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 ***
***********************
SVERIGEITE
1
Na(Mn'',Mg)(2)Sn''''[Be(2)Si(3)O(12)(OH)]
Orthorhombic I mma Z = 4
R =0.054 NR =571
23 .7 .1990
Ref.Str.:
R.C.Rouse, D.R.Peacor, G.W.Metz (1989)
* Amer. Mineral., 74, 1343-1350
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 10.815 alpha = 90.0
b = 13.273 beta = 90.0
c = 6.818 gamma = 90.0
Unit cell volume (cub. angs.) = 978.71
Molar volume ( cub.cm/mol.) = 147.38
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.0 0.0 0.0 Sn = 1.00
2 0.25 0.6291 0.25 0.0 Mn = 0.38, Mg = 0.62
3 0.0 0.0 0.5 0.0 Na = 1.00
4 0.25 0.0832 0.25 0.0 Si = 1.00
5 0.0 0.25 0.8606 0.0 Si = 1.00
6 0.6353 0.25 0.0262 0.0 Be = 1.00
7 0.7855 0.1479 0.4421 0.0 O = 1.00
8 0.8664 0.0021 0.213 0.0 O = 1.00
9 0.1213 0.25 0.7211 0.0 O = 1.00
10 0.0 0.3501 0.9932 0.0 O = 1.00
11 0.0 0.25 0.3834 0.0 OH = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.0 0.0
2 2 0.25 0.6291 0.25
3 3 0.0 0.0 0.5
4 4 0.25 0.0832 0.25
5 5 0.0 0.25 0.8606
6 6 0.6353 0.25 0.0262
7 7 0.7855 0.1479 0.4421
8 8 0.8664 0.0021 0.213
9 9 0.1213 0.25 0.7211
10 10 0.0 0.3501 0.9932
11 11 0.0 0.25 0.3834
12 1 0.5 0.0 0.5
13 2 0.25 0.3709 0.75
14 3 0.5 0.0 0.0
15 4 0.25 0.9168 0.75
16 5 0.5 0.75 0.3606
17 6 0.8647 0.75 0.5262
18 7 0.7145 0.8521 0.9421
19 8 0.6336 0.9979 0.713
20 9 0.3787 0.75 0.2211
21 10 0.5 0.6499 0.4932
22 11 0.5 0.75 0.8834
23 2 0.75 0.6291 0.25
24 4 0.75 0.0832 0.25
25 6 0.3647 0.25 0.0262
26 7 0.2145 0.1479 0.4421
27 8 0.1336 0.0021 0.213
28 9 0.8787 0.25 0.7211
29 2 0.75 0.3709 0.75
30 4 0.75 0.9168 0.75
31 6 0.1353 0.75 0.5262
32 7 0.2855 0.8521 0.9421
33 8 0.3664 0.9979 0.713
34 9 0.6213 0.75 0.2211
35 5 0.5 0.25 0.6394
36 6 0.1353 0.25 0.4738
37 7 0.2855 0.1479 0.0579
38 8 0.3664 0.0021 0.287
39 9 0.6213 0.25 0.7789
40 10 0.5 0.3501 0.5068
41 11 0.5 0.25 0.1166
42 5 0.0 0.75 0.1394
43 6 0.3647 0.75 0.9738
44 7 0.2145 0.8521 0.5579
45 8 0.1336 0.9979 0.787
46 9 0.8787 0.75 0.2789
47 10 0.0 0.6499 0.0068
48 11 0.0 0.75 0.6166
49 6 0.8647 0.25 0.4738
50 7 0.7145 0.1479 0.0579
51 8 0.6336 0.0021 0.287
52 9 0.3787 0.25 0.7789
53 6 0.6353 0.75 0.9738
54 7 0.7855 0.8521 0.5579
55 8 0.8664 0.9979 0.787
56 9 0.1213 0.75 0.2789
57 1 0.0 0.5 0.0
58 2 0.75 0.8709 0.25
59 3 0.0 0.5 0.5
60 4 0.75 0.4168 0.25
61 7 0.2145 0.3521 0.4421
62 8 0.1336 0.4979 0.213
63 10 0.0 0.1499 0.9932
64 1 0.5 0.5 0.5
65 2 0.75 0.1291 0.75
66 3 0.5 0.5 0.0
67 4 0.75 0.5832 0.75
68 7 0.2855 0.6479 0.9421
69 8 0.3664 0.5021 0.713
70 10 0.5 0.8501 0.4932
71 2 0.25 0.8709 0.25
72 4 0.25 0.4168 0.25
73 7 0.7855 0.3521 0.4421
74 8 0.8664 0.4979 0.213
75 2 0.25 0.1291 0.75
76 4 0.25 0.5832 0.75
77 7 0.7145 0.6479 0.9421
78 8 0.6336 0.5021 0.713
79 7 0.7145 0.3521 0.0579
80 8 0.6336 0.4979 0.287
81 10 0.5 0.1499 0.5068
82 7 0.7855 0.6479 0.5579
83 8 0.8664 0.5021 0.787
84 10 0.0 0.8501 0.0068
85 7 0.2855 0.3521 0.0579
86 8 0.3664 0.4979 0.287
87 7 0.2145 0.6479 0.5579
88 8 0.1336 0.5021 0.787
X-ray density (g/cm cub.) = 3.56
MU (1/cm) = 349.596 Mass attenuation coefficient (cm**2/g) = 98.236
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Sn 2.904 6
2.0488 8
2.0488 8
2.0488 8
2.0488 8
1.9902 10
1.9902 10
2 Mn ,Mg 2.772 6
2.1334 9
2.1334 9
2.1635 8
2.1486 7
2.1635 8
2.1486 7
3 Na 2.856 4
2.4326 8
2.4326 8
2.4326 8
2.4326 8
4 Si 2.148 4
1.6125 7
1.6754 8
1.6125 7
1.6754 8
5 Si 2.148 4
1.6204 9
1.607 10
1.6204 9
1.607 10
6 Be 2.088 4
1.6929 9
1.5878 11
1.6177 7
1.6177 7
7 O 3.312 10
2.6364 8
2.7163 11
3.174 8
2.5438 9
3.2036 9
2.7297 7
2.7499 8
3.203 8
2.7103 7
3.1191 10
8 O 3.312 9
2.6364 7
3.174 7
2.8898 8
2.7499 7
2.5678 8
3.203 7
2.905 8
2.8604 10
2.8521 10
9 O 3.312 9
2.6321 10
2.6499 11
2.5438 7
2.6237 9
3.2036 7
2.8115 9
2.5438 7
2.6321 10
3.2036 7
10 O 3.312 10
2.6321 9
2.9737 11
2.6321 9
2.8604 8
2.6573 10
2.8604 8
3.1191 7
2.8521 8
3.1191 7
2.8521 8
11 OH 3.36 8
2.7163 7
2.6499 9
2.9737 10
2.7163 7
2.6499 9
2.7163 7
2.9737 10
2.7163 7
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 6.665 13.33 0.075 145.5 2 175.3 933.6
2 0 1 1 7.297 14.594 0.082 121.02 4 78.6 312.0
3 1 0 1 7.675 15.35 0.087 109.18 4 186.7 1589.0
4 2 0 0 8.189 16.379 0.092 95.62 2 23.8 11.3
5 1 2 1 10.192 20.383 0.115 60.97 8 162.1 1338.1
6 2 2 0 10.588 21.176 0.119 56.33 4 101.3 241.3
7 2 1 1 11.002 22.005 0.124 52.01 8 14.9 9.7
8 0 3 1 11.979 23.957 0.135 43.55 4 102.0 189.4
9 0 0 2 13.059 26.118 0.147 36.32 2 13.2 1.3
10 0 4 0 13.423 26.846 0.151 34.27 2 173.2 214.7
11 3 0 1 13.987 27.974 0.157 31.4 4 256.8 864.5
12 1 1 2 14.118 28.236 0.158 30.78 8 74.1 141.1
13 2 3 1 14.58 29.159 0.163 28.74 8 9.9 2.3
14 0 2 2 14.716 29.431 0.165 28.18 4 75.6 67.2
15 2 0 2 15.492 30.984 0.173 25.23 4 373.9 1472.8
16 1 4 1 15.534 31.068 0.174 25.09 8 114.5 274.6
17 3 2 1 15.553 31.105 0.174 25.02 8 53.0 58.7
18 2 4 0 15.804 31.609 0.177 24.17 4 435.8 1917.2
19 4 0 0 16.552 33.105 0.185 21.87 2 398.5 725.3
20 2 2 2 16.932 33.864 0.189 20.82 8 254.8 1128.9
21 1 3 2 17.098 34.196 0.191 20.38 8 49.7 42.1
22 4 2 0 17.916 35.833 0.2 18.4 4 109.3 91.8
23 0 5 1 18.143 36.286 0.202 17.9 4 37.6 10.6
24 4 1 1 18.175 36.35 0.202 17.83 8 6.9 0.7
25 3 1 2 18.442 36.885 0.205 17.27 8 40.9 24.2
26 0 4 2 18.902 37.804 0.21 16.36 4 128.4 112.7
27 3 4 1 19.58 39.16 0.218 15.13 8 57.6 41.9
28 2 5 1 20.024 40.049 0.222 14.4 8 103.8 129.7
29 0 1 3 20.113 40.225 0.223 14.26 4 128.5 98.3
30 1 0 3 20.263 40.527 0.225 14.02 4 105.6 65.3
31 0 6 0 20.377 40.755 0.226 13.85 2 190.9 105.4
32 4 3 1 20.639 41.278 0.229 13.46 8 6.9 0.5
33 2 4 2 20.725 41.45 0.23 13.33 8 67.0 50.0
34 3 3 2 20.879 41.759 0.231 13.11 8 72.5 57.6
35 4 0 2 21.323 42.645 0.236 12.51 4 184.5 177.8
36 1 2 3 21.424 42.848 0.237 12.38 8 89.8 83.4
37 4 4 0 21.561 43.122 0.239 12.2 4 97.6 48.6
38 2 1 3 21.851 43.703 0.242 11.84 8 87.3 75.4
39 1 6 1 21.897 43.794 0.242 11.79 8 157.5 244.2
40 5 0 1 21.938 43.877 0.243 11.74 4 104.5 53.5
41 1 5 2 22.0 43.999 0.243 11.66 8 32.4 10.2
42 2 6 0 22.099 44.198 0.244 11.55 4 154.0 114.3
43 0 3 3 22.398 44.795 0.247 11.2 4 31.4 4.6
44 4 2 2 22.439 44.877 0.248 11.15 8 176.5 290.3
45 5 2 1 23.031 46.061 0.254 10.52 8 94.7 78.7
46 3 0 3 23.62 47.239 0.26 9.93 4 192.3 153.4
47 2 3 3 24.003 48.007 0.264 9.58 8 6.8 0.4
48 0 6 2 24.525 49.05 0.269 9.12 4 263.2 263.8
49 1 4 3 24.641 49.282 0.271 9.02 8 46.1 16.0
50 3 2 3 24.654 49.308 0.271 9.01 8 158.1 188.2
51 0 7 1 24.939 49.878 0.274 8.78 4 75.1 20.7
52 4 5 1 24.964 49.928 0.274 8.76 8 104.3 79.6
53 3 6 1 25.079 50.158 0.275 8.67 8 136.6 135.0
54 3 5 2 25.172 50.343 0.276 8.6 8 85.0 51.9
55 5 1 2 25.197 50.393 0.276 8.58 8 97.1 67.5
56 6 0 0 25.299 50.598 0.277 8.5 2 110.2 21.5
57 4 4 2 25.556 51.113 0.28 8.3 8 314.6 686.4
58 2 6 2 26.031 52.061 0.285 7.96 8 121.4 98.1
59 5 4 1 26.094 52.189 0.286 7.92 8 145.9 140.9
60 6 2 0 26.284 52.568 0.287 7.79 4 103.5 34.9
61 2 7 1 26.427 52.855 0.289 7.69 8 3.8 0.1
62 6 1 1 26.476 52.951 0.289 7.66 8 12.9 1.1
63 0 5 3 26.499 52.997 0.29 7.65 4 129.6 53.6
64 4 1 3 26.523 53.045 0.29 7.63 8 16.9 1.8
65 4 6 0 26.737 53.474 0.292 7.49 4 102.8 33.1
66 0 0 4 26.866 53.733 0.293 7.41 2 391.4 237.0
67 5 3 2 27.147 54.294 0.296 7.24 8 42.3 10.8
68 1 1 4 27.462 54.923 0.299 7.05 8 29.6 5.2
69 3 4 3 27.584 55.168 0.301 6.98 8 81.3 38.5
70 0 8 0 27.663 55.326 0.301 6.93 2 414.0 248.2
71 0 2 4 27.812 55.625 0.303 6.85 4 235.2 158.3
72 2 5 3 27.928 55.856 0.304 6.78 8 154.1 134.5
73 1 7 2 28.052 56.104 0.305 6.72 8 42.7 10.2
74 2 0 4 28.283 56.566 0.308 6.59 4 12.0 0.4
75 6 3 1 28.364 56.728 0.308 6.55 8 5.0 0.1
76 4 3 3 28.409 56.818 0.309 6.53 8 36.8 7.4
77 1 8 1 28.888 57.776 0.314 6.29 8 119.7 75.2
78 6 0 2 28.908 57.815 0.314 6.28 4 319.1 266.9
79 2 8 0 29.054 58.108 0.315 6.2 4 145.1 54.6
80 6 4 0 29.099 58.198 0.316 6.18 4 333.4 287.1
81 2 2 4 29.199 58.397 0.317 6.14 8 168.3 145.1
82 1 3 4 29.307 58.615 0.318 6.08 8 4.2 0.1
83 1 6 3 29.414 58.828 0.319 6.03 8 117.1 69.1
84 5 0 3 29.447 58.895 0.319 6.02 4 105.5 28.0
85 6 2 2 29.811 59.622 0.323 5.86 8 161.3 127.3
86 3 1 4 30.214 60.428 0.327 5.68 8 54.8 14.2
87 4 6 2 30.229 60.457 0.327 5.68 8 300.2 427.2
88 5 2 3 30.341 60.681 0.328 5.63 8 150.5 106.5
89 0 4 4 30.534 61.067 0.33 5.55 4 41.0 3.9
90 4 7 1 30.589 61.178 0.33 5.53 8 2.2 0.0
91 5 6 1 30.711 61.423 0.332 5.48 8 65.5 19.6
92 7 0 1 30.744 61.488 0.332 5.47 4 199.0 90.4
93 3 7 2 30.771 61.541 0.332 5.46 8 53.0 12.8
94 5 5 2 30.792 61.585 0.332 5.45 8 16.0 1.2
95 0 8 2 31.087 62.173 0.335 5.33 4 68.3 10.4
96 3 8 1 31.562 63.123 0.34 5.16 8 141.0 85.6
97 7 2 1 31.615 63.231 0.34 5.14 8 98.2 41.4
98 2 4 4 31.846 63.692 0.342 5.06 8 198.7 166.8
99 6 5 1 31.921 63.843 0.343 5.03 8 96.9 39.5
100 0 7 3 31.942 63.884 0.343 5.03 4 33.0 2.3
101 3 3 4 31.96 63.92 0.344 5.02 8 15.2 1.0
102 4 5 3 31.963 63.926 0.344 5.02 8 153.9 99.3
103 3 6 3 32.061 64.122 0.345 4.99 8 189.7 149.8
104 4 0 4 32.291 64.581 0.347 4.91 4 219.7 98.9
105 0 9 1 32.302 64.604 0.347 4.91 4 147.2 44.4
106 2 8 2 32.386 64.772 0.348 4.88 8 189.2 145.8
107 6 4 2 32.429 64.857 0.348 4.86 8 19.3 1.5
108 1 5 4 32.803 65.606 0.352 4.75 8 4.7 0.1
109 5 4 3 32.934 65.868 0.353 4.7 8 92.1 33.3
110 4 8 0 33.005 66.01 0.354 4.68 4 169.6 56.3
111 4 2 4 33.139 66.279 0.355 4.64 8 212.2 174.5
112 2 7 3 33.223 66.446 0.356 4.62 8 5.3 0.1
113 6 1 3 33.265 66.53 0.356 4.61 8 40.8 6.4
114 7 1 2 33.397 66.795 0.357 4.57 8 15.1 0.9
115 6 6 0 33.452 66.904 0.358 4.55 4 187.3 66.7
116 2 9 1 33.576 67.152 0.359 4.52 8 93.4 32.9
117 7 4 1 34.155 68.311 0.364 4.36 8 44.0 7.0
118 0 1 5 34.601 69.202 0.369 4.24 4 30.2 1.6
119 1 0 5 34.706 69.411 0.37 4.22 4 143.3 36.2
120 8 0 0 34.735 69.471 0.37 4.21 2 430.3 162.8
121 0 6 4 34.785 69.57 0.37 4.2 4 168.1 49.5
122 6 3 3 34.928 69.855 0.372 4.16 8 14.2 0.7
123 1 9 2 34.996 69.992 0.372 4.15 8 46.3 7.4
124 7 3 2 35.057 70.115 0.373 4.13 8 54.3 10.2
125 3 5 4 35.309 70.619 0.375 4.07 8 0.4 0.0
126 5 1 4 35.33 70.659 0.375 4.07 8 15.6 0.8
127 1 8 3 35.396 70.791 0.376 4.05 8 67.2 15.3
128 0 10 0 35.474 70.948 0.377 4.03 2 50.6 2.2
129 1 2 5 35.526 71.052 0.377 4.02 8 142.6 68.3
130 8 2 0 35.555 71.111 0.377 4.02 4 136.6 31.3
131 4 4 4 35.625 71.249 0.378 4.0 8 80.3 21.6
132 8 1 1 35.716 71.432 0.379 3.98 8 63.6 13.4
133 2 1 5 35.835 71.67 0.38 3.95 8 1.7 0.0
134 5 7 2 35.844 71.688 0.38 3.95 8 39.9 5.3
135 2 6 4 36.016 72.032 0.382 3.92 8 251.1 206.1
136 4 8 2 36.137 72.274 0.383 3.89 8 177.4 102.3
137 0 3 5 36.236 72.471 0.384 3.87 4 14.9 0.4
138 1 10 1 36.549 73.097 0.387 3.81 8 93.0 27.5
139 6 6 2 36.566 73.132 0.387 3.8 8 91.1 26.4
140 5 8 1 36.579 73.157 0.387 3.8 8 102.7 33.5
141 2 10 0 36.696 73.391 0.388 3.78 4 105.1 17.4
142 6 7 1 36.894 73.789 0.39 3.74 8 0.4 0.0
143 4 7 3 36.934 73.867 0.39 3.73 8 30.0 2.8
144 5 3 4 36.951 73.901 0.39 3.73 8 40.6 5.1
145 5 6 3 37.045 74.09 0.391 3.71 8 142.7 63.2
146 7 0 3 37.075 74.15 0.391 3.71 4 95.1 14.0
147 3 0 5 37.153 74.306 0.392 3.69 4 98.6 15.0
148 4 9 1 37.271 74.541 0.393 3.67 8 109.3 36.6
149 8 3 1 37.33 74.661 0.394 3.66 8 51.7 8.2
150 3 9 2 37.436 74.872 0.395 3.64 8 30.4 2.8
151 2 3 5 37.447 74.894 0.395 3.64 8 51.6 8.1
152 1 7 4 37.721 75.442 0.397 3.59 8 2.7 0.0
153 8 0 2 37.803 75.607 0.398 3.58 4 27.1 1.1
154 3 8 3 37.825 75.65 0.398 3.57 8 118.1 41.6
155 7 2 3 37.874 75.749 0.399 3.56 8 76.1 17.2
156 1 4 5 37.942 75.884 0.399 3.55 8 87.1 22.5
157 3 2 5 37.952 75.904 0.399 3.55 8 35.1 3.7
158 8 4 0 37.971 75.941 0.399 3.55 4 153.4 34.9
159 6 5 3 38.157 76.313 0.401 3.52 8 91.8 24.8
160 7 6 1 38.209 76.417 0.401 3.51 8 165.5 80.3
161 7 5 2 38.282 76.564 0.402 3.5 8 69.0 13.9
162 6 0 4 38.46 76.92 0.404 3.47 4 6.0 0.1
163 0 9 3 38.509 77.018 0.404 3.46 4 170.3 41.9
164 0 10 2 38.519 77.038 0.404 3.46 4 41.9 2.5
165 8 2 2 38.598 77.195 0.405 3.45 8 86.6 21.6
166 3 10 1 38.951 77.902 0.408 3.4 8 13.2 0.5
167 6 8 0 39.124 78.248 0.41 3.37 4 163.7 37.7
168 6 2 4 39.25 78.5 0.411 3.35 8 153.9 66.3
169 0 5 5 39.424 78.848 0.412 3.33 4 60.1 5.0
170 4 1 5 39.444 78.887 0.412 3.33 8 26.7 2.0
171 4 6 4 39.619 79.238 0.414 3.3 8 150.3 62.3
172 2 9 3 39.697 79.393 0.415 3.29 8 155.6 66.6
173 2 10 2 39.707 79.413 0.415 3.29 8 169.5 79.0
174 3 7 4 40.101 80.201 0.418 3.24 8 16.2 0.7
175 5 5 4 40.12 80.24 0.418 3.24 8 69.9 13.2
176 7 4 3 40.241 80.483 0.419 3.22 8 9.5 0.2
177 4 10 0 40.278 80.556 0.42 3.22 4 46.3 2.9
178 3 4 5 40.318 80.635 0.42 3.22 8 67.2 12.1
179 0 8 4 40.383 80.766 0.421 3.21 4 198.6 52.8
180 0 11 1 40.413 80.826 0.421 3.2 4 30.8 1.3
181 8 5 1 40.49 80.981 0.421 3.2 8 54.0 7.8
182 2 5 5 40.605 81.209 0.422 3.18 8 17.1 0.8
183 9 0 1 40.609 81.217 0.423 3.18 4 85.8 9.8
184 8 4 2 40.953 81.906 0.425 3.14 8 166.4 72.7
185 4 3 5 41.009 82.018 0.426 3.14 8 5.0 0.1
186 9 2 1 41.388 82.776 0.429 3.1 8 96.5 24.1
187 2 8 4 41.557 83.115 0.431 3.08 8 64.1 10.6
188 2 11 1 41.587 83.174 0.431 3.08 8 86.9 19.4
189 6 4 4 41.596 83.192 0.431 3.08 8 183.9 86.9
190 8 1 3 41.721 83.442 0.432 3.06 8 28.0 2.0
191 1 6 5 41.866 83.732 0.433 3.05 8 157.8 63.5
192 8 6 0 41.894 83.789 0.433 3.05 4 67.0 5.7
193 5 0 5 41.895 83.79 0.433 3.05 4 122.5 19.1
194 6 8 2 42.086 84.171 0.435 3.03 8 163.5 67.7
195 5 9 2 42.169 84.338 0.436 3.02 8 69.5 12.2
196 7 1 4 42.485 84.969 0.438 3.0 8 24.1 1.5
197 1 10 3 42.518 85.036 0.439 2.99 8 73.3 13.4
198 5 8 3 42.547 85.094 0.439 2.99 8 83.4 17.4
199 5 2 5 42.671 85.341 0.44 2.98 8 45.9 5.2
200 0 0 6 42.677 85.354 0.44 2.98 2 8.2 0.0
201 6 7 3 42.851 85.701 0.441 2.97 8 10.2 0.3
202 1 11 2 42.915 85.83 0.442 2.96 8 43.5 4.7
203 7 7 2 42.973 85.946 0.442 2.96 8 45.2 5.0
204 9 1 2 43.011 86.022 0.443 2.95 8 55.4 7.6
205 1 1 6 43.162 86.324 0.444 2.94 8 31.6 2.5
206 6 9 1 43.176 86.352 0.444 2.94 8 97.7 23.4
207 4 9 3 43.213 86.427 0.444 2.94 8 104.4 26.8
208 4 10 2 43.223 86.446 0.445 2.94 8 111.0 30.3
209 8 3 3 43.271 86.542 0.445 2.93 8 37.7 3.5
210 0 2 6 43.451 86.901 0.446 2.92 4 92.7 10.5
211 5 10 1 43.646 87.292 0.448 2.91 8 83.1 16.8
212 7 8 1 43.675 87.349 0.448 2.91 8 120.7 35.4
213 9 4 1 43.713 87.426 0.449 2.9 8 112.0 30.4
214 2 0 6 43.842 87.684 0.45 2.89 4 304.1 111.8
215 1 9 4 43.974 87.948 0.451 2.89 8 21.2 1.1
216 7 3 4 44.031 88.063 0.451 2.88 8 19.7 0.9
217 0 7 5 44.09 88.18 0.452 2.88 4 1.1 0.0
218 4 5 5 44.109 88.219 0.452 2.88 8 81.3 15.9
219 7 6 3 44.122 88.245 0.452 2.88 8 119.4 34.2
220 0 12 0 44.139 88.278 0.452 2.88 2 253.4 38.6
221 3 6 5 44.198 88.395 0.453 2.87 8 53.7 6.9
222 9 3 2 44.557 89.113 0.455 2.85 8 23.1 1.3
223 2 2 6 44.614 89.228 0.456 2.85 8 133.3 42.2
224 1 3 6 44.707 89.414 0.457 2.84 8 44.2 4.6
225 5 7 4 44.775 89.549 0.457 2.84 8 29.5 2.1
226 8 6 2 44.826 89.651 0.458 2.84 8 167.1 66.2
227 3 10 3 44.846 89.693 0.458 2.84 8 96.2 21.9
228 5 4 5 44.989 89.977 0.459 2.83 8 63.7 9.6
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 6.665 13.33 6.6365 933.6 48.7 49.3 5.6
2 0 1 1 7.297 14.594 6.06467 312.0 16.3 16.5 5.6
3 1 0 1 7.675 15.35 5.76756 1589.0 82.9 83.9 5.6
4 1 2 1 10.192 20.383 4.35331 1338.1 69.8 70.4 5.6
5 2 2 0 10.588 21.176 4.19209 241.3 12.6 12.7 5.6
6 0 3 1 11.979 23.957 3.71139 189.4 9.9 9.9 5.6
7 0 4 0 13.423 26.846 3.31825 214.7 11.2 11.2 5.6
8 3 0 1 13.987 27.974 3.18693 864.5 45.1 45.2 5.6
9 1 1 2 14.118 28.236 3.15794 141.1 7.4 7.4 5.6
10 0 2 2 14.716 29.431 3.03234 67.2 3.5 3.5 5.6
11 2 0 2 15.492 30.984 2.88378 1472.8 76.8 76.9 5.6
12 1 4 1 15.534 31.068 2.8762 333.3 17.4 17.4 5.6
13 2 4 0 15.804 31.609 2.82822 1917.2 100.0 100.0 5.6
14 4 0 0 16.552 33.105 2.70375 725.3 37.8 37.8 5.6
15 2 2 2 16.932 33.864 2.64487 1128.9 58.9 58.8 5.7
16 1 3 2 17.098 34.196 2.61995 42.1 2.2 2.2 5.7
17 4 2 0 17.916 35.833 2.50392 91.8 4.8 4.8 5.7
18 3 1 2 18.442 36.885 2.43489 24.2 1.3 1.3 5.7
19 0 4 2 18.902 37.804 2.37779 112.7 5.9 5.8 5.7
20 3 4 1 19.58 39.16 2.29852 41.9 2.2 2.2 5.7
21 2 5 1 20.024 40.049 2.24951 129.7 6.8 6.7 5.7
22 0 1 3 20.113 40.225 2.24007 98.3 5.1 5.1 5.7
23 1 0 3 20.263 40.527 2.22409 65.3 3.4 3.4 5.7
24 0 6 0 20.377 40.755 2.21217 105.4 5.5 5.5 5.7
25 2 4 2 20.725 41.45 2.17665 50.0 2.6 2.6 5.7
26 3 3 2 20.879 41.759 2.16127 57.6 3.0 3.0 5.7
27 4 0 2 21.323 42.645 2.11836 177.8 9.3 9.2 5.7
28 1 2 3 21.424 42.848 2.10882 83.4 4.4 4.3 5.7
29 4 4 0 21.561 43.122 2.09604 48.6 2.5 2.5 5.7
30 2 1 3 21.851 43.703 2.06952 75.4 3.9 3.9 5.7
31 1 6 1 21.897 43.794 2.06545 244.2 12.7 12.6 5.7
32 5 0 1 21.938 43.877 2.06173 53.5 2.8 2.8 5.7
33 2 6 0 22.099 44.198 2.04746 114.3 6.0 5.9 5.7
34 4 2 2 22.439 44.877 2.01805 290.3 15.1 14.9 5.7
35 5 2 1 23.031 46.061 1.96891 78.7 4.1 4.0 5.7
36 3 0 3 23.62 47.239 1.92252 153.4 8.0 7.9 5.7
37 0 6 2 24.525 49.05 1.85569 263.8 13.8 13.5 5.7
38 3 2 3 24.654 49.308 1.8466 204.2 10.7 10.5 5.7
39 4 5 1 24.964 49.928 1.8251 100.3 5.2 5.1 5.7
40 3 6 1 25.079 50.158 1.81727 135.0 7.0 6.9 5.7
41 5 1 2 25.197 50.393 1.80933 119.4 6.2 6.1 5.8
42 6 0 0 25.299 50.598 1.8025 21.5 1.1 1.1 5.8
43 4 4 2 25.556 51.113 1.78553 686.4 35.8 35.1 5.8
44 2 6 2 26.031 52.061 1.75522 98.1 5.1 5.0 5.8
45 5 4 1 26.094 52.189 1.75123 140.9 7.3 7.2 5.8
46 6 2 0 26.284 52.568 1.73948 34.9 1.8 1.8 5.8
47 0 5 3 26.499 52.997 1.72641 56.5 2.9 2.9 5.8
48 4 6 0 26.737 53.474 1.71212 33.1 1.7 1.7 5.8
49 0 0 4 26.866 53.733 1.7045 237.0 12.4 12.1 5.8
50 3 4 3 27.584 55.168 1.66349 38.5 2.0 2.0 5.8
51 0 8 0 27.663 55.326 1.65912 248.2 12.9 12.6 5.8
52 0 2 4 27.812 55.625 1.65092 158.3 8.3 8.0 5.8
53 2 5 3 27.928 55.856 1.64462 134.5 7.0 6.8 5.8
54 6 0 2 28.908 57.815 1.59347 342.0 17.8 17.3 5.8
55 2 8 0 29.054 58.108 1.58615 54.6 2.8 2.8 5.8
56 6 4 0 29.099 58.198 1.5839 287.1 15.0 14.5 5.8
57 2 2 4 29.199 58.397 1.57897 145.1 7.6 7.3 5.8
58 1 6 3 29.414 58.828 1.56844 69.1 3.6 3.5 5.8
59 5 0 3 29.447 58.895 1.56681 28.0 1.5 1.4 5.8
60 6 2 2 29.811 59.622 1.54943 127.3 6.6 6.4 5.8
61 4 6 2 30.229 60.457 1.53 441.4 23.0 22.3 5.8
62 5 2 3 30.341 60.681 1.52489 106.5 5.6 5.4 5.8
63 5 6 1 30.711 61.423 1.50825 19.6 1.0 1.0 5.8
64 7 0 1 30.744 61.488 1.5068 103.3 5.4 5.2 5.8
65 3 8 1 31.562 63.123 1.47164 85.6 4.5 4.3 5.9
66 7 2 1 31.615 63.231 1.4694 41.4 2.2 2.1 5.9
67 2 4 4 31.846 63.692 1.45987 166.8 8.7 8.4 5.9
68 6 5 1 31.921 63.843 1.45678 41.8 2.2 2.1 5.9
69 4 5 3 31.963 63.926 1.45508 99.3 5.2 5.0 5.9
70 3 6 3 32.061 64.122 1.4511 149.8 7.8 7.5 5.9
71 4 0 4 32.291 64.581 1.44189 143.3 7.5 7.2 5.9
72 2 8 2 32.386 64.772 1.4381 145.8 7.6 7.3 5.9
73 5 4 3 32.934 65.868 1.41681 33.3 1.7 1.7 5.9
74 4 8 0 33.005 66.01 1.41411 56.3 2.9 2.8 5.9
75 4 2 4 33.139 66.279 1.40902 174.5 9.1 8.7 5.9
76 6 6 0 33.452 66.904 1.39736 66.7 3.5 3.3 5.9
77 2 9 1 33.576 67.152 1.39281 32.9 1.7 1.6 5.9
78 1 0 5 34.706 69.411 1.35289 36.2 1.9 1.8 5.9
79 8 0 0 34.735 69.471 1.35187 162.8 8.5 8.1 5.9
80 0 6 4 34.785 69.57 1.35019 49.5 2.6 2.5 5.9
81 1 2 5 35.526 71.052 1.32562 99.6 5.2 4.9 5.9
82 4 4 4 35.625 71.249 1.32243 21.6 1.1 1.1 5.9
83 2 6 4 36.016 72.032 1.30997 206.1 10.8 10.2 5.9
84 4 8 2 36.137 72.274 1.30619 102.3 5.3 5.1 5.9
85 1 10 1 36.549 73.097 1.29349 53.9 2.8 2.7 6.0
86 5 8 1 36.579 73.157 1.29258 33.5 1.7 1.7 6.0
87 5 6 3 37.045 74.09 1.27859 63.2 3.3 3.1 6.0
88 4 9 1 37.271 74.541 1.27197 36.6 1.9 1.8 6.0
89 3 8 3 37.825 75.65 1.25606 42.7 2.2 2.1 6.0
90 8 4 0 37.971 75.941 1.25196 61.0 3.2 3.0 6.0
91 6 5 3 38.157 76.313 1.24679 24.8 1.3 1.2 6.0
92 7 6 1 38.209 76.417 1.24535 80.3 4.2 3.9 6.0
93 0 9 3 38.509 77.018 1.23713 44.5 2.3 2.2 6.0
94 8 2 2 38.598 77.195 1.23473 21.6 1.1 1.1 6.0
95 6 8 0 39.124 78.248 1.22072 37.7 2.0 1.8 6.0
96 6 2 4 39.25 78.5 1.21744 66.3 3.5 3.2 6.0
97 4 6 4 39.619 79.238 1.20795 62.3 3.3 3.0 6.0
98 2 10 2 39.707 79.413 1.20572 145.6 7.6 7.1 6.0
99 0 8 4 40.383 80.766 1.1889 54.1 2.8 2.6 6.1
100 8 4 2 40.953 81.906 1.17521 72.7 3.8 3.5 6.1
101 9 2 1 41.388 82.776 1.16505 24.1 1.3 1.2 6.1
102 6 4 4 41.596 83.192 1.16028 116.9 6.1 5.6 6.1
103 1 6 5 41.866 83.732 1.15416 88.3 4.6 4.3 6.1
104 6 8 2 42.086 84.171 1.14926 67.7 3.5 3.3 6.1
105 5 8 3 42.547 85.094 1.13914 30.8 1.6 1.5 6.1
106 6 9 1 43.176 86.352 1.12575 25.9 1.4 1.2 6.1
107 4 10 2 43.223 86.446 1.12475 57.0 3.0 2.7 6.1
108 7 8 1 43.675 87.349 1.11544 52.1 2.7 2.5 6.2
109 9 4 1 43.713 87.426 1.11466 30.4 1.6 1.5 6.2
110 2 0 6 43.842 87.684 1.11205 111.8 5.8 5.3 6.2
111 0 12 0 44.139 88.278 1.10608 88.7 4.6 4.2 6.2
112 2 2 6 44.614 89.228 1.09675 42.2 2.2 2.0 6.2
113 8 6 2 44.826 89.651 1.09267 88.1 4.6 4.2 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)
|