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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MILARITE
5, td--osumilite, Zn-Mn-analogue
K(Mn,Fe)(2)(Zn,Mn)(3)Si(12)O(30)
Hexagonal P 6cc Z = 2
R =0.144 NR =200
8 .12 .1992
Ref.Str.:
Pushcharovskii D.Yu., Baataryn T., Pobedimskaya E.A., Belov N.V. (1971)
* Kristallogr., 16, 721-723
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 10.52 alpha = 90.0
b = 10.52 beta = 90.0
c = 14.22 gamma = 120.0
Unit cell volume (cub. angs.) = 1362.89
Molar volume ( cub.cm/mol.) = 410.46
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.5 0.25 0.0 Zn = 1.00
2 0.3333 0.6667 0.262 0.0 Mn = 1.00
3 0.0 0.0 0.227 0.0 K = 1.00
4 0.346 0.103 0.116 0.0 Si = 1.00
5 0.338 0.108 0.887 0.0 Si = 1.00
6 0.355 0.096 0.0 0.0 O = 1.00
7 0.212 0.939 0.14 0.0 O = 1.00
8 0.213 0.941 0.859 0.0 O = 1.00
9 0.49 0.146 0.167 0.0 O = 1.00
10 0.495 0.142 0.835 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.5 0.25
2 2 0.3333 0.6667 0.262
3 3 0.0 0.0 0.227
4 4 0.346 0.103 0.116
5 5 0.338 0.108 0.887
6 6 0.355 0.096 0.0
7 7 0.212 0.939 0.14
8 8 0.213 0.941 0.859
9 9 0.49 0.146 0.167
10 10 0.495 0.142 0.835
11 1 0.5 0.5 0.25
12 1 0.5 0.0 0.25
13 4 0.897 0.243 0.116
14 4 0.757 0.654 0.116
15 5 0.892 0.23 0.887
16 5 0.77 0.662 0.887
17 6 0.904 0.259 0.0
18 6 0.741 0.645 0.0
19 7 0.061 0.273 0.14
20 7 0.727 0.788 0.14
21 8 0.059 0.272 0.859
22 8 0.728 0.787 0.859
23 9 0.854 0.344 0.167
24 9 0.656 0.51 0.167
25 10 0.858 0.353 0.835
26 10 0.647 0.505 0.835
27 2 0.6667 0.3333 0.262
28 4 0.654 0.897 0.116
29 5 0.662 0.892 0.887
30 6 0.645 0.904 0.0
31 7 0.788 0.061 0.14
32 8 0.787 0.059 0.859
33 9 0.51 0.854 0.167
34 10 0.505 0.858 0.835
35 4 0.103 0.757 0.116
36 4 0.243 0.346 0.116
37 5 0.108 0.77 0.887
38 5 0.23 0.338 0.887
39 6 0.096 0.741 0.0
40 6 0.259 0.355 0.0
41 7 0.939 0.727 0.14
42 7 0.273 0.212 0.14
43 8 0.941 0.728 0.859
44 8 0.272 0.213 0.859
45 9 0.146 0.656 0.167
46 9 0.344 0.49 0.167
47 10 0.142 0.647 0.835
48 10 0.353 0.495 0.835
49 1 0.0 0.5 0.75
50 2 0.3333 0.6666 0.762
51 3 0.0 0.0 0.727
52 4 0.346 0.243 0.616
53 5 0.338 0.23 0.387
54 6 0.355 0.259 0.5
55 7 0.212 0.273 0.64
56 8 0.213 0.272 0.359
57 9 0.49 0.344 0.667
58 10 0.495 0.353 0.335
59 1 0.5 0.0 0.75
60 1 0.5 0.5 0.75
61 4 0.897 0.654 0.616
62 4 0.757 0.103 0.616
63 5 0.892 0.662 0.387
64 5 0.77 0.108 0.387
65 6 0.904 0.645 0.5
66 6 0.741 0.096 0.5
67 7 0.061 0.788 0.64
68 7 0.727 0.939 0.64
69 8 0.059 0.787 0.359
70 8 0.728 0.941 0.359
71 9 0.854 0.51 0.667
72 9 0.656 0.146 0.667
73 10 0.858 0.505 0.335
74 10 0.647 0.142 0.335
75 2 0.6667 0.3334 0.762
76 4 0.654 0.757 0.616
77 5 0.662 0.77 0.387
78 6 0.645 0.741 0.5
79 7 0.788 0.727 0.64
80 8 0.787 0.728 0.359
81 9 0.51 0.656 0.667
82 10 0.505 0.647 0.335
83 4 0.103 0.346 0.616
84 4 0.243 0.897 0.616
85 5 0.108 0.338 0.387
86 5 0.23 0.892 0.387
87 6 0.096 0.355 0.5
88 6 0.259 0.904 0.5
89 7 0.939 0.212 0.64
90 7 0.273 0.061 0.64
91 8 0.941 0.213 0.359
92 8 0.272 0.059 0.359
93 9 0.146 0.49 0.667
94 9 0.344 0.854 0.667
95 10 0.142 0.495 0.335
96 10 0.353 0.858 0.335
X-ray density (g/cm cub.) = 2.83
MU (1/cm) = 181.912 Mass attenuation coefficient (cm**2/g) = 64.259
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Zn 2.628 4
1.9811 9
1.9811 9
1.9427 10
1.9427 10
2 Mn 2.724 6
2.3452 9
2.3449 9
2.3457 9
2.1812 10
2.1807 10
2.1802 10
3 K 3.228 12
2.8892 7
2.8891 7
2.8891 7
2.8892 7
2.8891 7
2.8891 7
3.2125 8
3.2124 8
3.2125 8
3.2125 8
3.2124 8
3.2125 8
4 Si 2.1 4
1.656 6
1.6273 7
1.5298 9
1.7035 7
5 Si 2.1 4
1.6286 6
1.6322 8
1.6769 10
1.6211 8
6 O 3.264 6
2.5435 7
2.5445 8
2.6807 9
2.6825 10
2.6925 7
2.7152 8
7 O 3.264 6
2.5435 6
2.6597 9
2.6924 6
2.6109 7
2.611 7
2.7249 9
8 O 3.264 6
2.5445 6
2.6675 10
2.7151 6
2.6071 8
2.6071 8
2.8159 10
9 O 3.264 6
2.6807 6
2.6597 7
3.1823 9
2.7251 7
3.2152 10
2.9166 10
10 O 3.264 6
2.6825 6
2.6675 8
3.0416 10
2.8162 8
3.2152 9
2.9166 9
X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 1 0 0 4.85 9.7 0.055 276.81 6 21.6 41.6
2 0 0 2 6.219 12.439 0.07 167.43 2 282.4 1437.8
3 1 0 2 7.899 15.798 0.089 102.95 12 90.7 547.8
4 1 1 0 8.421 16.841 0.095 90.32 6 123.2 442.8
5 2 0 0 9.735 19.47 0.11 67.03 6 29.4 18.7
6 1 1 2 10.496 20.991 0.118 57.37 12 107.6 429.5
7 2 0 2 11.585 23.17 0.13 46.7 12 179.8 975.6
8 0 0 4 12.514 25.028 0.141 39.73 2 156.8 105.2
9 2 1 0 12.926 25.852 0.145 37.11 12 29.5 20.9
10 2 1 1 13.306 26.613 0.149 34.9 24 139.5 877.9
11 1 0 4 13.449 26.899 0.151 34.12 12 112.8 280.5
12 2 1 2 14.392 28.783 0.161 29.55 24 79.0 238.3
13 3 0 0 14.693 29.386 0.165 28.27 6 72.9 48.5
14 1 1 4 15.16 30.321 0.17 26.44 12 154.3 406.5
15 2 0 4 15.953 31.906 0.178 23.69 12 238.9 873.4
16 3 0 2 16.01 32.021 0.179 23.51 12 16.0 3.9
17 2 1 3 16.051 32.102 0.179 23.38 24 74.8 169.2
18 2 2 0 17.031 34.061 0.19 20.56 6 297.4 587.4
19 3 1 0 17.749 35.497 0.198 18.79 12 65.6 52.2
20 3 1 1 18.036 36.072 0.201 18.14 24 75.1 132.1
21 2 1 4 18.145 36.29 0.202 17.9 24 60.0 83.1
22 2 2 2 18.197 36.393 0.203 17.79 12 181.9 380.1
23 3 1 2 18.876 37.752 0.21 16.41 24 46.2 45.2
24 0 0 6 18.966 37.933 0.211 16.24 2 38.7 2.6
25 3 0 4 19.487 38.974 0.217 15.29 12 55.3 30.2
26 1 0 6 19.623 39.246 0.218 15.06 12 51.4 25.7
27 4 0 0 19.767 39.533 0.22 14.82 6 96.2 44.3
28 3 1 3 20.209 40.419 0.224 14.11 24 82.6 124.4
29 2 1 5 20.565 41.131 0.228 13.57 24 13.1 3.0
30 4 0 2 20.801 41.602 0.231 13.23 12 138.6 164.1
31 1 1 6 20.884 41.768 0.231 13.11 12 42.7 15.5
32 2 2 4 21.366 42.731 0.236 12.46 12 159.6 205.0
33 2 0 6 21.492 42.984 0.238 12.29 12 111.4 98.6
34 3 2 0 21.625 43.251 0.239 12.12 12 91.4 65.4
35 3 2 1 21.87 43.739 0.242 11.82 24 5.5 0.5
36 3 1 4 21.963 43.925 0.243 11.71 24 131.7 262.2
37 3 2 2 22.59 45.179 0.249 10.99 24 23.3 7.7
38 4 1 0 22.796 45.591 0.251 10.76 12 73.7 37.8
39 4 1 1 23.03 46.06 0.254 10.52 24 63.2 54.4
40 2 1 6 23.238 46.476 0.256 10.31 24 58.5 45.5
41 4 0 4 23.681 47.363 0.261 9.87 12 107.0 73.0
42 4 1 2 23.723 47.445 0.261 9.84 24 83.0 87.5
43 3 2 3 23.752 47.503 0.261 9.81 24 9.4 1.1
44 3 1 5 24.065 48.131 0.265 9.52 24 98.9 120.4
45 3 0 6 24.348 48.695 0.268 9.27 12 61.3 22.5
46 4 1 3 24.844 49.688 0.273 8.86 24 33.7 13.0
47 5 0 0 25.008 50.015 0.274 8.72 6 170.9 82.3
48 3 2 4 25.31 50.62 0.278 8.49 24 44.8 22.0
49 0 0 8 25.68 51.361 0.281 8.21 2 439.6 170.9
50 5 0 2 25.874 51.749 0.283 8.07 12 42.4 9.4
51 2 2 6 25.945 51.89 0.284 8.02 12 262.2 356.4
52 3 3 0 26.061 52.121 0.285 7.94 6 131.7 44.5
53 2 1 7 26.12 52.239 0.286 7.9 24 60.9 37.8
54 1 0 8 26.201 52.402 0.287 7.85 12 36.2 6.6
55 4 1 4 26.354 52.708 0.288 7.74 24 30.4 9.3
56 3 1 6 26.462 52.924 0.289 7.67 24 89.3 79.0
57 4 2 0 26.576 53.152 0.29 7.6 12 119.1 69.6
58 4 2 1 26.786 53.571 0.293 7.46 24 71.0 48.6
59 3 3 2 26.903 53.806 0.294 7.39 12 54.5 14.2
60 3 2 5 27.217 54.433 0.297 7.19 24 4.4 0.2
61 1 1 8 27.221 54.442 0.297 7.19 12 90.7 38.2
62 4 2 2 27.407 54.815 0.299 7.08 24 82.9 62.9
63 2 0 8 27.721 55.443 0.302 6.9 12 49.9 11.1
64 4 0 6 27.973 55.945 0.304 6.76 12 96.0 40.3
65 5 1 0 28.082 56.165 0.306 6.7 12 20.1 1.7
66 4 1 5 28.211 56.423 0.307 6.63 24 33.9 9.9
67 5 1 1 28.284 56.569 0.308 6.59 24 108.4 100.1
68 5 0 4 28.361 56.723 0.308 6.55 12 20.0 1.7
69 4 2 3 28.423 56.847 0.309 6.52 24 16.7 2.3
70 5 1 2 28.885 57.769 0.314 6.29 24 86.8 61.3
71 3 1 7 29.112 58.225 0.316 6.18 24 8.4 0.6
72 2 1 8 29.188 58.376 0.317 6.14 24 54.8 23.9
73 3 3 4 29.331 58.661 0.318 6.07 12 153.1 91.9
74 3 2 6 29.431 58.862 0.319 6.03 24 72.8 41.2
75 4 2 4 29.808 59.616 0.323 5.86 24 119.5 108.1
76 5 1 3 29.868 59.736 0.323 5.83 24 70.6 37.6
77 3 0 8 30.141 60.281 0.326 5.71 12 70.4 18.3
78 4 1 6 30.379 60.758 0.328 5.61 24 22.8 3.8
79 6 0 0 30.483 60.967 0.329 5.57 6 162.8 47.7
80 4 3 0 30.95 61.899 0.334 5.39 12 53.7 10.0
81 4 3 1 31.14 62.28 0.336 5.31 24 16.4 1.8
82 5 1 4 31.213 62.425 0.336 5.29 24 54.8 20.5
83 6 0 2 31.247 62.494 0.337 5.27 12 233.2 185.3
84 4 2 5 31.532 63.065 0.339 5.17 24 42.8 12.2
85 2 2 8 31.536 63.073 0.34 5.17 12 262.1 229.4
86 4 3 2 31.707 63.413 0.341 5.11 24 26.3 4.6
87 5 2 0 31.87 63.741 0.343 5.05 12 211.7 146.2
88 3 2 7 31.922 63.845 0.343 5.03 24 21.7 3.1
89 3 1 8 31.994 63.988 0.344 5.01 24 35.3 8.1
90 5 2 1 32.058 64.115 0.345 4.99 24 72.2 33.6
91 5 0 6 32.224 64.449 0.346 4.93 12 37.1 4.4
92 2 1 9 32.438 64.876 0.348 4.86 24 49.4 15.3
93 5 2 2 32.616 65.231 0.35 4.8 24 3.5 0.1
94 4 3 3 32.639 65.279 0.35 4.8 24 19.0 2.2
95 0 0 10 32.799 65.597 0.352 4.75 2 104.0 5.5
96 4 1 7 32.828 65.656 0.352 4.74 24 56.4 19.5
97 5 1 5 32.895 65.789 0.353 4.72 24 76.6 35.8
98 3 3 6 33.126 66.251 0.355 4.65 12 48.7 7.1
99 1 0 10 33.247 66.494 0.356 4.61 12 69.6 14.4
100 4 0 8 33.346 66.692 0.357 4.58 12 92.0 25.0
101 6 0 4 33.478 66.957 0.358 4.54 12 194.3 110.8
102 5 2 3 33.535 67.07 0.359 4.53 24 57.2 19.1
103 4 2 6 33.572 67.143 0.359 4.52 24 101.2 59.8
104 6 1 0 33.671 67.341 0.36 4.49 12 59.0 10.1
105 6 1 1 33.853 67.705 0.362 4.44 24 14.4 1.2
106 4 3 4 33.922 67.844 0.362 4.42 24 38.9 8.7
107 1 1 10 34.134 68.268 0.364 4.36 12 54.5 8.4
108 6 1 2 34.396 68.791 0.367 4.29 24 49.1 13.4
109 2 0 10 34.574 69.148 0.368 4.25 12 126.7 44.1
110 3 2 8 34.671 69.343 0.369 4.22 24 95.1 49.4
111 5 2 4 34.801 69.602 0.37 4.19 24 70.8 27.2
112 5 1 6 34.893 69.785 0.371 4.17 24 21.9 2.6
113 3 1 9 35.098 70.197 0.373 4.12 24 185.9 184.0
114 6 1 3 35.292 70.584 0.375 4.08 24 28.7 4.3
115 4 3 5 35.538 71.076 0.377 4.02 24 59.2 18.2
116 4 1 8 35.542 71.084 0.377 4.02 24 16.0 1.3
117 4 4 0 35.857 71.714 0.38 3.95 6 48.7 3.0
118 2 1 10 35.878 71.756 0.38 3.95 24 94.1 45.2
119 4 2 7 35.906 71.812 0.381 3.94 24 40.5 8.3
120 5 3 0 36.287 72.575 0.384 3.86 12 14.6 0.5
121 7 0 0 36.287 72.575 0.384 3.86 6 185.7 43.0
122 5 2 5 36.4 72.799 0.385 3.84 24 11.3 0.6
123 5 3 1 36.463 72.927 0.386 3.82 24 106.1 55.6
124 6 1 4 36.531 73.061 0.386 3.81 24 40.0 7.9
125 4 4 2 36.562 73.125 0.387 3.8 12 175.0 75.3
126 3 0 10 36.736 73.472 0.388 3.77 12 24.7 1.5
127 5 3 2 36.989 73.979 0.391 3.72 24 34.6 5.7
128 7 0 2 36.989 73.979 0.391 3.72 12 32.5 2.5
129 6 0 6 37.047 74.094 0.391 3.71 12 116.1 32.3
130 5 1 7 37.19 74.381 0.392 3.68 24 52.1 12.9
131 5 0 8 37.257 74.514 0.393 3.67 12 95.2 21.5
132 4 3 6 37.472 74.944 0.395 3.63 24 63.3 18.8
133 6 2 0 37.567 75.133 0.396 3.62 12 153.0 54.7
134 3 2 9 37.672 75.344 0.397 3.6 24 9.7 0.4
135 6 2 1 37.74 75.481 0.397 3.59 24 78.3 28.4
136 5 3 3 37.86 75.721 0.398 3.57 24 95.5 42.0
137 2 2 10 38.01 76.02 0.4 3.54 12 68.2 10.6
138 6 1 5 38.1 76.2 0.401 3.53 24 17.2 1.4
139 3 3 8 38.104 76.208 0.401 3.53 12 73.6 12.3
140 6 2 2 38.26 76.52 0.402 3.5 24 113.0 57.8
141 5 2 6 38.317 76.634 0.402 3.49 24 44.8 9.1
142 3 1 10 38.431 76.862 0.403 3.47 24 59.0 15.6
143 4 1 9 38.516 77.031 0.404 3.46 24 38.4 6.6
144 4 2 8 38.525 77.05 0.404 3.46 24 111.2 55.3
145 4 4 4 38.649 77.299 0.405 3.44 12 227.3 114.9
146 5 3 4 39.069 78.137 0.409 3.38 24 78.3 26.8
147 7 0 4 39.069 78.137 0.409 3.38 12 62.5 8.5
148 6 2 3 39.122 78.243 0.41 3.37 24 49.6 10.7
149 2 1 11 39.528 79.057 0.413 3.32 24 42.4 7.7
150 7 1 0 39.667 79.334 0.414 3.3 12 24.9 1.3
151 4 0 10 39.687 79.374 0.415 3.29 12 131.2 36.6
152 4 3 7 39.714 79.428 0.415 3.29 24 8.1 0.3
153 5 1 8 39.78 79.559 0.415 3.28 24 32.4 4.4
154 7 1 1 39.838 79.676 0.416 3.28 24 29.7 3.7
155 6 1 6 39.99 79.981 0.417 3.26 24 35.7 5.3
156 6 2 4 40.319 80.638 0.42 3.22 24 30.7 3.9
157 7 1 2 40.35 80.699 0.42 3.21 24 38.5 6.2
158 0 0 12 40.544 81.087 0.422 3.19 2 73.5 1.9
159 5 2 7 40.545 81.091 0.422 3.19 24 63.8 16.8
160 5 3 5 40.607 81.214 0.422 3.18 24 70.0 20.1
161 3 2 10 40.932 81.865 0.425 3.15 24 28.2 3.2
162 1 0 12 40.958 81.915 0.425 3.14 12 99.2 20.0
163 7 1 3 41.199 82.399 0.428 3.12 24 9.2 0.3
164 5 4 0 41.326 82.652 0.429 3.1 12 52.1 5.4
165 4 2 9 41.429 82.857 0.43 3.09 24 71.4 20.4
166 5 4 1 41.495 82.99 0.43 3.09 24 42.8 7.3
167 4 1 10 41.758 83.516 0.432 3.06 24 54.3 11.7
168 1 1 12 41.783 83.567 0.433 3.06 12 47.4 4.4
169 6 2 5 41.846 83.693 0.433 3.05 24 46.8 8.6
170 6 0 8 41.85 83.7 0.433 3.05 12 47.3 4.4
171 5 4 2 42.003 84.006 0.434 3.04 24 41.2 6.7
172 3 1 11 42.014 84.027 0.434 3.04 24 35.2 4.9
173 4 4 6 42.059 84.117 0.435 3.03 12 163.1 52.1
174 6 3 0 42.15 84.301 0.436 3.02 12 26.8 1.4
175 2 0 12 42.195 84.391 0.436 3.02 12 128.7 32.3
176 6 1 7 42.197 84.394 0.436 3.02 24 20.6 1.7
177 4 3 8 42.262 84.523 0.437 3.01 24 81.2 25.7
178 6 3 1 42.319 84.638 0.437 3.01 24 35.4 4.9
179 7 1 4 42.384 84.768 0.438 3.0 24 75.6 22.2
180 5 3 6 42.47 84.94 0.438 3.0 24 46.8 8.5
181 7 0 6 42.47 84.94 0.438 3.0 12 35.3 2.4
182 8 0 0 42.562 85.123 0.439 2.99 6 186.5 33.6
183 5 1 9 42.664 85.328 0.44 2.98 24 86.7 29.0
184 6 3 2 42.825 85.651 0.441 2.97 24 40.1 6.2
185 5 4 3 42.847 85.694 0.441 2.97 24 13.5 0.7
186 5 2 8 43.084 86.167 0.443 2.95 24 140.9 75.6
187 8 0 2 43.236 86.472 0.445 2.94 12 72.5 10.0
188 5 0 10 43.403 86.805 0.446 2.92 12 33.9 2.2
189 2 1 12 43.428 86.855 0.446 2.92 24 55.5 11.6
190 6 3 3 43.668 87.335 0.448 2.91 24 21.5 1.7
191 6 2 6 43.702 87.403 0.448 2.9 24 53.9 10.9
192 7 2 0 43.793 87.586 0.449 2.9 12 72.4 9.8
193 7 1 5 43.9 87.801 0.45 2.89 24 6.9 0.2
194 7 2 1 43.961 87.922 0.451 2.89 24 48.1 8.6
195 5 4 4 44.026 88.051 0.451 2.88 24 9.5 0.3
196 3 3 10 44.222 88.445 0.453 2.87 12 42.0 3.3
197 3 0 12 44.247 88.495 0.453 2.87 12 36.3 2.4
198 7 2 2 44.466 88.931 0.455 2.86 24 15.3 0.9
199 3 2 11 44.476 88.953 0.455 2.86 24 31.3 3.6
200 4 2 10 44.632 89.264 0.456 2.85 24 56.3 11.7
201 5 3 7 44.659 89.318 0.456 2.85 24 72.7 19.4
202 6 1 8 44.723 89.447 0.457 2.84 24 43.7 7.0
203 6 3 4 44.845 89.69 0.458 2.84 24 20.2 1.5
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 1 0 0 4.85 9.7 9.11059 41.6 2.9 2.9 5.6
2 0 0 2 6.219 12.439 7.11 1437.8 100.0 100.0 5.6
3 1 0 2 7.899 15.798 5.60513 547.8 38.1 38.0 5.6
4 1 1 0 8.421 16.841 5.26 442.8 30.8 30.7 5.6
5 2 0 0 9.735 19.47 4.55529 18.7 1.3 1.3 5.6
6 1 1 2 10.496 20.991 4.22861 429.5 29.9 29.7 5.6
7 2 0 2 11.585 23.17 3.83559 975.6 67.9 67.4 5.6
8 0 0 4 12.514 25.028 3.555 105.2 7.3 7.3 5.6
9 2 1 0 12.926 25.852 3.44348 20.9 1.5 1.4 5.6
10 2 1 1 13.306 26.613 3.34675 877.9 61.1 60.5 5.6
11 1 0 4 13.449 26.899 3.3118 280.5 19.5 19.3 5.6
12 2 1 2 14.392 28.783 3.09914 238.3 16.6 16.4 5.6
13 3 0 0 14.693 29.386 3.03686 48.5 3.4 3.3 5.6
14 1 1 4 15.16 30.321 2.94539 406.5 28.3 27.9 5.6
15 2 0 4 15.953 31.906 2.80257 873.4 60.7 59.9 5.6
16 2 1 3 16.051 32.102 2.78593 169.2 11.8 11.6 5.6
17 2 2 0 17.031 34.061 2.63 587.4 40.9 40.2 5.7
18 3 1 0 17.749 35.497 2.52682 52.2 3.6 3.6 5.7
19 3 1 1 18.036 36.072 2.48785 132.1 9.2 9.0 5.7
20 2 1 4 18.145 36.29 2.47339 83.1 5.8 5.7 5.7
21 2 2 2 18.197 36.393 2.46666 380.1 26.4 26.0 5.7
22 3 1 2 18.876 37.752 2.38093 45.2 3.1 3.1 5.7
23 3 0 4 19.487 38.974 2.30905 30.2 2.1 2.1 5.7
24 1 0 6 19.623 39.246 2.29366 25.7 1.8 1.8 5.7
25 4 0 0 19.767 39.533 2.27765 44.3 3.1 3.0 5.7
26 3 1 3 20.209 40.419 2.22978 124.4 8.6 8.5 5.7
27 4 0 2 20.801 41.602 2.16907 164.1 11.4 11.2 5.7
28 1 1 6 20.884 41.768 2.16079 15.5 1.1 1.1 5.7
29 2 2 4 21.366 42.731 2.1143 205.0 14.3 13.9 5.7
30 2 0 6 21.492 42.984 2.10247 98.6 6.9 6.7 5.7
31 3 2 0 21.625 43.251 2.09011 65.4 4.5 4.4 5.7
32 3 1 4 21.963 43.925 2.05957 262.2 18.2 17.8 5.7
33 4 1 0 22.796 45.591 1.98809 37.8 2.6 2.6 5.7
34 4 1 1 23.03 46.06 1.96894 54.4 3.8 3.7 5.7
35 2 1 6 23.238 46.476 1.95229 45.5 3.2 3.1 5.7
36 4 0 4 23.681 47.363 1.9178 73.0 5.1 4.9 5.7
37 4 1 2 23.723 47.445 1.91465 87.5 6.1 5.9 5.7
38 3 1 5 24.065 48.131 1.88896 120.4 8.4 8.1 5.7
39 3 0 6 24.348 48.695 1.86838 22.5 1.6 1.5 5.7
40 5 0 0 25.008 50.015 1.82212 82.3 5.7 5.5 5.7
41 3 2 4 25.31 50.62 1.80177 22.0 1.5 1.5 5.8
42 0 0 8 25.68 51.361 1.7775 170.9 11.9 11.5 5.8
43 2 2 6 25.945 51.89 1.76061 356.4 24.8 23.9 5.8
44 3 3 0 26.061 52.121 1.75333 44.5 3.1 3.0 5.8
45 2 1 7 26.12 52.239 1.74966 37.8 2.6 2.5 5.8
46 3 1 6 26.462 52.924 1.72863 79.0 5.5 5.3 5.8
47 4 2 0 26.576 53.152 1.72174 69.6 4.8 4.7 5.8
48 4 2 1 26.786 53.571 1.70926 48.6 3.4 3.3 5.8
49 1 1 8 27.221 54.442 1.68395 38.2 2.7 2.6 5.8
50 4 2 2 27.407 54.815 1.67337 62.9 4.4 4.2 5.8
51 4 0 6 27.973 55.945 1.64222 40.3 2.8 2.7 5.8
52 5 1 1 28.284 56.569 1.62558 100.1 7.0 6.7 5.8
53 5 1 2 28.885 57.769 1.59462 61.3 4.3 4.1 5.8
54 2 1 8 29.188 58.376 1.57948 23.9 1.7 1.6 5.8
55 3 3 4 29.331 58.661 1.57248 91.9 6.4 6.1 5.8
56 3 2 6 29.431 58.862 1.56759 41.2 2.9 2.7 5.8
57 4 2 4 29.808 59.616 1.54957 108.1 7.5 7.2 5.8
58 5 1 3 29.868 59.736 1.54674 37.6 2.6 2.5 5.8
59 3 0 8 30.141 60.281 1.53405 18.3 1.3 1.2 5.8
60 6 0 0 30.483 60.967 1.51843 47.7 3.3 3.2 5.8
61 5 1 4 31.213 62.425 1.48641 20.5 1.4 1.4 5.8
62 6 0 2 31.247 62.494 1.48495 185.3 12.9 12.3 5.8
63 2 2 8 31.536 63.073 1.47269 241.6 16.8 16.0 5.9
64 5 2 0 31.87 63.741 1.45886 146.2 10.2 9.7 5.9
65 5 2 1 32.058 64.115 1.45124 33.6 2.3 2.2 5.9
66 2 1 9 32.438 64.876 1.43605 15.3 1.1 1.0 5.9
67 4 1 7 32.828 65.656 1.42087 19.5 1.4 1.3 5.9
68 5 1 5 32.895 65.789 1.41831 35.8 2.5 2.4 5.9
69 1 0 10 33.247 66.494 1.40499 14.4 1.0 0.9 5.9
70 4 0 8 33.346 66.692 1.40128 25.0 1.7 1.6 5.9
71 6 0 4 33.478 66.957 1.39639 110.8 7.7 7.3 5.9
72 5 2 3 33.535 67.07 1.39432 19.1 1.3 1.3 5.9
73 4 2 6 33.572 67.143 1.39296 59.8 4.2 3.9 5.9
74 2 0 10 34.574 69.148 1.3574 44.1 3.1 2.9 5.9
75 3 2 8 34.671 69.343 1.35406 49.4 3.4 3.2 5.9
76 5 2 4 34.801 69.602 1.34964 27.2 1.9 1.8 5.9
77 3 1 9 35.098 70.197 1.33966 184.0 12.8 12.0 5.9
78 4 3 5 35.538 71.076 1.32523 19.5 1.4 1.3 5.9
79 2 1 10 35.878 71.756 1.31434 56.6 3.9 3.7 5.9
80 7 0 0 36.287 72.575 1.30151 43.0 3.0 2.8 6.0
81 5 3 1 36.463 72.927 1.2961 55.6 3.9 3.6 6.0
82 4 4 2 36.562 73.125 1.29307 75.3 5.2 4.9 6.0
83 6 0 6 37.047 74.094 1.27853 32.3 2.2 2.1 6.0
84 5 0 8 37.257 74.514 1.27236 21.5 1.5 1.4 6.0
85 4 3 6 37.472 74.944 1.26612 18.8 1.3 1.2 6.0
86 6 2 0 37.567 75.133 1.26341 54.7 3.8 3.5 6.0
87 6 2 1 37.74 75.481 1.25845 28.4 2.0 1.8 6.0
88 5 3 3 37.86 75.721 1.25506 42.0 2.9 2.7 6.0
89 6 2 2 38.26 76.52 1.24393 57.8 4.0 3.7 6.0
90 3 1 10 38.431 76.862 1.23924 15.6 1.1 1.0 6.0
91 4 2 8 38.525 77.05 1.2367 61.9 4.3 4.0 6.0
92 4 4 4 38.649 77.299 1.23333 114.9 8.0 7.4 6.0
93 5 3 4 39.069 78.137 1.22218 35.3 2.5 2.3 6.0
94 4 0 10 39.687 79.374 1.20622 38.0 2.6 2.4 6.0
95 5 2 7 40.545 81.091 1.18496 18.6 1.3 1.2 6.1
96 5 3 5 40.607 81.214 1.18347 20.1 1.4 1.3 6.1
97 1 0 12 40.958 81.915 1.1751 23.2 1.6 1.5 6.1
98 4 2 9 41.429 82.857 1.16412 20.4 1.4 1.3 6.1
99 4 1 10 41.758 83.516 1.1566 16.1 1.1 1.0 6.1
100 4 4 6 42.059 84.117 1.14986 52.1 3.6 3.3 6.1
101 2 0 12 42.195 84.391 1.14683 34.0 2.4 2.2 6.1
102 4 3 8 42.262 84.523 1.14537 25.7 1.8 1.6 6.1
103 7 1 4 42.384 84.768 1.14269 22.2 1.5 1.4 6.1
104 8 0 0 42.562 85.123 1.13882 33.6 2.3 2.1 6.1
105 5 1 9 42.664 85.328 1.13661 29.0 2.0 1.8 6.1
106 5 2 8 43.084 86.167 1.12768 75.6 5.3 4.8 6.1
107 5 3 7 44.659 89.318 1.09588 31.1 2.2 1.9 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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