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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SULFUR
1, t-alpha-sulfur, f-sulfur
S
Orthorhombic * Fddd Z = 128
*Fddd
13 .5 .1991
Ref.Str.:
Wyckoff R.W.G. (1963)
* Crystal Structures, 1, 33
R: ATOMIC. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 10.467 alpha = 90.0
b = 12.87 beta = 90.0
c = 24.493 gamma = 90.0
Unit cell volume (cub. angs.) = 3299.46
Molar volume ( cub.cm/mol.) = 15.53
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.8554 0.9526 0.9516 0.0 S = 1.00
2 0.7844 0.0301 0.0763 0.0 S = 1.00
3 0.7069 0.9795 0.004 0.0 S = 1.00
4 0.7862 0.9073 0.129 0.0 S = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.8554 0.9526 0.9516
2 2 0.7844 0.0301 0.0763
3 3 0.7069 0.9795 0.004
4 4 0.7862 0.9073 0.129
5 1 0.8554 0.4526 0.4516
6 2 0.7844 0.5301 0.5763
7 3 0.7069 0.4795 0.504
8 4 0.7862 0.4073 0.629
9 1 0.3554 0.9526 0.4516
10 2 0.2844 0.0301 0.5763
11 3 0.2069 0.9795 0.504
12 4 0.2862 0.9073 0.629
13 1 0.3554 0.4526 0.9516
14 2 0.2844 0.5301 0.0763
15 3 0.2069 0.4795 0.004
16 4 0.2862 0.4073 0.129
17 1 0.1446 0.2026 0.2016
18 2 0.2156 0.2801 0.3263
19 3 0.2931 0.2295 0.254
20 4 0.2138 0.1573 0.379
21 1 0.1446 0.7026 0.7016
22 2 0.2156 0.7801 0.8263
23 3 0.2931 0.7295 0.754
24 4 0.2138 0.6573 0.879
25 1 0.6446 0.2026 0.7016
26 2 0.7156 0.2801 0.8263
27 3 0.7931 0.2295 0.754
28 4 0.7138 0.1573 0.879
29 1 0.6446 0.7026 0.2016
30 2 0.7156 0.7801 0.3263
31 3 0.7931 0.7295 0.254
32 4 0.7138 0.6573 0.379
33 1 0.1054 0.2026 0.0484
34 2 0.0344 0.2801 0.9237
35 3 0.9569 0.2295 0.996
36 4 0.0362 0.1573 0.871
37 1 0.1054 0.7026 0.5484
38 2 0.0344 0.7801 0.4237
39 3 0.9569 0.7295 0.496
40 4 0.0362 0.6573 0.371
41 1 0.6054 0.2026 0.5484
42 2 0.5344 0.2801 0.4237
43 3 0.4569 0.2295 0.496
44 4 0.5362 0.1573 0.371
45 1 0.6054 0.7026 0.0484
46 2 0.5344 0.7801 0.9237
47 3 0.4569 0.7295 0.996
48 4 0.5362 0.6573 0.871
49 1 0.3946 0.4526 0.7984
50 2 0.4656 0.5301 0.6737
51 3 0.5431 0.4795 0.746
52 4 0.4638 0.4073 0.621
53 1 0.3946 0.9526 0.2984
54 2 0.4656 0.0301 0.1737
55 3 0.5431 0.9795 0.246
56 4 0.4638 0.9073 0.121
57 1 0.8946 0.4526 0.2984
58 2 0.9656 0.5301 0.1737
59 3 0.0431 0.4795 0.246
60 4 0.9638 0.4073 0.121
61 1 0.8946 0.9526 0.7984
62 2 0.9656 0.0301 0.6737
63 3 0.0431 0.9795 0.746
64 4 0.9638 0.9073 0.621
65 1 0.1054 0.0474 0.2016
66 2 0.0344 0.9699 0.3263
67 3 0.9569 0.0205 0.254
68 4 0.0362 0.0927 0.379
69 1 0.1054 0.5474 0.7016
70 2 0.0344 0.4699 0.8263
71 3 0.9569 0.5205 0.754
72 4 0.0362 0.5927 0.879
73 1 0.6054 0.0474 0.7016
74 2 0.5344 0.9699 0.8263
75 3 0.4569 0.0205 0.754
76 4 0.5362 0.0927 0.879
77 1 0.6054 0.5474 0.2016
78 2 0.5344 0.4699 0.3263
79 3 0.4569 0.5205 0.254
80 4 0.5362 0.5927 0.379
81 1 0.3946 0.7974 0.4516
82 2 0.4656 0.7199 0.5763
83 3 0.5431 0.7705 0.504
84 4 0.4638 0.8427 0.629
85 1 0.3946 0.2974 0.9516
86 2 0.4656 0.2199 0.0763
87 3 0.5431 0.2705 0.004
88 4 0.4638 0.3427 0.129
89 1 0.8946 0.7974 0.9516
90 2 0.9656 0.7199 0.0763
91 3 0.0431 0.7705 0.004
92 4 0.9638 0.8427 0.129
93 1 0.8946 0.2974 0.4516
94 2 0.9656 0.2199 0.5763
95 3 0.0431 0.2705 0.504
96 4 0.9638 0.3427 0.629
97 1 0.3554 0.7974 0.2984
98 2 0.2844 0.7199 0.1737
99 3 0.2069 0.7705 0.246
100 4 0.2862 0.8427 0.121
101 1 0.3554 0.2974 0.7984
102 2 0.2844 0.2199 0.6737
103 3 0.2069 0.2705 0.746
104 4 0.2862 0.3427 0.621
105 1 0.8554 0.7974 0.7984
106 2 0.7844 0.7199 0.6737
107 3 0.7069 0.7705 0.746
108 4 0.7862 0.8427 0.621
109 1 0.8554 0.2974 0.2984
110 2 0.7844 0.2199 0.1737
111 3 0.7069 0.2705 0.246
112 4 0.7862 0.3427 0.121
113 1 0.6446 0.5474 0.0484
114 2 0.7156 0.4699 0.9237
115 3 0.7931 0.5205 0.996
116 4 0.7138 0.5927 0.871
117 1 0.6446 0.0474 0.5484
118 2 0.7156 0.9699 0.4237
119 3 0.7931 0.0205 0.496
120 4 0.7138 0.0927 0.371
121 1 0.1446 0.5474 0.5484
122 2 0.2156 0.4699 0.4237
123 3 0.2931 0.5205 0.496
124 4 0.2138 0.5927 0.371
125 1 0.1446 0.0474 0.0484
126 2 0.2156 0.9699 0.9237
127 3 0.2931 0.0205 0.996
128 4 0.2138 0.0927 0.871
X-ray density (g/cm cub.) = 2.06
MU (1/cm) = 183.957 Mass attenuation coefficient (cm**2/g) = 89.1
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 S 4.368 13
3.2978 2
2.0453 3
3.507 4
3.8744 3
3.7972 4
4.0847 2
3.7747 1
4.1924 4
2.0391 1
3.3166 3
4.2508 1
4.034 1
3.8381 2
2 S 4.368 12
3.2978 1
2.0538 3
2.0406 4
4.0847 1
3.7033 3
4.1019 2
3.8675 4
4.1354 2
3.318 4
3.4144 2
4.1695 4
3.8381 1
3 S 4.368 13
2.0453 1
2.0538 2
3.3054 4
3.823 4
4.1519 3
3.8744 1
3.7033 2
4.1519 3
3.9434 4
3.8325 4
4.119 3
3.3166 1
4.3677 3
4 S 4.368 13
2.0406 2
3.3054 3
3.507 1
3.823 3
3.7972 1
3.8675 2
3.9434 3
3.3802 4
4.1924 1
3.8325 3
3.318 2
2.0364 4
4.1695 2
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 1 1 5.735 11.471 0.065 197.29 8 78.5 89.2
2 0 1 3 6.415 12.83 0.073 157.25 4 0.0 0.0
3 1 0 3 6.872 13.744 0.078 136.73 4 0.0 0.0
4 0 0 4 7.227 14.453 0.082 123.43 2 3.4 0.0
5 1 1 3 7.689 15.377 0.087 108.79 8 159.1 202.4
6 0 2 2 7.771 15.543 0.088 106.43 4 146.5 83.9
7 2 0 2 9.21 18.421 0.104 75.14 4 92.9 23.8
8 0 3 1 10.503 21.006 0.118 57.28 4 0.0 0.0
9 1 1 5 10.582 21.164 0.119 56.4 8 83.0 28.5
10 2 2 0 10.936 21.872 0.123 52.67 4 291.9 164.9
11 1 3 0 11.189 22.378 0.126 50.22 4 0.0 0.0
12 1 3 1 11.337 22.674 0.128 48.86 8 231.4 192.2
13 2 2 2 11.529 23.059 0.13 47.18 8 634.1 1394.0
14 1 3 3 12.461 24.921 0.14 40.09 8 177.6 93.0
15 3 0 1 12.885 25.771 0.145 37.36 4 0.0 0.0
16 0 2 6 12.912 25.825 0.145 37.19 4 632.0 545.8
17 2 2 4 13.158 26.315 0.148 35.74 8 121.0 38.4
18 0 1 7 13.187 26.374 0.148 35.57 4 0.0 0.0
19 3 1 0 13.223 26.446 0.148 35.37 4 0.0 0.0
20 3 1 1 13.35 26.699 0.15 34.66 8 354.6 320.4
21 1 0 7 13.422 26.844 0.151 34.27 4 0.0 0.0
22 0 3 5 13.808 27.617 0.155 32.27 4 0.0 0.0
23 2 0 6 13.846 27.691 0.155 32.08 4 547.3 353.1
24 0 4 0 13.851 27.703 0.155 32.06 2 522.2 160.6
25 1 1 7 13.869 27.739 0.156 31.97 8 279.2 183.2
26 3 1 3 14.326 28.652 0.161 29.84 8 370.0 300.3
27 1 3 5 14.463 28.927 0.162 29.24 8 317.3 216.3
28 0 0 8 14.572 29.143 0.163 28.78 2 172.8 15.8
29 2 2 6 15.52 31.04 0.174 25.14 8 2.9 0.0
30 0 4 4 15.691 31.381 0.176 24.55 4 556.3 279.2
31 3 0 5 15.727 31.453 0.176 24.43 4 0.0 0.0
32 3 1 5 16.116 32.231 0.18 23.18 8 45.9 3.6
33 3 3 1 16.637 33.273 0.186 21.63 8 139.9 31.1
34 2 4 2 16.737 33.474 0.187 21.35 8 106.0 17.6
35 1 3 7 17.065 34.13 0.19 20.47 8 337.7 171.6
36 4 0 0 17.119 34.239 0.191 20.33 2 318.2 37.8
37 1 1 9 17.368 34.737 0.194 19.7 8 56.4 4.6
38 3 3 3 17.446 34.891 0.195 19.51 8 197.2 55.8
39 2 4 4 17.933 35.865 0.2 18.37 8 301.2 122.4
40 1 5 1 18.045 36.091 0.201 18.12 8 224.2 66.9
41 0 5 3 18.287 36.574 0.204 17.6 4 0.0 0.0
42 2 2 8 18.367 36.734 0.205 17.43 8 9.9 0.1
43 3 1 7 18.51 37.02 0.206 17.13 8 414.5 216.3
44 4 0 4 18.67 37.34 0.208 16.81 4 241.5 36.0
45 1 5 3 18.801 37.603 0.209 16.55 8 18.9 0.4
46 4 2 2 18.901 37.802 0.21 16.36 8 234.7 66.2
47 3 3 5 18.973 37.946 0.211 16.22 8 253.3 76.5
48 0 3 9 19.584 39.168 0.218 15.13 4 0.0 0.0
49 0 2 10 19.664 39.328 0.218 14.99 4 444.5 108.8
50 2 4 6 19.785 39.571 0.22 14.79 8 12.7 0.2
51 4 2 4 19.985 39.969 0.222 14.46 8 63.0 4.2
52 1 3 9 20.07 40.14 0.223 14.32 8 35.8 1.4
53 1 5 5 20.241 40.482 0.225 14.06 8 89.1 8.2
54 2 0 10 20.318 40.636 0.225 13.94 4 75.3 2.9
55 0 4 8 20.322 40.644 0.225 13.93 4 229.1 26.9
56 0 1 11 20.553 41.107 0.228 13.58 4 0.0 0.0
57 1 0 11 20.713 41.425 0.23 13.35 4 0.0 0.0
58 1 1 11 21.021 42.042 0.233 12.92 8 244.8 56.9
59 3 0 9 21.036 42.073 0.233 12.9 4 0.0 0.0
60 3 3 7 21.087 42.174 0.234 12.83 8 100.4 9.5
61 3 1 9 21.341 42.682 0.236 12.49 8 350.8 112.9
62 0 6 2 21.381 42.762 0.237 12.43 4 544.1 135.2
63 2 2 10 21.548 43.096 0.238 12.22 8 196.1 34.5
64 4 2 6 21.689 43.379 0.24 12.04 8 41.6 1.5
65 0 5 7 21.808 43.617 0.241 11.89 4 0.0 0.0
66 3 5 0 21.832 43.663 0.241 11.87 4 0.0 0.0
67 3 5 1 21.914 43.827 0.242 11.77 8 16.4 0.2
68 5 1 1 21.97 43.939 0.243 11.7 8 175.2 26.4
69 2 4 8 22.16 44.32 0.245 11.47 8 154.7 20.2
70 0 0 12 22.172 44.344 0.245 11.46 2 3.7 0.0
71 1 5 7 22.255 44.509 0.246 11.36 8 87.9 6.5
72 4 4 0 22.298 44.596 0.246 11.31 4 43.3 0.8
73 5 0 3 22.325 44.65 0.247 11.28 4 0.0 0.0
74 3 5 3 22.561 45.121 0.249 11.02 8 189.4 29.0
75 5 1 3 22.616 45.231 0.25 10.96 8 36.5 1.1
76 4 4 2 22.619 45.238 0.25 10.96 8 132.6 14.2
77 4 0 8 22.782 45.565 0.251 10.78 4 403.4 64.5
78 2 6 0 22.836 45.672 0.252 10.72 4 18.2 0.1
79 2 6 2 23.151 46.303 0.255 10.39 8 270.9 56.0
80 1 3 11 23.369 46.737 0.257 10.18 8 27.9 0.6
81 4 4 4 23.562 47.123 0.259 9.99 8 178.2 23.3
82 3 3 9 23.663 47.327 0.261 9.89 8 53.8 2.1
83 3 5 5 23.813 47.627 0.262 9.75 8 194.8 27.2
84 5 1 5 23.866 47.732 0.263 9.7 8 427.5 130.3
85 4 2 8 23.911 47.821 0.263 9.66 8 261.3 48.5
86 0 6 6 23.933 47.865 0.263 9.64 4 235.8 19.7
87 2 6 4 24.078 48.155 0.265 9.51 8 80.1 4.5
88 5 3 0 24.169 48.338 0.266 9.43 4 0.0 0.0
89 5 3 1 24.245 48.489 0.267 9.36 8 43.9 1.3
90 3 1 11 24.502 49.004 0.269 9.14 8 144.0 13.9
91 1 5 9 24.735 49.471 0.272 8.94 8 174.0 19.9
92 1 1 13 24.815 49.631 0.272 8.88 8 169.7 18.8
93 0 7 1 24.843 49.686 0.273 8.86 4 0.0 0.0
94 5 3 3 24.845 49.689 0.273 8.86 8 102.1 6.8
95 2 4 10 24.946 49.891 0.274 8.77 8 233.8 35.2
96 2 2 12 24.986 49.971 0.274 8.74 8 351.6 79.4
97 4 4 6 25.072 50.144 0.275 8.67 8 15.5 0.2
98 1 7 0 25.174 50.348 0.276 8.59 4 0.0 0.0
99 1 7 1 25.248 50.495 0.277 8.54 8 116.5 8.5
100 5 0 7 25.39 50.781 0.278 8.43 4 0.0 0.0
101 2 6 6 25.565 51.13 0.28 8.3 8 38.2 0.9
102 3 5 7 25.604 51.209 0.281 8.27 8 642.8 251.1
103 5 1 7 25.654 51.309 0.281 8.23 8 51.2 1.6
104 1 7 3 25.83 51.661 0.283 8.1 8 140.7 11.8
105 5 3 5 26.014 52.027 0.285 7.97 8 498.9 145.9
106 6 0 2 26.488 52.975 0.29 7.65 4 653.4 120.1
107 0 3 13 26.521 53.042 0.29 7.63 4 0.0 0.0
108 0 4 12 26.546 53.092 0.29 7.61 4 547.1 83.7
109 4 2 10 26.557 53.113 0.29 7.61 8 263.9 38.9
110 0 7 5 26.583 53.166 0.29 7.59 4 0.0 0.0
111 3 3 11 26.612 53.224 0.291 7.57 8 200.1 22.3
112 1 3 13 26.907 53.815 0.294 7.38 8 13.9 0.1
113 1 7 5 26.969 53.937 0.294 7.35 8 566.5 173.2
114 4 4 8 27.082 54.164 0.296 7.28 8 39.2 0.8
115 0 2 14 27.147 54.293 0.296 7.24 4 128.2 4.4
116 0 5 11 27.22 54.441 0.297 7.19 4 0.0 0.0
117 6 2 0 27.225 54.45 0.297 7.19 4 37.8 0.4
118 6 2 2 27.503 55.005 0.3 7.03 8 111.0 6.4
119 2 6 8 27.549 55.099 0.3 7.0 8 278.9 40.0
120 1 5 11 27.6 55.2 0.301 6.97 8 194.3 19.3
121 2 0 14 27.661 55.321 0.301 6.93 4 136.4 4.7
122 3 0 13 27.687 55.374 0.302 6.92 4 0.0 0.0
123 5 3 7 27.701 55.402 0.302 6.91 8 282.3 40.5
124 3 5 9 27.862 55.723 0.303 6.82 8 487.6 119.2
125 5 1 9 27.909 55.818 0.304 6.8 8 169.7 14.4
126 3 1 13 27.935 55.871 0.304 6.78 8 192.9 18.5
127 4 6 2 27.942 55.884 0.304 6.78 8 55.3 1.5
128 2 4 12 28.069 56.137 0.305 6.71 8 106.3 5.6
129 6 2 4 28.325 56.649 0.308 6.57 8 347.3 58.2
130 3 7 1 28.334 56.668 0.308 6.57 8 459.9 102.1
131 5 5 1 28.381 56.761 0.309 6.54 8 257.8 31.9
132 0 1 15 28.393 56.786 0.309 6.54 4 0.0 0.0
133 0 6 10 28.512 57.025 0.31 6.47 4 190.4 8.6
134 1 0 15 28.518 57.037 0.31 6.47 4 0.0 0.0
135 4 0 12 28.595 57.19 0.311 6.43 4 351.7 29.2
136 0 8 0 28.607 57.215 0.311 6.43 2 60.8 0.4
137 1 7 7 28.617 57.235 0.311 6.42 8 33.8 0.5
138 2 2 14 28.647 57.295 0.311 6.41 8 465.9 102.2
139 6 0 6 28.697 57.394 0.312 6.38 4 44.2 0.5
140 4 6 4 28.756 57.511 0.312 6.35 8 120.3 6.7
141 1 1 15 28.762 57.525 0.312 6.35 8 300.7 42.2
142 3 7 3 28.873 57.746 0.313 6.29 8 307.2 43.6
143 5 5 3 28.919 57.839 0.314 6.27 8 153.8 10.9
144 4 4 10 29.526 59.052 0.32 5.98 8 304.0 40.6
145 4 2 12 29.561 59.123 0.32 5.97 8 149.5 9.8
146 6 2 6 29.661 59.323 0.321 5.92 8 41.3 0.7
147 0 8 4 29.673 59.347 0.321 5.92 4 85.1 1.6
148 5 3 9 29.85 59.701 0.323 5.84 8 138.4 8.2
149 3 3 13 29.876 59.752 0.323 5.83 8 112.9 5.5
150 3 7 5 29.933 59.866 0.324 5.8 8 88.1 3.3
151 2 6 10 29.968 59.937 0.324 5.79 8 256.7 28.0
152 5 5 5 29.978 59.956 0.324 5.78 8 53.7 1.2
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 1 1 5.735 11.471 7.70787 89.2 6.4 6.4 5.6
2 1 1 3 7.689 15.377 5.75748 202.4 14.5 14.6 5.6
3 0 2 2 7.771 15.543 5.69647 83.9 6.0 6.0 5.6
4 2 0 2 9.21 18.421 4.81248 23.8 1.7 1.7 5.6
5 1 1 5 10.582 21.164 4.1945 28.5 2.0 2.0 5.6
6 2 2 0 10.936 21.872 4.06023 164.9 11.8 11.8 5.6
7 1 3 1 11.337 22.674 3.9184 192.2 13.8 13.8 5.6
8 2 2 2 11.529 23.059 3.85394 1394.0 100.0 100.0 5.6
9 1 3 3 12.461 24.921 3.56994 93.0 6.7 6.7 5.6
10 0 2 6 12.912 25.825 3.44708 545.8 39.2 39.1 5.6
11 2 2 4 13.158 26.315 3.3839 38.4 2.8 2.8 5.6
12 3 1 1 13.35 26.699 3.33607 320.4 23.0 22.9 5.6
13 2 0 6 13.846 27.691 3.21879 696.9 50.0 49.8 5.6
14 3 1 3 14.326 28.652 3.11305 300.3 21.5 21.4 5.6
15 1 3 5 14.463 28.927 3.08406 216.3 15.5 15.4 5.6
16 0 0 8 14.572 29.143 3.06163 15.8 1.1 1.1 5.6
17 0 4 4 15.691 31.381 2.84823 279.2 20.0 19.9 5.6
18 3 3 1 16.637 33.273 2.69044 31.1 2.2 2.2 5.6
19 2 4 2 16.737 33.474 2.67476 17.6 1.3 1.3 5.7
20 1 3 7 17.065 34.13 2.62484 171.6 12.3 12.2 5.7
21 4 0 0 17.119 34.239 2.61675 37.8 2.7 2.7 5.7
22 3 3 3 17.446 34.891 2.56929 55.8 4.0 4.0 5.7
23 2 4 4 17.933 35.865 2.50174 122.4 8.8 8.7 5.7
24 1 5 1 18.045 36.091 2.48662 66.9 4.8 4.7 5.7
25 3 1 7 18.51 37.02 2.42632 216.3 15.5 15.3 5.7
26 4 0 4 18.67 37.34 2.40624 36.0 2.6 2.6 5.7
27 4 2 2 18.901 37.802 2.37787 66.2 4.7 4.7 5.7
28 3 3 5 18.973 37.946 2.36918 76.5 5.5 5.4 5.7
29 0 2 10 19.664 39.328 2.28909 108.8 7.8 7.7 5.7
30 0 4 8 20.322 40.644 2.21795 29.8 2.1 2.1 5.7
31 1 1 11 21.021 42.042 2.14737 56.9 4.1 4.0 5.7
32 3 1 9 21.341 42.682 2.11664 112.9 8.1 8.0 5.7
33 0 6 2 21.381 42.762 2.11284 135.2 9.7 9.5 5.7
34 2 2 10 21.548 43.096 2.09725 34.5 2.5 2.4 5.7
35 5 1 1 21.97 43.939 2.05893 26.4 1.9 1.9 5.7
36 2 4 8 22.16 44.32 2.04213 20.2 1.4 1.4 5.7
37 3 5 3 22.561 45.121 2.00771 29.0 2.1 2.0 5.7
38 4 4 2 22.619 45.238 2.00278 15.2 1.1 1.1 5.7
39 4 0 8 22.782 45.565 1.98919 64.5 4.6 4.5 5.7
40 2 6 2 23.151 46.303 1.9592 56.0 4.0 3.9 5.7
41 4 4 4 23.562 47.123 1.92697 23.3 1.7 1.6 5.7
42 3 5 5 23.813 47.627 1.90778 27.2 1.9 1.9 5.7
43 5 1 5 23.866 47.732 1.90381 130.3 9.3 9.1 5.7
44 4 2 8 23.911 47.821 1.90046 68.2 4.9 4.8 5.7
45 1 5 9 24.735 49.471 1.8409 19.9 1.4 1.4 5.7
46 1 1 13 24.815 49.631 1.83533 18.8 1.3 1.3 5.7
47 2 4 10 24.946 49.891 1.82635 35.2 2.5 2.5 5.7
48 2 2 12 24.986 49.971 1.82363 79.4 5.7 5.6 5.7
49 3 5 7 25.604 51.209 1.78242 251.1 18.0 17.5 5.8
50 5 3 5 26.014 52.027 1.75628 145.9 10.5 10.2 5.8
51 6 0 2 26.488 52.975 1.72707 120.1 8.6 8.4 5.8
52 0 4 12 26.546 53.092 1.72354 122.7 8.8 8.5 5.8
53 3 3 11 26.612 53.224 1.71959 22.3 1.6 1.6 5.8
54 1 7 5 26.969 53.937 1.69851 173.2 12.4 12.1 5.8
55 2 6 8 27.549 55.099 1.66543 40.0 2.9 2.8 5.8
56 1 5 11 27.6 55.2 1.66261 19.3 1.4 1.3 5.8
57 5 3 7 27.701 55.402 1.65702 40.5 2.9 2.8 5.8
58 3 5 9 27.862 55.723 1.64822 119.2 8.5 8.3 5.8
59 3 1 13 27.935 55.871 1.64422 34.4 2.5 2.4 5.8
60 3 7 1 28.334 56.668 1.62298 160.3 11.5 11.1 5.8
61 5 5 1 28.381 56.761 1.62053 31.9 2.3 2.2 5.8
62 4 0 12 28.595 57.19 1.60939 30.2 2.2 2.1 5.8
63 2 2 14 28.647 57.295 1.60669 102.2 7.3 7.1 5.8
64 1 1 15 28.762 57.525 1.60082 48.9 3.5 3.4 5.8
65 3 7 3 28.873 57.746 1.5952 43.6 3.1 3.0 5.8
66 4 4 10 29.526 59.052 1.56301 40.6 2.9 2.8 5.8
67 2 6 10 29.968 59.937 1.54203 29.2 2.1 2.0 5.8
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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