.41 4 83.0 35.5
27 0 2 4 17.086 34.173 0.191 20.41 4 165.6 134.8
28 2 4 1 17.144 34.288 0.191 20.27 8 34.4 11.5
29 0 6 0 17.402 34.805 0.194 19.61 2 135.6 43.4
30 1 1 4 17.404 34.808 0.194 19.61 8 138.8 181.7
31 1 5 2 17.637 35.275 0.197 19.05 8 56.4 29.2
32 0 6 1 17.876 35.752 0.199 18.5 4 80.3 28.7
33 2 2 3 17.978 35.957 0.2 18.27 8 102.4 92.2
34 3 1 0 18.224 36.447 0.203 17.73 4 55.0 12.9
35 2 4 2 18.551 37.101 0.207 17.05 8 68.1 38.1
36 3 1 1 18.679 37.358 0.208 16.79 8 38.6 12.1
37 0 6 2 19.236 38.472 0.214 15.74 4 11.1 0.5
38 1 3 4 19.309 38.618 0.215 15.61 8 60.2 27.2
39 1 5 3 19.884 39.767 0.221 14.62 8 49.1 17.0
40 0 4 4 19.925 39.851 0.221 14.56 4 51.0 9.1
41 3 1 2 19.993 39.985 0.222 14.45 8 29.2 5.9
42 3 3 0 20.062 40.124 0.223 14.34 4 60.3 12.6
43 2 0 4 20.157 40.315 0.224 14.19 4 140.9 67.8
44 3 3 1 20.483 40.966 0.227 13.69 8 106.3 74.4
45 2 4 3 20.712 41.424 0.23 13.35 8 19.9 2.5
46 2 2 4 21.022 42.045 0.233 12.92 8 77.1 36.9
47 0 2 5 21.074 42.148 0.233 12.84 4 53.9 9.0
48 2 6 0 21.288 42.576 0.236 12.56 4 37.8 4.3
49 1 7 0 21.333 42.666 0.236 12.5 4 120.0 43.3
50 0 6 3 21.339 42.679 0.236 12.49 4 158.3 75.3
51 1 1 5 21.341 42.681 0.236 12.49 8 67.8 27.6
52 2 6 1 21.689 43.379 0.24 12.04 8 25.8 3.8
53 3 3 2 21.705 43.41 0.24 12.02 8 21.2 2.6
54 1 7 1 21.733 43.467 0.24 11.99 8 29.3 5.0
55 3 1 3 22.036 44.072 0.244 11.62 8 10.7 0.6
56 1 5 4 22.714 45.428 0.251 10.85 8 77.4 31.3
57 2 6 2 22.859 45.718 0.252 10.7 8 89.0 40.8
58 1 7 2 22.902 45.803 0.253 10.65 8 79.4 32.3
59 1 3 5 22.971 45.942 0.253 10.58 8 115.7 68.2
60 3 5 0 23.377 46.754 0.258 10.17 4 46.3 5.2
61 2 4 4 23.461 46.922 0.258 10.09 8 52.9 13.6
62 0 8 0 23.501 47.003 0.259 10.05 2 164.9 32.8
63 0 4 5 23.509 47.017 0.259 10.04 4 21.9 1.2
64 3 3 3 23.628 47.257 0.26 9.92 8 61.8 18.2
65 3 5 1 23.75 47.5 0.261 9.81 8 85.3 34.4
66 0 8 1 23.873 47.747 0.263 9.7 4 5.2 0.1
67 0 6 4 24.031 48.062 0.264 9.55 4 113.1 29.4
68 4 0 0 24.308 48.616 0.267 9.31 2 372.3 155.1
69 2 2 5 24.476 48.952 0.269 9.16 8 65.5 18.9
70 0 0 6 24.493 48.985 0.269 9.15 2 102.3 11.5
71 3 1 4 24.668 49.336 0.271 9.0 8 80.7 28.2
72 2 6 3 24.712 49.425 0.271 8.96 8 121.1 63.2
73 1 7 3 24.752 49.505 0.272 8.93 8 59.5 15.2
74 3 5 2 24.844 49.688 0.273 8.86 8 72.4 22.3
75 0 8 2 24.963 49.927 0.274 8.76 4 54.4 6.2
76 4 2 0 25.058 50.116 0.275 8.68 4 6.8 0.1
77 0 2 6 25.239 50.478 0.277 8.54 4 67.8 9.5
78 4 2 1 25.413 50.826 0.279 8.41 8 9.5 0.4
79 1 1 6 25.471 50.942 0.279 8.37 8 61.4 15.2
80 4 0 2 25.735 51.471 0.282 8.17 4 43.4 3.7
81 1 5 5 25.992 51.985 0.284 7.99 8 44.8 7.7
82 3 3 4 26.137 52.275 0.286 7.89 8 104.5 41.4
83 4 2 2 26.456 52.912 0.289 7.67 8 30.4 3.4
84 3 5 3 26.594 53.187 0.291 7.58 8 18.6 1.3
85 2 8 0 26.664 53.328 0.291 7.54 4 84.5 13.0
86 2 4 5 26.67 53.341 0.291 7.53 8 33.7 4.1
87 0 8 3 26.707 53.414 0.292 7.51 4 34.9 2.2
88 1 3 6 26.909 53.818 0.294 7.38 8 48.1 8.2
89 2 8 1 27.003 54.007 0.295 7.32 8 81.0 23.1
90 2 6 4 27.148 54.296 0.296 7.24 8 61.0 12.9
91 1 7 4 27.185 54.37 0.297 7.21 8 90.3 28.3
92 0 6 5 27.191 54.381 0.297 7.21 4 182.8 58.0
93 4 4 0 27.219 54.437 0.297 7.19 4 7.4 0.1
94 0 4 6 27.389 54.778 0.299 7.09 4 73.2 9.1
95 1 9 0 27.405 54.809 0.299 7.08 4 120.0 24.5
96 4 4 1 27.553 55.107 0.3 7.0 8 108.4 39.6
97 2 0 6 27.571 55.143 0.3 6.99 4 56.3 5.3
98 1 9 1 27.738 55.476 0.302 6.89 8 17.0 1.0
99 3 7 0 27.769 55.537 0.302 6.87 4 40.1 2.7
100 3 1 5 27.775 55.55 0.302 6.87 8 94.1 29.3
101 2 8 2 28.005 56.01 0.305 6.74 8 31.6 3.2
102 3 7 1 28.099 56.198 0.306 6.69 8 62.2 12.5
103 4 2 3 28.135 56.269 0.306 6.67 8 79.0 20.1
104 2 2 6 28.26 56.519 0.307 6.61 8 68.7 15.0
105 4 4 2 28.542 57.084 0.31 6.46 8 38.5 4.6
106 1 9 2 28.723 57.445 0.312 6.37 8 94.7 27.5
107 3 5 4 28.917 57.835 0.314 6.27 8 53.1 8.5
108 0 8 4 29.025 58.05 0.315 6.22 4 55.2 4.6
109 3 7 2 29.076 58.151 0.315 6.19 8 137.9 56.7
110 3 3 5 29.134 58.269 0.316 6.17 8 96.6 27.7
111 0 2 7 29.593 59.186 0.321 5.95 4 93.4 12.5
112 2 8 3 29.625 59.25 0.321 5.94 8 74.5 15.9
113 1 5 6 29.64 59.28 0.321 5.93 8 18.2 0.9
114 4 0 4 29.724 59.447 0.322 5.89 4 62.6 5.6
115 1 1 7 29.802 59.604 0.323 5.86 8 51.3 7.4
116 0 10 0 29.899 59.797 0.324 5.82 2 9.9 0.1
117 2 6 5 30.077 60.154 0.325 5.74 8 128.5 45.6
118 1 7 5 30.112 60.224 0.326 5.73 8 28.8 2.3
119 4 4 3 30.143 60.287 0.326 5.71 8 60.4 10.0
120 0 10 1 30.214 60.428 0.327 5.68 4 95.8 12.6
121 2 4 6 30.263 60.526 0.327 5.66 8 106.6 31.0
122 1 9 3 30.318 60.636 0.328 5.64 8 43.2 5.1
123 4 2 4 30.381 60.761 0.328 5.61 8 120.3 39.1
124 4 6 0 30.585 61.17 0.33 5.53 4 44.4 2.6
125 3 7 3 30.659 61.319 0.331 5.5 8 29.9 2.4
126 0 6 6 30.744 61.487 0.332 5.47 4 34.3 1.5
127 4 6 1 30.896 61.793 0.333 5.41 8 16.3 0.7
128 1 3 7 31.105 62.211 0.335 5.33 8 42.0 4.5
129 5 1 0 31.128 62.257 0.336 5.32 4 36.3 1.7
130 0 10 2 31.149 62.298 0.336 5.31 4 173.7 38.6
131 3 1 6 31.285 62.57 0.337 5.26 8 138.6 48.6
132 5 1 1 31.437 62.873 0.339 5.2 8 28.0 2.0
133 0 4 7 31.544 63.088 0.34 5.17 4 180.7 40.6
134 3 5 5 31.743 63.485 0.342 5.1 8 94.0 21.6
135 2 8 4 31.806 63.611 0.342 5.07 8 53.8 7.1
136 4 6 2 31.82 63.64 0.342 5.07 8 33.5 2.7
137 0 8 5 31.844 63.689 0.342 5.06 4 32.8 1.3
138 4 4 4 32.304 64.607 0.347 4.9 8 8.3 0.2
139 2 2 7 32.345 64.689 0.347 4.89 8 39.8 3.7
140 5 1 2 32.351 64.703 0.347 4.89 8 114.2 30.7
141 5 3 0 32.401 64.802 0.348 4.87 4 4.2 0.0
142 1 9 4 32.471 64.943 0.348 4.85 8 21.3 1.1
143 3 3 6 32.554 65.108 0.349 4.82 8 63.3 9.3
144 2 10 0 32.635 65.27 0.35 4.8 4 33.8 1.3
145 0 10 3 32.673 65.347 0.35 4.79 4 107.5 13.3
146 5 3 1 32.702 65.405 0.351 4.78 8 73.0 12.2
147 3 7 4 32.8 65.6 0.352 4.75 8 19.9 0.9
148 2 10 1 32.936 65.871 0.353 4.7 8 33.3 2.5
149 3 9 0 32.996 65.993 0.353 4.69 4 141.7 22.6
150 4 2 5 33.132 66.264 0.355 4.64 8 40.7 3.7
151 3 9 1 33.295 66.59 0.356 4.6 8 19.2 0.8
152 4 6 3 33.327 66.655 0.357 4.59 8 107.9 25.7
153 2 6 6 33.441 66.881 0.358 4.55 8 73.0 11.7
154 1 7 6 33.474 66.947 0.358 4.55 8 25.1 1.4
155 0 0 8 33.557 67.114 0.359 4.52 2 81.0 3.6
156 5 3 2 33.599 67.197 0.359 4.51 8 87.3 16.5
157 1 5 7 33.625 67.25 0.359 4.5 8 53.6 6.2
158 2 10 2 33.829 67.657 0.361 4.45 8 95.1 19.3
159 5 1 3 33.846 67.693 0.362 4.44 8 59.8 7.6
160 1 11 0 33.91 67.82 0.362 4.42 4 25.6 0.7
161 0 2 8 34.172 68.345 0.365 4.35 4 78.8 6.5
162 3 9 2 34.184 68.367 0.365 4.35 8 57.1 6.8
163 1 11 1 34.205 68.409 0.365 4.34 8 51.3 5.5
164 2 4 7 34.207 68.414 0.365 4.34 8 33.7 2.4
165 1 1 8 34.365 68.731 0.366 4.3 8 52.8 5.8
166 2 8 5 34.495 68.99 0.368 4.27 8 54.0 6.0
167 0 6 7 34.658 69.315 0.369 4.23 4 100.3 10.2
168 0 10 4 34.748 69.495 0.37 4.21 4 137.4 19.1
169 5 5 0 34.871 69.742 0.371 4.18 4 58.4 3.4
170 4 8 0 34.968 69.936 0.372 4.15 4 52.9 2.8
171 4 4 5 34.974 69.947 0.372 4.15 8 33.1 2.2
172 3 5 6 35.019 70.038 0.372 4.14 8 76.7 11.7
173 5 3 3 35.067 70.134 0.373 4.13 8 135.7 36.6
174 1 11 2 35.082 70.164 0.373 4.13 8 64.2 8.2
175 0 8 6 35.116 70.232 0.373 4.12 4 115.4 13.2
176 1 9 5 35.135 70.27 0.374 4.11 8 55.6 6.1
177 5 5 1 35.162 70.324 0.374 4.11 8 71.8 10.2
178 3 1 7 35.167 70.335 0.374 4.11 8 63.1 7.9
179 4 8 1 35.259 70.518 0.375 4.08 8 13.5 0.4
180 2 10 3 35.293 70.585 0.375 4.08 8 28.4 1.6
181 4 6 4 35.383 70.766 0.376 4.06 8 90.1 15.8
182 3 7 5 35.452 70.903 0.376 4.04 8 66.7 8.6
183 1 3 8 35.578 71.156 0.378 4.01 8 42.6 3.5
184 3 9 3 35.641 71.282 0.378 4.0 8 18.7 0.7
185 4 0 6 35.748 71.497 0.379 3.97 4 64.1 3.9
186 5 1 4 35.888 71.776 0.381 3.94 8 119.7 27.2
187 0 4 8 35.989 71.978 0.381 3.92 4 115.4 12.6
188 5 5 2 36.029 72.058 0.382 3.91 8 52.2 5.1
189 4 8 2 36.125 72.25 0.383 3.89 8 18.2 0.6
190 2 0 8 36.146 72.291 0.383 3.89 4 123.3 14.2
191 4 2 6 36.347 72.693 0.385 3.85 8 10.2 0.2
192 3 3 7 36.368 72.736 0.385 3.84 8 59.7 6.6
193 1 11 3 36.523 73.047 0.386 3.81 8 44.5 3.6
194 0 12 0 36.738 73.476 0.388 3.77 2 179.4 14.6
195 2 2 8 36.742 73.483 0.388 3.77 8 76.7 10.7
196 0 12 1 37.023 74.046 0.391 3.72 4 91.8 7.5
197 5 3 4 37.079 74.158 0.391 3.71 8 72.7 9.4
198 2 6 7 37.212 74.425 0.393 3.68 8 127.8 28.9
199 1 7 7 37.244 74.488 0.393 3.67 8 10.4 0.2
200 2 10 4 37.3 74.6 0.393 3.66 8 119.9 25.4
201 0 10 5 37.336 74.672 0.394 3.66 4 33.9 1.0
202 5 5 3 37.456 74.912 0.395 3.64 8 69.8 8.5
203 4 8 3 37.55 75.1 0.396 3.62 8 25.3 1.1
204 3 9 4 37.641 75.281 0.396 3.6 8 106.4 19.6
205 2 8 6 37.658 75.316 0.397 3.6 8 92.1 14.7
206 0 12 2 37.873 75.746 0.399 3.57 4 87.1 6.5
207 4 6 5 37.953 75.907 0.399 3.55 8 147.7 37.3
208 1 5 8 37.954 75.908 0.399 3.55 8 39.4 2.7
209 4 4 6 38.12 76.24 0.401 3.52 8 25.9 1.1
210 6 0 0 38.131 76.262 0.401 3.52 2 168.0 12.0
211 1 9 6 38.276 76.552 0.402 3.5 8 8.6 0.1
212 5 7 0 38.44 76.881 0.404 3.47 4 144.1 17.4
213 5 1 5 38.446 76.891 0.404 3.47 8 100.8 17.0
214 1 11 4 38.506 77.012 0.404 3.46 8 60.7 6.1
215 2 4 8 38.508 77.017 0.404 3.46 8 14.6 0.4
216 3 7 6 38.583 77.166 0.405 3.45 8 47.6 3.8
217 6 2 0 38.716 77.431 0.406 3.43 4 18.5 0.3
218 5 7 1 38.721 77.442 0.406 3.43 8 42.9 3.0
219 3 5 7 38.726 77.452 0.406 3.43 8 87.8 12.7
220 0 8 7 38.819 77.638 0.407 3.42 4 131.9 14.3
221 0 6 8 38.939 77.878 0.408 3.4 4 25.7 0.5
222 3 11 0 38.995 77.99 0.408 3.39 4 108.3 9.6
223 6 2 1 38.996 77.991 0.408 3.39 8 40.5 2.7
224 0 2 9 39.036 78.071 0.409 3.38 4 26.7 0.6
225 1 1 9 39.219 78.438 0.41 3.36 8 41.2 2.7
226 2 12 0 39.241 78.481 0.411 3.36 4 106.3 9.1
227 6 0 2 39.252 78.504 0.411 3.35 4 134.4 14.6
228 3 11 1 39.275 78.549 0.411 3.35 8 56.8 5.2
229 0 12 3 39.276 78.552 0.411 3.35 4 14.5 0.2
230 5 5 4 39.422 78.845 0.412 3.33 8 96.4 14.9
231 3 1 8 39.427 78.854 0.412 3.33 8 40.5 2.6
232 4 8 4 39.515 79.03 0.413 3.32 8 25.5 1.0
233 2 12 1 39.52 79.039 0.413 3.32 8 110.9 19.6
234 5 7 2 39.559 79.118 0.413 3.31 8 72.5 8.4
235 5 3 5 39.61 79.22 0.414 3.31 8 62.0 6.1
236 2 10 5 39.826 79.652 0.416 3.28 8 68.0 7.3
237 6 2 2 39.832 79.664 0.416 3.28 8 34.0 1.8
238 4 2 7 40.009 80.017 0.417 3.25 8 9.6 0.1
239 3 11 2 40.109 80.219 0.418 3.24 8 45.6 3.2
240 3 9 5 40.16 80.32 0.419 3.23 8 55.9 4.9
241 4 10 0 40.276 80.551 0.42 3.22 4 23.2 0.4
242 2 12 2 40.353 80.706 0.42 3.21 8 110.7 18.9
243 1 3 9 40.377 80.754 0.421 3.21 8 68.9 7.3
244 0 10 6 40.416 80.833 0.421 3.2 4 72.7 4.1
245 6 4 0 40.455 80.91 0.421 3.2 4 41.8 1.3
246 4 10 1 40.553 81.105 0.422 3.19 8 28.0 1.2
247 3 3 8 40.584 81.167 0.422 3.18 8 23.1 0.8
248 6 4 1 40.732 81.464 0.424 3.17 8 116.6 20.7
249 0 4 9 40.772 81.543 0.424 3.16 4 83.0 5.2
250 5 7 3 40.946 81.892 0.425 3.14 8 48.8 3.6
251 1 13 0 41.005 82.01 0.426 3.14 4 6.7 0.0
252 1 11 5 41.01 82.021 0.426 3.14 8 27.1 1.1
253 4 6 6 41.021 82.041 0.426 3.14 8 18.4 0.5
254 6 2 3 41.217 82.434 0.428 3.12 8 38.3 2.2
255 0 12 4 41.218 82.436 0.428 3.11 4 31.0 0.7
256 1 13 1 41.281 82.562 0.428 3.11 8 36.8 2.0
257 2 8 7 41.284 82.567 0.428 3.11 8 106.5 17.0
258 4 10 2 41.381 82.763 0.429 3.1 8 100.5 15.1
259 2 6 8 41.402 82.803 0.429 3.1 8 54.7 4.5
260 1 7 8 41.432 82.864 0.43 3.09 8 86.9 11.2
261 3 11 3 41.492 82.984 0.43 3.09 8 98.1 14.3
262 2 2 9 41.497 82.994 0.43 3.09 8 77.8 9.0
263 5 1 6 41.503 83.006 0.43 3.09 8 34.0 1.7
264 6 4 2 41.56 83.12 0.431 3.08 8 20.2 0.6
265 2 12 3 41.734 83.468 0.432 3.06 8 48.5 3.5
266 4 4 7 41.735 83.47 0.432 3.06 8 119.3 21.0
267 1 9 7 41.888 83.775 0.433 3.05 8 36.6 2.0
268 5 5 5 41.913 83.827 0.434 3.05 8 67.2 6.6
269 4 8 5 42.005 84.01 0.434 3.04 8 22.1 0.7
270 1 13 2 42.107 84.215 0.435 3.03 8 9.3 0.1
271 3 7 7 42.188 84.376 0.436 3.02 8 41.5 2.5
272 6 0 4 42.57 85.14 0.439 2.99 4 52.1 2.0
273 5 3 6 42.648 85.296 0.44 2.98 8 32.8 1.5
274 1 5 9 42.672 85.345 0.44 2.98 8 49.3 3.5
275 4 10 3 42.757 85.513 0.441 2.97 8 78.7 8.9
276 2 10 6 42.861 85.722 0.442 2.96 8 90.6 11.7
277 5 7 4 42.872 85.745 0.442 2.96 8 92.2 12.1
278 3 5 8 42.877 85.754 0.442 2.96 8 33.0 1.5
279 6 4 3 42.934 85.869 0.442 2.96 8 7.4 0.1
280 0 8 8 42.968 85.937 0.442 2.96 4 74.5 3.9
281 5 9 0 43.052 86.103 0.443 2.95 4 73.6 3.8
282 6 2 4 43.141 86.283 0.444 2.94 8 17.1 0.4
283 3 9 6 43.191 86.382 0.444 2.94 8 28.0 1.1
284 2 4 9 43.213 86.426 0.444 2.94 8 180.8 46.2
285 6 6 0 43.321 86.641 0.445 2.93 4 54.6 2.1
286 5 9 1 43.326 86.651 0.445 2.93 8 18.9 0.5
287 3 11 4 43.415 86.83 0.446 2.92 8 59.0 4.9
288 1 13 3 43.479 86.959 0.447 2.92 8 18.1 0.5
289 4 0 8 43.567 87.134 0.447 2.91 4 79.4 4.4
290 6 6 1 43.594 87.189 0.448 2.91 8 67.4 6.4
291 0 6 9 43.634 87.267 0.448 2.91 4 49.1 1.7
292 2 12 4 43.656 87.311 0.448 2.91 8 19.3 0.5
293 0 12 5 43.69 87.381 0.448 2.9 4 61.1 2.6
294 0 0 10 43.706 87.412 0.449 2.9 2 82.0 2.3
295 0 10 7 43.992 87.983 0.451 2.88 4 29.8 0.6
296 1 11 6 44.032 88.064 0.451 2.88 8 8.5 0.1
297 3 1 9 44.112 88.225 0.452 2.88 8 32.3 1.4
298 4 2 8 44.137 88.274 0.452 2.88 8 28.6 1.1
299 5 9 2 44.147 88.294 0.452 2.88 8 113.4 17.8
300 0 14 0 44.255 88.51 0.453 2.87 2 97.8 3.3
301 0 2 10 44.276 88.552 0.453 2.87 4 46.1 1.5
302 6 6 2 44.416 88.831 0.454 2.86 8 16.6 0.4
303 1 1 10 44.456 88.911 0.455 2.86 8 38.0 2.0
304 0 14 1 44.529 89.057 0.455 2.85 4 72.9 3.6
305 4 6 7 44.589 89.179 0.456 2.85 8 36.5 1.8
306 4 10 4 44.674 89.347 0.456 2.85 8 114.2 17.9
307 6 4 4 44.851 89.702 0.458 2.84 8 9.6 0.1
308 5 5 6 44.928 89.857 0.458 2.83 8 35.6 1.7
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 2 0 5.722 11.443 7.7265 13.0 1.3 1.3 5.6
2 1 1 0 6.566 13.132 6.73637 92.2 8.9 8.9 5.6
3 0 2 1 6.967 13.934 6.35036 10.5 1.0 1.0 5.6
4 1 1 1 7.678 15.356 5.76551 21.9 2.1 2.1 5.6
5 0 0 2 7.943 15.886 5.574 33.6 3.2 3.3 5.6
6 0 2 2 9.811 19.622 4.52046 316.1 30.4 30.5 5.6
7 1 1 2 10.333 20.666 4.29447 313.6 30.2 30.3 5.6
8 1 3 1 11.2 22.4 3.96573 262.2 25.2 25.3 5.6
9 0 4 1 12.182 24.364 3.65028 1038.6 100.0 100.0 5.6
10 1 3 2 13.188 26.376 3.37629 73.8 7.1 7.1 5.6
11 0 2 3 13.298 26.596 3.34883 24.8 2.4 2.4 5.6
12 1 1 3 13.694 27.388 3.25377 112.1 10.8 10.8 5.6
13 2 2 1 13.822 27.644 3.22424 341.5 32.9 32.8 5.6
14 2 0 2 14.354 28.708 3.10711 502.3 48.4 48.2 5.6
15 2 2 2 15.498 30.996 2.88275 636.5 61.3 61.0 5.6
16 1 5 0 15.643 31.286 2.85666 13.8 1.3 1.3 5.6
17 1 3 3 15.994 31.988 2.79556 160.1 15.4 15.3 5.6
18 1 5 1 16.162 32.324 2.76725 114.5 11.0 11.0 5.6
19 2 4 0 16.652 33.304 2.68802 45.3 4.4 4.3 5.6
20 0 4 3 16.715 33.431 2.67815 35.5 3.4 3.4 5.7
21 0 2 4 17.086 34.173 2.62166 134.8 13.0 12.9 5.7
22 2 4 1 17.144 34.288 2.61313 11.5 1.1 1.1 5.7
23 1 1 4 17.404 34.808 2.5753 225.0 21.7 21.5 5.7
24 1 5 2 17.637 35.275 2.54224 29.2 2.8 2.8 5.7
25 0 6 1 17.876 35.752 2.5094 28.7 2.8 2.7 5.7
26 2 2 3 17.978 35.957 2.49559 92.2 8.9 8.8 5.7
27 3 1 0 18.224 36.447 2.4631 12.9 1.2 1.2 5.7
28 2 4 2 18.551 37.101 2.42119 38.1 3.7 3.6 5.7
29 3 1 1 18.679 37.358 2.4051 12.1 1.2 1.1 5.7
30 1 3 4 19.309 38.618 2.32948 27.2 2.6 2.6 5.7
31 1 5 3 19.884 39.767 2.26479 17.0 1.6 1.6 5.7
32 3 3 0 20.062 40.124 2.24546 12.6 1.2 1.2 5.7
33 2 0 4 20.157 40.315 2.23529 67.8 6.5 6.4 5.7
34 3 3 1 20.483 40.966 2.20125 74.4 7.2 7.1 5.7
35 2 2 4 21.022 42.045 2.14723 36.9 3.6 3.5 5.7
36 0 6 3 21.339 42.679 2.11679 146.2 14.1 13.9 5.7
37 1 5 4 22.714 45.428 1.99488 31.3 3.0 3.0 5.7
38 2 6 2 22.859 45.718 1.98287 40.8 3.9 3.8 5.7
39 1 7 2 22.902 45.803 1.9794 32.3 3.1 3.1 5.7
40 1 3 5 22.971 45.942 1.97373 68.2 6.6 6.4 5.7
41 2 4 4 23.461 46.922 1.93476 13.6 1.3 1.3 5.7
42 0 8 0 23.501 47.003 1.93163 34.0 3.3 3.2 5.7
43 3 3 3 23.628 47.257 1.92184 18.2 1.8 1.7 5.7
44 3 5 1 23.75 47.5 1.91256 34.4 3.3 3.2 5.7
45 0 6 4 24.031 48.062 1.89151 29.4 2.8 2.8 5.7
46 4 0 0 24.308 48.616 1.87125 155.1 14.9 14.6 5.7
47 2 2 5 24.476 48.952 1.85917 30.4 2.9 2.9 5.7
48 3 1 4 24.668 49.336 1.84562 28.2 2.7 2.7 5.7
49 2 6 3 24.712 49.425 1.84249 63.2 6.1 5.9 5.7
50 1 7 3 24.752 49.505 1.8397 15.2 1.5 1.4 5.7
51 3 5 2 24.844 49.688 1.83334 22.3 2.2 2.1 5.7
52 1 1 6 25.471 50.942 1.79112 15.2 1.5 1.4 5.8
53 3 3 4 26.137 52.275 1.74854 41.4 4.0 3.9 5.8
54 2 8 0 26.664 53.328 1.71648 17.1 1.6 1.6 5.8
55 2 8 1 27.003 54.007 1.69649 23.1 2.2 2.2 5.8
56 2 6 4 27.148 54.296 1.68815 12.9 1.2 1.2 5.8
57 0 6 5 27.191 54.381 1.68569 86.3 8.3 8.1 5.8
58 1 9 0 27.405 54.809 1.67353 33.7 3.2 3.1 5.8
59 4 4 1 27.553 55.107 1.6652 44.9 4.3 4.2 5.8
60 3 1 5 27.775 55.55 1.65297 31.9 3.1 3.0 5.8
61 3 7 1 28.099 56.198 1.63543 12.5 1.2 1.2 5.8
62 4 2 3 28.135 56.269 1.63353 20.1 1.9 1.9 5.8
63 2 2 6 28.26 56.519 1.62689 15.0 1.4 1.4 5.8
64 1 9 2 28.723 57.445 1.60285 27.5 2.6 2.6 5.8
65 3 7 2 29.076 58.151 1.58506 56.7 5.5 5.3 5.8
66 3 3 5 29.134 58.269 1.58214 27.7 2.7 2.6 5.8
67 0 2 7 29.593 59.186 1.55978 12.5 1.2 1.2 5.8
68 2 8 3 29.625 59.25 1.55827 16.8 1.6 1.6 5.8
69 2 6 5 30.077 60.154 1.53698 45.6 4.4 4.2 5.8
70 0 10 1 30.214 60.428 1.53066 12.6 1.2 1.2 5.8
71 2 4 6 30.263 60.526 1.52841 31.0 3.0 2.9 5.8
72 4 2 4 30.381 60.761 1.52307 39.1 3.8 3.6 5.8
73 0 10 2 31.149 62.298 1.48913 38.6 3.7 3.6 5.8
74 3 1 6 31.285 62.57 1.48331 48.6 4.7 4.5 5.8
75 0 4 7 31.544 63.088 1.47237 40.6 3.9 3.7 5.9
76 3 5 5 31.743 63.485 1.46412 21.6 2.1 2.0 5.9
77 5 1 2 32.351 64.703 1.43948 34.4 3.3 3.2 5.9
78 0 10 3 32.673 65.347 1.42684 25.5 2.5 2.3 5.9
79 3 9 0 32.996 65.993 1.41443 22.6 2.2 2.1 5.9
80 4 6 3 33.327 66.655 1.40198 25.7 2.5 2.4 5.9
81 2 6 6 33.441 66.881 1.39778 11.7 1.1 1.1 5.9
82 5 3 2 33.599 67.197 1.39198 22.8 2.2 2.1 5.9
83 2 10 2 33.829 67.657 1.38363 27.0 2.6 2.5 5.9
84 3 9 2 34.184 68.367 1.37098 21.2 2.0 1.9 5.9
85 0 10 4 34.748 69.495 1.35146 19.1 1.8 1.7 5.9
86 3 5 6 35.019 70.038 1.3423 11.7 1.1 1.1 5.9
87 5 3 3 35.067 70.134 1.3407 44.7 4.3 4.1 5.9
88 0 8 6 35.116 70.232 1.33908 19.3 1.9 1.8 5.9
89 5 5 1 35.162 70.324 1.33754 18.0 1.7 1.6 5.9
90 4 6 4 35.383 70.766 1.33028 15.8 1.5 1.4 5.9
91 5 1 4 35.888 71.776 1.31402 27.2 2.6 2.5 5.9
92 0 4 8 35.989 71.978 1.31083 12.6 1.2 1.1 5.9
93 2 0 8 36.146 72.291 1.30591 14.2 1.4 1.3 5.9
94 0 12 0 36.738 73.476 1.28775 25.3 2.4 2.3 6.0
95 2 6 7 37.212 74.425 1.27367 28.9 2.8 2.6 6.0
96 2 10 4 37.3 74.6 1.27112 25.4 2.4 2.3 6.0
97 3 9 4 37.641 75.281 1.2613 34.3 3.3 3.1 6.0
98 4 6 5 37.953 75.907 1.25244 40.0 3.8 3.6 6.0
99 6 0 0 38.131 76.262 1.2475 13.1 1.3 1.2 6.0
100 5 7 0 38.44 76.881 1.23899 34.3 3.3 3.1 6.0
101 3 5 7 38.726 77.452 1.23128 15.7 1.5 1.4 6.0
102 0 8 7 38.819 77.638 1.22879 14.3 1.4 1.3 6.0
103 3 11 0 38.995 77.99 1.22412 12.2 1.2 1.1 6.0
104 6 0 2 39.252 78.504 1.21738 31.8 3.1 2.9 6.0
105 5 5 4 39.422 78.845 1.21298 17.5 1.7 1.6 6.0
106 2 12 1 39.52 79.039 1.21048 20.7 2.0 1.9 6.0
107 2 12 2 40.353 80.706 1.18963 26.3 2.5 2.3 6.1
108 6 4 1 40.732 81.464 1.18047 20.7 2.0 1.8 6.1
109 2 8 7 41.284 82.567 1.16747 19.0 1.8 1.7 6.1
110 4 10 2 41.381 82.763 1.1652 19.5 1.9 1.7 6.1
111 1 7 8 41.432 82.864 1.16403 11.2 1.1 1.0 6.1
112 3 11 3 41.492 82.984 1.16266 25.0 2.4 2.2 6.1
113 4 4 7 41.735 83.47 1.15712 24.4 2.4 2.2 6.1
114 5 7 4 42.872 85.745 1.13216 25.4 2.4 2.2 6.1
115 2 4 9 43.213 86.426 1.12497 47.3 4.6 4.2 6.1
116 6 6 1 43.594 87.189 1.11708 10.8 1.0 0.9 6.2
117 5 9 2 44.147 88.294 1.10592 17.8 1.7 1.6 6.2
118 4 10 4 44.674 89.347 1.0956 17.9 1.7 1.6 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
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