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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BISMUTHINITE
1, t-stibnite, f-orpiment, g-stibnite
Bi(2)S(3)
Orthorhombic P bnm Z = 4
R =0.084 NR =450
23 .3 .1989
Ref.Str.:
V.Kuocik, L.Vesela-Novakova (1970)
* Tschermaks Min. Petr. Mitt., 14, 55-59
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 11.115 alpha = 90.0
b = 11.25 beta = 90.0
c = 3.97 gamma = 90.0
Unit cell volume (cub. angs.) = 496.42
Molar volume ( cub.cm/mol.) = 74.75
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.3257 0.0166 0.25 0.0 Bi = 1.00
2 0.0341 0.1596 0.75 0.0 Bi = 1.00
3 0.3715 0.4517 0.75 0.0 S = 1.00
4 0.4432 0.125 0.75 0.0 S = 1.00
5 0.1938 0.2178 0.25 0.0 S = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.3257 0.0166 0.25
2 2 0.0341 0.1596 0.75
3 3 0.3715 0.4517 0.75
4 4 0.4432 0.125 0.75
5 5 0.1938 0.2178 0.25
6 1 0.6743 0.9834 0.75
7 2 0.9659 0.8404 0.25
8 3 0.6285 0.5483 0.25
9 4 0.5568 0.875 0.25
10 5 0.8062 0.7822 0.75
11 1 0.1743 0.5166 0.25
12 2 0.4659 0.6596 0.75
13 3 0.1285 0.9517 0.75
14 4 0.0568 0.625 0.75
15 5 0.3062 0.7178 0.25
16 1 0.8257 0.4834 0.75
17 2 0.5341 0.3404 0.25
18 3 0.8715 0.0483 0.25
19 4 0.9432 0.375 0.25
20 5 0.6938 0.2822 0.75
X-ray density (g/cm cub.) = 6.88
MU (1/cm) = 1456.344 Mass attenuation coefficient (cm**2/g) = 211.771
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Bi 3.624 7
2.6708 4
2.6708 4
2.6968 5
3.0225 4
3.0459 3
3.0459 3
3.3685 5
2 Bi 3.624 7
2.7422 5
2.7422 5
2.5635 3
2.9622 3
2.9622 3
3.2914 4
3.2914 4
3 S 4.368 11
3.97 3
3.97 3
3.7608 4
3.8426 5
3.8426 5
3.6443 3
3.6443 3
4.0045 4
3.6645 5
3.6645 5
4.0583 5
4 S 4.368 9
3.7608 3
3.97 4
3.97 4
3.5658 5
3.5658 5
3.6667 4
3.6667 4
4.0045 3
3.2994 5
5 S 4.368 10
3.8426 3
3.8426 3
3.5658 4
3.5658 4
3.97 5
3.97 5
3.6645 3
3.6645 3
4.0583 3
3.2994 4
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 0 5.591 11.181 0.063 207.76 4 25.6 220.6
2 0 2 0 7.871 15.741 0.089 103.71 2 160.4 2166.2
3 2 0 0 7.967 15.934 0.09 101.16 2 95.2 743.4
4 1 2 0 8.828 17.657 0.1 81.97 4 129.1 2217.3
5 2 1 0 8.893 17.786 0.1 80.75 4 71.0 661.1
6 2 2 0 11.235 22.471 0.126 49.79 4 236.3 4511.0
7 1 0 1 11.89 23.78 0.134 44.23 4 185.0 2456.6
8 1 3 0 12.52 25.04 0.141 39.69 4 348.6 7827.0
9 1 1 1 12.539 25.079 0.141 39.56 8 181.6 4235.2
10 3 1 0 12.644 25.287 0.142 38.88 4 333.0 6998.7
11 0 2 1 13.738 27.476 0.154 32.62 4 195.8 2030.2
12 1 2 1 14.323 28.646 0.161 29.85 8 190.4 3514.9
13 2 3 0 14.347 28.694 0.161 29.75 4 143.6 995.2
14 2 1 1 14.364 28.728 0.161 29.67 8 302.1 8789.3
15 3 2 0 14.415 28.831 0.162 29.45 4 156.7 1173.2
16 0 4 0 15.895 31.79 0.178 23.88 2 74.3 107.1
17 2 2 1 15.96 31.92 0.178 23.67 8 306.3 7207.7
18 4 0 0 16.093 32.187 0.18 23.25 2 54.9 56.8
19 1 4 0 16.41 32.82 0.183 22.29 4 11.8 5.0
20 3 0 1 16.522 33.043 0.185 21.96 4 294.5 3091.7
21 4 1 0 16.591 33.182 0.185 21.76 4 118.3 494.6
22 1 3 1 16.914 33.827 0.189 20.87 8 28.4 54.6
23 3 3 0 16.993 33.987 0.19 20.66 4 56.9 108.6
24 3 1 1 17.008 34.016 0.19 20.62 8 186.3 2323.3
25 2 4 0 17.876 35.751 0.199 18.5 4 352.4 3727.7
26 4 2 0 18.01 36.02 0.201 18.2 4 199.5 1175.9
27 2 3 1 18.344 36.688 0.204 17.48 8 160.1 1453.3
28 3 2 1 18.399 36.798 0.205 17.36 8 25.1 35.4
29 0 4 1 19.611 39.223 0.218 15.08 4 308.7 2333.0
30 1 4 1 20.043 40.085 0.222 14.37 8 274.2 3507.3
31 3 4 0 20.112 40.223 0.223 14.26 4 142.7 471.3
32 4 3 0 20.183 40.365 0.224 14.15 4 107.3 264.3
33 4 1 1 20.195 40.39 0.224 14.13 8 161.0 1188.4
34 1 5 0 20.444 40.888 0.227 13.75 4 15.8 5.6
35 3 3 1 20.536 41.073 0.228 13.61 8 70.0 216.6
36 5 1 0 20.683 41.367 0.229 13.39 4 119.2 309.1
37 2 4 1 21.293 42.585 0.236 12.55 8 136.7 761.0
38 4 2 1 21.409 42.818 0.237 12.4 8 192.7 1494.6
39 2 5 0 21.675 43.35 0.24 12.06 4 207.9 845.9
40 5 2 0 21.875 43.75 0.242 11.81 4 216.9 902.0
41 0 0 2 22.833 45.666 0.252 10.72 2 613.6 3276.9
42 4 4 0 22.935 45.869 0.253 10.62 4 192.1 635.8
43 3 4 1 23.254 46.509 0.256 10.29 8 74.9 187.6
44 4 3 1 23.318 46.635 0.257 10.23 8 398.7 5277.1
45 5 0 1 23.399 46.798 0.258 10.15 4 405.6 2709.6
46 1 5 1 23.551 47.102 0.259 10.0 8 179.9 1050.4
47 1 1 2 23.584 47.168 0.26 9.97 8 19.8 12.6
48 3 5 0 23.611 47.223 0.26 9.94 4 248.5 996.1
49 5 3 0 23.754 47.508 0.261 9.81 4 318.5 1614.9
50 5 1 1 23.765 47.53 0.262 9.8 8 90.3 259.1
51 0 6 0 24.256 48.512 0.267 9.35 2 403.9 1238.0
52 0 2 2 24.299 48.599 0.267 9.31 4 130.2 256.4
53 2 0 2 24.334 48.669 0.267 9.28 4 77.2 89.8
54 6 0 0 24.57 49.14 0.27 9.08 2 302.0 672.3
55 1 6 0 24.621 49.243 0.27 9.04 4 104.7 160.8
56 2 5 1 24.658 49.316 0.271 9.01 8 197.4 1139.7
57 1 2 2 24.664 49.328 0.271 9.0 8 102.4 306.7
58 2 1 2 24.69 49.38 0.271 8.98 8 58.6 100.3
59 5 2 1 24.839 49.679 0.273 8.86 8 48.4 67.3
60 6 1 0 24.923 49.847 0.274 8.79 4 207.3 612.9
61 2 6 0 25.694 51.388 0.281 8.2 4 106.9 152.3
62 2 2 2 25.736 51.471 0.282 8.17 8 199.1 1052.2
63 4 4 1 25.805 51.61 0.283 8.12 8 46.5 56.9
64 6 2 0 25.962 51.924 0.284 8.01 4 178.9 415.9
65 4 5 0 26.136 52.272 0.286 7.89 4 48.8 30.5
66 5 4 0 26.211 52.421 0.287 7.84 4 192.9 473.4
67 1 3 2 26.391 52.782 0.289 7.72 8 295.1 2181.3
68 3 5 1 26.427 52.853 0.289 7.69 8 235.2 1381.4
69 3 1 2 26.457 52.914 0.289 7.67 8 284.3 2012.7
70 5 3 1 26.558 53.116 0.29 7.61 8 120.0 355.4
71 0 6 1 27.022 54.044 0.295 7.31 4 307.4 1121.9
72 1 6 1 27.36 54.721 0.298 7.11 8 113.7 298.4
73 2 3 2 27.414 54.828 0.299 7.08 8 112.4 290.0
74 3 6 0 27.415 54.829 0.299 7.08 4 130.2 194.8
75 3 2 2 27.454 54.909 0.299 7.05 8 130.5 389.7
76 6 3 0 27.631 55.262 0.301 6.95 4 10.0 1.1
77 6 1 1 27.641 55.282 0.301 6.95 8 120.0 324.8
78 0 4 2 28.357 56.714 0.308 6.55 4 63.0 42.2
79 2 6 1 28.359 56.719 0.308 6.55 8 23.0 11.2
80 4 0 2 28.483 56.965 0.31 6.49 4 49.4 25.7
81 6 2 1 28.61 57.22 0.311 6.42 8 17.4 6.3
82 1 4 2 28.685 57.37 0.312 6.39 8 5.0 0.5
83 4 5 1 28.773 57.546 0.312 6.34 8 79.0 128.4
84 4 1 2 28.802 57.604 0.313 6.33 8 106.9 234.6
85 5 4 1 28.843 57.686 0.313 6.31 8 19.6 7.9
86 1 7 0 28.965 57.929 0.314 6.25 4 36.6 13.6
87 3 3 2 29.065 58.129 0.315 6.2 8 47.3 45.1
88 5 5 0 29.15 58.3 0.316 6.16 4 79.8 63.6
89 7 1 0 29.335 58.67 0.318 6.07 4 10.9 1.2
90 2 4 2 29.655 59.31 0.321 5.93 8 298.5 1713.9
91 4 6 0 29.709 59.418 0.322 5.9 4 89.6 76.9
92 4 2 2 29.746 59.493 0.322 5.88 8 168.5 542.4
93 6 4 0 29.861 59.722 0.323 5.83 4 190.2 342.6
94 2 7 0 29.929 59.858 0.324 5.8 4 76.8 55.5
95 3 6 1 29.976 59.952 0.324 5.78 8 143.5 386.7
96 6 3 1 30.18 60.361 0.326 5.7 8 135.1 337.6
97 7 2 0 30.269 60.538 0.327 5.66 4 292.2 784.4
98 3 4 2 31.23 62.46 0.337 5.28 8 123.2 260.2
99 4 3 2 31.282 62.564 0.337 5.26 8 92.7 146.8
100 1 7 1 31.446 62.892 0.339 5.2 8 216.1 788.5
101 1 5 2 31.473 62.946 0.339 5.19 8 11.7 2.3
102 3 7 0 31.496 62.991 0.339 5.18 4 325.0 888.8
103 7 0 1 31.498 62.996 0.339 5.18 4 24.1 4.9
104 5 5 1 31.623 63.245 0.34 5.14 8 26.4 11.6
105 5 1 2 31.65 63.3 0.341 5.13 8 103.2 177.2
106 7 3 0 31.79 63.579 0.342 5.08 4 44.3 16.2
107 7 1 1 31.799 63.597 0.342 5.08 8 50.3 41.6
108 4 6 1 32.156 64.311 0.345 4.95 8 27.7 12.3
109 6 4 1 32.301 64.602 0.347 4.91 8 122.5 239.0
110 2 7 1 32.366 64.732 0.347 4.88 8 186.8 553.3
111 2 5 2 32.393 64.785 0.348 4.88 8 181.2 519.5
112 5 6 0 32.509 65.018 0.349 4.84 4 156.2 191.5
113 5 2 2 32.545 65.09 0.349 4.83 8 187.4 550.1
114 6 5 0 32.589 65.177 0.35 4.81 4 158.3 195.8
115 7 2 1 32.692 65.383 0.351 4.78 8 291.1 1314.8
116 0 8 0 33.213 66.426 0.356 4.62 2 115.3 49.9
117 4 4 2 33.363 66.726 0.357 4.58 8 168.0 419.4
118 1 8 0 33.513 67.025 0.358 4.53 4 137.6 139.4
119 4 7 0 33.62 67.239 0.359 4.5 4 275.9 556.3
120 8 0 0 33.67 67.34 0.36 4.49 2 231.2 194.7
121 7 4 0 33.854 67.708 0.362 4.44 4 78.3 44.2
122 3 7 1 33.869 67.739 0.362 4.43 8 2.9 0.1
123 3 5 2 33.896 67.791 0.362 4.43 8 218.9 688.8
124 8 1 0 33.96 67.921 0.363 4.41 4 145.2 151.0
125 5 3 2 34.009 68.018 0.363 4.4 8 279.1 1111.5
126 7 3 1 34.152 68.305 0.364 4.36 8 5.7 0.5
127 2 8 0 34.404 68.807 0.367 4.29 4 87.0 52.7
128 0 6 2 34.41 68.82 0.367 4.29 4 356.4 884.9
129 6 0 2 34.663 69.326 0.369 4.23 4 266.3 486.6
130 1 6 2 34.705 69.409 0.37 4.22 8 92.5 117.2
131 8 2 0 34.825 69.65 0.371 4.19 4 92.9 58.7
132 5 6 1 34.847 69.694 0.371 4.18 8 306.8 1277.4
133 6 5 1 34.924 69.848 0.372 4.16 8 105.9 151.6
134 6 1 2 34.95 69.899 0.372 4.16 8 182.6 450.1
135 0 8 1 35.528 71.056 0.377 4.02 4 62.9 25.8
136 2 6 2 35.582 71.163 0.378 4.01 8 94.5 116.3
137 6 6 0 35.769 71.538 0.379 3.97 4 211.8 289.1
138 6 2 2 35.803 71.607 0.38 3.96 8 158.7 323.8
139 1 8 1 35.819 71.637 0.38 3.96 8 137.2 241.9
140 3 8 0 35.865 71.731 0.38 3.95 4 103.1 68.1
141 1 0 3 35.887 71.774 0.381 3.94 4 136.6 119.5
142 4 7 1 35.922 71.845 0.381 3.94 8 84.8 91.9
143 4 5 2 35.948 71.896 0.381 3.93 8 43.4 24.1
144 5 4 2 36.01 72.02 0.382 3.92 8 171.5 373.9
145 7 4 1 36.15 72.3 0.383 3.89 8 365.8 1688.4
146 1 1 3 36.169 72.338 0.383 3.88 8 140.7 249.7
147 8 3 0 36.245 72.49 0.384 3.87 4 14.8 1.4
148 8 1 1 36.253 72.507 0.384 3.87 8 238.8 716.0
149 5 7 0 36.258 72.516 0.384 3.87 4 49.7 15.5
150 7 5 0 36.423 72.846 0.385 3.83 4 64.2 25.7
151 2 8 1 36.684 73.368 0.388 3.78 8 249.9 766.5
152 0 2 3 36.724 73.449 0.388 3.77 4 145.8 130.1
153 1 2 3 37.011 74.022 0.391 3.72 8 149.2 268.7
154 3 6 2 37.024 74.047 0.391 3.72 8 115.3 160.4
155 2 1 3 37.032 74.063 0.391 3.71 8 224.7 608.6
156 8 2 1 37.094 74.189 0.392 3.7 8 31.1 11.6
157 6 3 2 37.208 74.415 0.393 3.68 8 8.8 0.9
158 2 2 3 37.866 75.732 0.398 3.57 8 228.3 603.4
159 4 8 0 37.872 75.745 0.398 3.57 4 37.8 8.3
160 6 6 1 38.016 76.032 0.4 3.54 8 131.9 200.0
161 3 8 1 38.11 76.22 0.401 3.53 8 10.8 1.3
162 3 0 3 38.177 76.354 0.401 3.52 4 217.4 269.6
163 8 4 0 38.197 76.394 0.401 3.51 4 106.4 64.5
164 1 9 0 38.324 76.648 0.403 3.49 4 269.0 410.1
165 1 7 2 38.357 76.715 0.403 3.49 8 32.9 12.2
166 1 3 3 38.399 76.798 0.403 3.48 8 24.6 6.9
167 3 1 3 38.453 76.906 0.404 3.47 8 140.0 220.9
168 8 3 1 38.481 76.963 0.404 3.47 8 75.8 64.6
169 5 7 1 38.494 76.988 0.404 3.47 8 175.9 348.2
170 5 5 2 38.519 77.038 0.404 3.46 8 71.4 57.2
171 7 5 1 38.656 77.312 0.405 3.44 8 28.9 9.3
172 7 1 2 38.681 77.361 0.406 3.44 8 9.7 1.0
173 9 1 0 38.863 77.725 0.407 3.41 4 184.2 187.7
174 4 6 2 39.009 78.018 0.409 3.39 8 80.2 70.8
175 6 4 2 39.143 78.286 0.41 3.37 8 170.4 317.7
176 2 9 0 39.17 78.339 0.41 3.37 4 132.7 96.2
177 2 7 2 39.203 78.405 0.41 3.36 8 68.8 51.7
178 2 3 3 39.244 78.488 0.411 3.35 8 119.8 156.2
179 3 2 3 39.278 78.555 0.411 3.35 8 19.6 4.2
180 6 7 0 39.384 78.768 0.412 3.34 4 133.6 96.7
181 7 6 0 39.471 78.942 0.413 3.32 4 85.5 39.5
182 7 2 2 39.504 79.008 0.413 3.32 8 262.2 740.7
183 9 2 0 39.685 79.37 0.415 3.3 4 122.1 79.8
184 0 4 3 40.038 80.075 0.418 3.25 4 239.6 302.9
185 4 8 1 40.078 80.157 0.418 3.24 8 202.5 432.0
186 1 4 3 40.317 80.633 0.42 3.22 8 212.4 471.1
187 8 4 1 40.398 80.796 0.421 3.21 8 33.3 11.5
188 5 8 0 40.402 80.805 0.421 3.21 4 88.1 40.3
189 4 1 3 40.416 80.833 0.421 3.2 8 124.6 161.4
190 1 9 1 40.523 81.046 0.422 3.19 8 121.1 151.9
191 3 9 0 40.568 81.136 0.422 3.19 4 46.0 11.0
192 3 7 2 40.601 81.202 0.422 3.18 8 292.6 884.7
193 3 3 3 40.642 81.284 0.423 3.18 8 54.0 30.1
194 8 5 0 40.662 81.323 0.423 3.18 4 252.0 327.4
195 9 0 1 40.783 81.565 0.424 3.16 4 323.9 538.5
196 7 3 2 40.866 81.733 0.425 3.15 8 39.9 16.3
197 9 3 0 41.046 82.092 0.426 3.13 4 227.5 263.1
198 9 1 1 41.054 82.108 0.426 3.13 8 58.3 34.6
199 2 4 3 41.151 82.303 0.427 3.12 8 106.7 115.3
200 4 2 3 41.231 82.462 0.428 3.11 8 150.6 229.3
201 2 9 1 41.357 82.714 0.429 3.1 8 44.6 20.0
202 5 6 2 41.52 83.041 0.43 3.08 8 141.0 199.0
203 6 7 1 41.569 83.137 0.431 3.08 8 205.1 420.3
204 6 5 2 41.593 83.186 0.431 3.08 8 142.4 202.5
205 7 6 1 41.655 83.309 0.431 3.07 8 45.8 20.9
206 9 2 1 41.866 83.732 0.433 3.05 8 4.6 0.2
207 0 8 2 42.166 84.332 0.436 3.02 4 104.3 53.4
208 1 8 2 42.442 84.885 0.438 3.0 8 124.0 149.8
209 4 9 0 42.509 85.017 0.439 2.99 4 191.7 178.5
210 3 4 3 42.536 85.072 0.439 2.99 8 59.3 34.1
211 4 7 2 42.541 85.083 0.439 2.99 8 249.8 605.8
212 5 8 1 42.576 85.152 0.439 2.99 8 114.5 127.2
213 4 3 3 42.582 85.164 0.439 2.99 8 316.8 973.5
214 8 0 2 42.588 85.176 0.439 2.99 4 209.4 212.5
215 5 0 3 42.641 85.282 0.44 2.98 4 322.1 502.3
216 3 9 1 42.74 85.481 0.441 2.97 8 102.2 100.9
217 1 5 3 42.753 85.505 0.441 2.97 8 143.0 197.3
218 7 4 2 42.759 85.517 0.441 2.97 8 70.9 48.5
219 8 5 1 42.833 85.666 0.441 2.97 8 174.9 294.5
220 8 1 2 42.857 85.715 0.442 2.97 8 131.3 166.0
221 5 1 3 42.911 85.821 0.442 2.96 8 72.3 50.2
222 9 4 0 42.937 85.874 0.442 2.96 4 172.7 143.2
223 7 7 0 42.995 85.991 0.443 2.95 4 7.0 0.2
224 0 10 0 43.211 86.423 0.444 2.94 2 79.0 14.9
225 9 3 1 43.214 86.428 0.444 2.94 8 55.3 29.2
226 2 8 2 43.27 86.541 0.445 2.93 8 78.5 58.7
227 6 8 0 43.448 86.896 0.446 2.92 4 93.9 41.8
228 1 10 0 43.487 86.974 0.447 2.92 4 159.1 119.9
229 2 5 3 43.58 87.16 0.447 2.91 8 158.0 235.9
230 8 6 0 43.632 87.265 0.448 2.91 4 146.0 100.7
231 8 2 2 43.665 87.329 0.448 2.91 8 83.7 66.1
232 5 2 3 43.718 87.436 0.449 2.9 8 39.0 14.4
233 10 0 0 43.869 87.738 0.45 2.89 2 118.2 32.8
234 10 1 0 44.138 88.275 0.452 2.88 4 143.5 96.1
235 2 10 0 44.313 88.627 0.453 2.87 4 207.2 199.7
236 4 4 3 44.465 88.93 0.455 2.86 8 37.6 13.1
237 6 6 2 44.556 89.112 0.455 2.85 8 192.5 343.0
238 3 8 2 44.647 89.294 0.456 2.85 8 93.7 81.2
239 4 9 1 44.669 89.338 0.456 2.85 8 227.6 478.5
240 10 2 0 44.944 89.887 0.459 2.83 4 3.2 0.0
241 3 5 3 44.956 89.913 0.459 2.83 8 189.9 331.5
242 5 9 0 44.988 89.977 0.459 2.83 4 109.1 54.6
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 1 1 0 5.591 11.181 7.90679 220.6 1.8 1.8 5.6
2 0 2 0 7.871 15.741 5.625 2166.2 18.0 18.1 5.6
3 2 0 0 7.967 15.934 5.5575 743.4 6.2 6.2 5.6
4 1 2 0 8.828 17.657 5.0189 2217.3 18.4 18.5 5.6
5 2 1 0 8.893 17.786 4.98268 661.1 5.5 5.5 5.6
6 2 2 0 11.235 22.471 3.95339 4511.0 37.4 37.5 5.6
7 1 0 1 11.89 23.78 3.73868 2456.6 20.4 20.4 5.6
8 1 3 0 12.52 25.04 3.55322 12062.2 100.0 100.0 5.6
9 3 1 0 12.644 25.287 3.51907 6998.7 58.0 58.0 5.6
10 0 2 1 13.738 27.476 3.24352 2030.2 16.8 16.8 5.6
11 1 2 1 14.323 28.646 3.11366 4510.1 37.4 37.3 5.6
12 2 1 1 14.364 28.728 3.10495 8789.3 72.9 72.7 5.6
13 3 2 0 14.415 28.831 3.09412 1173.2 9.7 9.7 5.6
14 2 2 1 15.96 31.92 2.80132 7207.7 59.8 59.4 5.6
15 3 0 1 16.522 33.043 2.70867 3091.7 25.6 25.5 5.6
16 4 1 0 16.591 33.182 2.69768 494.6 4.1 4.1 5.6
17 3 1 1 17.008 34.016 2.63342 2432.0 20.2 20.0 5.7
18 2 4 0 17.876 35.751 2.50945 3727.7 30.9 30.6 5.7
19 4 2 0 18.01 36.02 2.49134 1175.9 9.7 9.7 5.7
20 2 3 1 18.344 36.688 2.44751 1453.3 12.0 11.9 5.7
21 0 4 1 19.611 39.223 2.29496 2333.0 19.3 19.1 5.7
22 1 4 1 20.043 40.085 2.24755 3507.3 29.1 28.7 5.7
23 3 4 0 20.112 40.223 2.24017 471.3 3.9 3.9 5.7
24 4 1 1 20.195 40.39 2.23128 1452.8 12.0 11.9 5.7
25 3 3 1 20.536 41.073 2.19577 216.6 1.8 1.8 5.7
26 5 1 0 20.683 41.367 2.18083 309.1 2.6 2.5 5.7
27 2 4 1 21.293 42.585 2.12121 761.0 6.3 6.2 5.7
28 4 2 1 21.409 42.818 2.11024 1494.6 12.4 12.2 5.7
29 2 5 0 21.675 43.35 2.08556 845.9 7.0 6.9 5.7
30 5 2 0 21.875 43.75 2.06741 902.0 7.5 7.4 5.7
31 0 0 2 22.833 45.666 1.985 3276.9 27.2 26.7 5.7
32 4 4 0 22.935 45.869 1.9767 635.8 5.3 5.2 5.7
33 3 4 1 23.254 46.509 1.95099 187.6 1.6 1.5 5.7
34 4 3 1 23.318 46.635 1.94599 5277.1 43.7 42.9 5.7
35 5 0 1 23.399 46.798 1.93962 2709.6 22.5 22.0 5.7
36 1 5 1 23.551 47.102 1.92781 1050.4 8.7 8.5 5.7
37 3 5 0 23.611 47.223 1.92315 1008.7 8.4 8.2 5.7
38 5 3 0 23.754 47.508 1.91225 1874.0 15.5 15.2 5.7
39 0 6 0 24.256 48.512 1.875 1238.0 10.3 10.0 5.7
40 0 2 2 24.299 48.599 1.87187 256.4 2.1 2.1 5.7
41 6 0 0 24.57 49.14 1.8525 672.3 5.6 5.4 5.7
42 1 6 0 24.621 49.243 1.84888 160.8 1.3 1.3 5.7
43 2 5 1 24.658 49.316 1.8463 1446.4 12.0 11.7 5.7
44 6 1 0 24.923 49.847 1.82788 612.9 5.1 5.0 5.7
45 2 6 0 25.694 51.388 1.77661 152.3 1.3 1.2 5.8
46 2 2 2 25.736 51.471 1.77395 1052.2 8.7 8.5 5.8
47 6 2 0 25.962 51.924 1.75954 415.9 3.4 3.4 5.8
48 5 4 0 26.211 52.421 1.74401 473.4 3.9 3.8 5.8
49 1 3 2 26.391 52.782 1.73292 2181.3 18.1 17.6 5.8
50 3 5 1 26.427 52.853 1.73077 1381.4 11.5 11.1 5.8
51 3 1 2 26.457 52.914 1.72892 2012.7 16.7 16.2 5.8
52 5 3 1 26.558 53.116 1.72281 355.4 2.9 2.9 5.8
53 0 6 1 27.022 54.044 1.69542 1121.9 9.3 9.0 5.8
54 1 6 1 27.36 54.721 1.67603 298.4 2.5 2.4 5.8
55 2 3 2 27.414 54.828 1.673 484.8 4.0 3.9 5.8
56 3 2 2 27.454 54.909 1.67074 389.7 3.2 3.1 5.8
57 6 1 1 27.641 55.282 1.66035 326.0 2.7 2.6 5.8
58 4 1 2 28.802 57.604 1.59882 363.0 3.0 2.9 5.8
59 2 4 2 29.655 59.31 1.55683 1713.9 14.2 13.7 5.8
60 4 2 2 29.746 59.493 1.55248 542.4 4.5 4.3 5.8
61 6 4 0 29.861 59.722 1.54706 342.6 2.8 2.7 5.8
62 3 6 1 29.976 59.952 1.54167 386.7 3.2 3.1 5.8
63 6 3 1 30.18 60.361 1.53221 337.6 2.8 2.7 5.8
64 7 2 0 30.269 60.538 1.52814 784.4 6.5 6.3 5.8
65 3 4 2 31.23 62.46 1.48567 260.2 2.2 2.1 5.8
66 4 3 2 31.282 62.564 1.48346 146.8 1.2 1.2 5.8
67 1 7 1 31.446 62.892 1.4765 790.8 6.6 6.3 5.9
68 3 7 0 31.496 62.991 1.4744 893.7 7.4 7.1 5.9
69 5 1 2 31.65 63.3 1.46797 188.9 1.6 1.5 5.9
70 6 4 1 32.301 64.602 1.44148 239.0 2.0 1.9 5.9
71 2 7 1 32.366 64.732 1.43891 1072.7 8.9 8.5 5.9
72 5 6 0 32.509 65.018 1.43325 191.5 1.6 1.5 5.9
73 5 2 2 32.545 65.09 1.43185 550.1 4.6 4.4 5.9
74 6 5 0 32.589 65.177 1.43014 195.8 1.6 1.6 5.9
75 7 2 1 32.692 65.383 1.42614 1314.8 10.9 10.4 5.9
76 4 4 2 33.363 66.726 1.40066 419.4 3.5 3.3 5.9
77 1 8 0 33.513 67.025 1.39513 139.4 1.2 1.1 5.9
78 4 7 0 33.62 67.239 1.39121 556.3 4.6 4.4 5.9
79 8 0 0 33.67 67.34 1.38937 194.7 1.6 1.5 5.9
80 3 5 2 33.896 67.791 1.38122 688.8 5.7 5.4 5.9
81 8 1 0 33.96 67.921 1.3789 151.0 1.3 1.2 5.9
82 5 3 2 34.009 68.018 1.37717 1111.5 9.2 8.8 5.9
83 0 6 2 34.41 68.82 1.36305 937.6 7.8 7.4 5.9
84 6 0 2 34.663 69.326 1.35434 486.6 4.0 3.8 5.9
85 5 6 1 34.847 69.694 1.34809 1336.1 11.1 10.5 5.9
86 6 1 2 34.95 69.899 1.34463 601.6 5.0 4.7 5.9
87 6 6 0 35.769 71.538 1.3178 289.1 2.4 2.3 5.9
88 6 2 2 35.803 71.607 1.31671 565.7 4.7 4.4 5.9
89 1 0 3 35.887 71.774 1.31405 187.6 1.6 1.5 5.9
90 5 4 2 36.01 72.02 1.31016 373.9 3.1 2.9 5.9
91 7 4 1 36.15 72.3 1.30578 1938.1 16.1 15.2 5.9
92 5 7 0 36.258 72.516 1.30242 732.9 6.1 5.7 5.9
93 2 8 1 36.684 73.368 1.28938 766.5 6.4 6.0 6.0
94 0 2 3 36.724 73.449 1.28817 130.1 1.1 1.0 6.0
95 2 1 3 37.032 74.063 1.27899 1037.7 8.6 8.1 6.0
96 2 2 3 37.866 75.732 1.2549 611.6 5.1 4.8 6.0
97 6 6 1 38.016 76.032 1.2507 200.0 1.7 1.6 6.0
98 3 0 3 38.177 76.354 1.24623 334.1 2.8 2.6 6.0
99 1 9 0 38.324 76.648 1.24217 410.1 3.4 3.2 6.0
100 3 1 3 38.453 76.906 1.23865 285.5 2.4 2.2 6.0
101 5 7 1 38.494 76.988 1.23753 405.4 3.4 3.1 6.0
102 9 1 0 38.863 77.725 1.22763 187.7 1.6 1.5 6.0
103 6 4 2 39.143 78.286 1.22023 413.9 3.4 3.2 6.0
104 2 3 3 39.244 78.488 1.21759 156.2 1.3 1.2 6.0
105 7 2 2 39.504 79.008 1.21088 740.7 6.1 5.7 6.0
106 0 4 3 40.038 80.075 1.19741 302.9 2.5 2.3 6.0
107 4 8 1 40.078 80.157 1.19639 432.0 3.6 3.3 6.0
108 1 4 3 40.317 80.633 1.19052 471.1 3.9 3.6 6.1
109 4 1 3 40.416 80.833 1.18808 213.3 1.8 1.6 6.1
110 1 9 1 40.523 81.046 1.18549 151.9 1.3 1.2 6.1
111 3 7 2 40.601 81.202 1.18362 884.7 7.3 6.8 6.1
112 8 5 0 40.662 81.323 1.18216 357.4 3.0 2.7 6.1
113 9 0 1 40.783 81.565 1.17926 538.5 4.5 4.1 6.1
114 9 3 0 41.046 82.092 1.17302 297.7 2.5 2.3 6.1
115 4 2 3 41.231 82.462 1.16869 229.3 1.9 1.8 6.1
116 5 6 2 41.52 83.041 1.16201 199.0 1.6 1.5 6.1
117 6 7 1 41.569 83.137 1.16091 622.8 5.2 4.8 6.1
118 1 8 2 42.442 84.885 1.14141 149.8 1.2 1.1 6.1
119 4 9 0 42.509 85.017 1.13997 212.7 1.8 1.6 6.1
120 4 7 2 42.541 85.083 1.13926 605.8 5.0 4.6 6.1
121 8 0 2 42.588 85.176 1.13825 1313.3 10.9 10.0 6.1
122 5 0 3 42.641 85.282 1.1371 502.3 4.2 3.8 6.1
123 1 5 3 42.753 85.505 1.13471 346.6 2.9 2.6 6.1
124 8 5 1 42.833 85.666 1.13299 460.5 3.8 3.5 6.1
125 9 4 0 42.937 85.874 1.13078 193.4 1.6 1.5 6.1
126 2 5 3 43.58 87.16 1.11738 235.9 2.0 1.8 6.2
127 2 10 0 44.313 88.627 1.10264 199.7 1.7 1.5 6.2
128 6 6 2 44.556 89.112 1.09789 343.0 2.8 2.6 6.2
129 4 9 1 44.669 89.338 1.09569 559.7 4.6 4.2 6.2
130 3 5 3 44.956 89.913 1.09017 331.5 2.7 2.5 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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