Institute of Experimental Mineralogy
Russian Academy of Sciences
-------------------------------------------------
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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LUKKULAISVAARAITE
1
Pd(14)Ag(2)Te(9)
Tetragonal I 4/m Z = 2
I4/m
4 .10 .16
Ref.Str.:
Vymazalova A., Grokhovskaya T.L., Laufek F., Rassulov V.A. (2014)
* Mineral. Mag., 78, 1743-1754
L: $Pd14 Ag2 Te9$
R: Locality - Lukkulaisvaara intrusion, northern Russian Karelia, Russia.
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.9599 alpha = 90.0
b = 8.9599 beta = 90.0
c = 11.822 gamma = 90.0
Unit cell volume (cub. angs.) = 949.07
Molar volume ( cub.cm/mol.) = 285.83
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.5718 0.279 0.3616 0.65 Pd = 1.00
2 0.7051 0.4068 0.0 0.6 Pd = 1.00
3 0.5 0.0 0.0 0.8 Pd = 1.00
4 0.5 0.5 0.1919 0.8 Ag = 1.00
5 0.5 0.5 0.5 0.8 Te = 1.00
6 0.6262 0.188 0.148 0.7 Te = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.5718 0.279 0.3616
2 2 0.7051 0.4068 0.0
3 3 0.5 0.0 0.0
4 4 0.5 0.5 0.1919
5 5 0.5 0.5 0.5
6 6 0.6262 0.188 0.148
7 1 0.721 0.5718 0.3616
8 1 0.4282 0.721 0.3616
9 1 0.279 0.4282 0.3616
10 2 0.5932 0.7051 0.0
11 2 0.2949 0.5932 0.0
12 2 0.4068 0.2949 0.0
13 3 0.0 0.5 0.0
14 6 0.812 0.6262 0.148
15 6 0.3738 0.812 0.148
16 6 0.188 0.3738 0.148
17 1 0.9282 0.221 0.8616
18 2 0.7949 0.0932 0.5
19 3 0.0 0.5 0.5
20 4 0.0 0.0 0.6919
21 5 0.0 0.0 0.0
22 6 0.8738 0.312 0.648
23 1 0.779 0.9282 0.8616
24 1 0.0718 0.779 0.8616
25 1 0.221 0.0718 0.8616
26 2 0.9068 0.7949 0.5
27 2 0.2051 0.9068 0.5
28 2 0.0932 0.2051 0.5
29 3 0.5 0.0 0.5
30 6 0.688 0.8738 0.648
31 6 0.1262 0.688 0.648
32 6 0.312 0.1262 0.648
33 1 0.5718 0.279 0.6384
34 4 0.5 0.5 0.8081
35 6 0.6262 0.188 0.852
36 1 0.721 0.5718 0.6384
37 1 0.4282 0.721 0.6384
38 1 0.279 0.4282 0.6384
39 6 0.812 0.6262 0.852
40 6 0.3738 0.812 0.852
41 6 0.188 0.3738 0.852
42 1 0.9282 0.221 0.1384
43 4 0.0 0.0 0.3081
44 6 0.8738 0.312 0.352
45 1 0.779 0.9282 0.1384
46 1 0.0718 0.779 0.1384
47 1 0.221 0.0718 0.1384
48 6 0.688 0.8738 0.352
49 6 0.1262 0.688 0.352
50 6 0.312 0.1262 0.352
X-ray density (g/cm cub.) = 9.98
MU (1/cm) = 2370.838 Mass attenuation coefficient (cm**2/g) = 237.491
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Pd 3.3 4
2.648 5
2.6979 6
2.7244 6
2.7029 6
2 Pd 3.3 4
2.7211 6
2.8005 6
2.7211 6
2.8006 6
3 Pd 3.3 4
2.679 6
2.679 6
2.679 6
2.679 6
4 Ag 3.888 5
3.6424 5
3.0598 6
3.0598 6
3.0598 6
3.0598 6
5 Te 5.064 8
4.1371 6
4.1371 6
4.1371 6
4.1371 6
4.1371 6
4.1371 6
4.1371 6
4.1371 6
6 Te 5.064 8
4.2646 6
4.0576 6
4.2646 6
4.1371 5
3.4993 6
3.4601 6
3.7481 6
3.7481 6
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 1 6.193 12.385 0.07 168.91 8 8.4 10.5
2 1 1 0 6.983 13.967 0.079 132.34 4 88.9 464.7
3 0 0 2 7.488 14.975 0.085 114.82 2 150.3 575.7
4 2 0 0 9.901 19.801 0.112 64.73 4 21.1 12.8
5 1 1 2 10.266 20.532 0.116 60.05 8 86.1 395.5
6 1 2 1 11.711 23.422 0.132 45.66 8 162.2 1066.8
7 2 1 1 11.711 23.422 0.132 45.66 8 0.0 0.0
8 1 0 3 12.33 24.66 0.139 40.99 8 138.7 699.9
9 2 0 2 12.459 24.918 0.14 40.1 8 144.8 746.4
10 2 2 0 14.073 28.146 0.158 30.99 4 57.3 45.2
11 0 0 4 15.107 30.214 0.169 26.64 2 585.6 2028.1
12 3 0 1 15.427 30.854 0.173 25.46 8 71.7 116.3
13 1 3 0 15.775 31.55 0.176 24.27 4 350.9 1327.0
14 3 1 0 15.775 31.55 0.176 24.27 4 674.6 4904.7
15 1 2 3 15.912 31.824 0.178 23.82 8 29.6 18.5
16 2 1 3 15.912 31.824 0.178 23.82 8 721.1 11003.4
17 2 2 2 16.014 32.028 0.179 23.49 8 76.0 120.6
18 1 1 4 16.714 33.427 0.187 21.42 8 74.7 106.2
19 1 3 2 17.546 35.093 0.196 19.26 8 3.3 0.2
20 3 1 2 17.546 35.093 0.196 19.26 8 681.5 7946.3
21 2 0 4 18.194 36.388 0.203 17.79 8 453.8 3254.3
22 2 3 1 18.466 36.932 0.206 17.22 8 516.3 4077.7
23 3 2 1 18.466 36.932 0.206 17.22 8 224.5 771.3
24 3 0 3 18.882 37.763 0.21 16.4 8 473.9 3270.7
25 1 0 5 19.69 39.38 0.219 14.95 8 318.5 1346.9
26 4 0 0 20.113 40.227 0.223 14.26 4 157.0 156.1
27 2 2 4 20.882 41.764 0.231 13.11 8 429.7 2150.0
28 1 4 1 21.125 42.25 0.234 12.78 8 470.8 2514.8
29 4 1 1 21.125 42.25 0.234 12.78 8 558.4 3538.2
30 3 3 0 21.391 42.783 0.237 12.42 4 345.1 657.1
31 2 3 3 21.497 42.994 0.238 12.29 8 587.3 3763.0
32 3 2 3 21.497 42.994 0.238 12.29 8 368.2 1479.2
33 4 0 2 21.576 43.153 0.239 12.18 8 130.8 185.0
34 1 3 4 22.124 44.248 0.244 11.52 8 483.6 2392.0
35 3 1 4 22.124 44.248 0.244 11.52 8 992.5 10076.2
36 1 2 5 22.227 44.453 0.246 11.4 8 35.4 12.7
37 2 1 5 22.227 44.453 0.246 11.4 8 128.7 167.7
38 2 4 0 22.611 45.221 0.25 10.96 4 1044.9 5316.3
39 4 2 0 22.611 45.221 0.25 10.96 4 606.1 1788.8
40 3 3 2 22.788 45.576 0.251 10.77 8 0.8 0.0
41 0 0 6 23.013 46.026 0.254 10.54 2 1239.3 3592.8
42 1 4 3 23.878 47.755 0.263 9.69 8 454.2 1776.0
43 4 1 3 23.878 47.755 0.263 9.69 8 190.3 311.8
44 2 4 2 23.951 47.902 0.264 9.62 8 224.5 430.7
45 4 2 2 23.951 47.902 0.264 9.62 8 2.8 0.1
46 1 1 6 24.168 48.335 0.266 9.43 8 3.5 0.1
47 3 0 5 24.552 49.103 0.27 9.1 8 95.5 73.6
48 2 0 6 25.282 50.565 0.277 8.51 8 16.1 2.0
49 4 0 4 25.562 51.124 0.28 8.3 8 281.7 585.2
50 3 4 1 25.77 51.54 0.282 8.15 8 33.0 7.9
51 4 3 1 25.77 51.54 0.282 8.15 8 303.0 664.3
52 5 0 1 25.77 51.54 0.282 8.15 8 314.8 717.2
53 1 5 0 25.999 51.999 0.285 7.98 4 185.0 121.4
54 5 1 0 25.999 51.999 0.285 7.98 4 169.6 101.9
55 3 3 4 26.634 53.268 0.291 7.56 8 350.7 825.8
56 2 3 5 26.723 53.447 0.292 7.5 8 29.7 5.9
57 3 2 5 26.723 53.447 0.292 7.5 8 67.4 30.3
58 1 5 2 27.214 54.429 0.297 7.2 8 67.4 29.0
59 5 1 2 27.214 54.429 0.297 7.2 8 70.8 32.0
60 2 2 6 27.412 54.825 0.299 7.08 8 46.6 13.6
61 1 0 7 27.654 55.307 0.301 6.94 8 168.0 173.9
62 2 4 4 27.677 55.353 0.302 6.93 8 95.1 55.7
63 4 2 4 27.677 55.353 0.302 6.93 8 144.7 128.8
64 2 5 1 27.874 55.747 0.303 6.82 8 141.2 120.6
65 5 2 1 27.874 55.747 0.303 6.82 8 211.1 269.7
66 3 4 3 28.178 56.355 0.307 6.65 8 85.1 42.7
67 4 3 3 28.178 56.355 0.307 6.65 8 252.9 377.6
68 5 0 3 28.178 56.355 0.307 6.65 8 262.5 406.8
69 1 3 6 28.436 56.872 0.309 6.51 8 105.1 63.9
70 3 1 6 28.436 56.872 0.309 6.51 8 258.4 386.3
71 1 4 5 28.779 57.558 0.313 6.34 8 136.5 104.8
72 4 1 5 28.779 57.558 0.313 6.34 8 90.2 45.8
73 4 4 0 29.099 58.198 0.316 6.18 4 139.5 53.5
74 1 2 7 29.667 59.333 0.321 5.92 8 311.0 508.5
75 2 1 7 29.667 59.333 0.321 5.92 8 3.8 0.1
76 3 5 0 30.085 60.17 0.325 5.74 4 365.8 340.8
77 5 3 0 30.085 60.17 0.325 5.74 4 141.5 51.0
78 2 5 3 30.168 60.336 0.326 5.7 8 310.9 489.5
79 5 2 3 30.168 60.336 0.326 5.7 8 185.5 174.2
80 4 4 2 30.23 60.46 0.327 5.68 8 36.4 6.7
81 1 5 4 30.663 61.326 0.331 5.5 8 14.0 1.0
82 5 1 4 30.663 61.326 0.331 5.5 8 43.6 9.3
83 6 0 0 31.052 62.104 0.335 5.35 4 76.3 13.8
84 3 5 2 31.195 62.389 0.336 5.29 8 131.5 81.3
85 5 3 2 31.195 62.389 0.336 5.29 8 49.6 11.6
86 4 0 6 31.376 62.753 0.338 5.23 8 71.3 23.6
87 0 0 8 31.416 62.833 0.338 5.21 2 828.2 793.9
88 3 0 7 31.599 63.197 0.34 5.15 8 112.5 57.9
89 1 6 1 31.801 63.603 0.342 5.07 8 78.1 27.5
90 6 1 1 31.801 63.603 0.342 5.07 8 145.6 95.5
91 6 0 2 32.142 64.285 0.345 4.96 8 4.8 0.1
92 3 3 6 32.321 64.642 0.347 4.9 8 225.0 220.3
93 1 1 8 32.36 64.721 0.347 4.89 8 99.1 42.6
94 3 4 5 32.64 65.28 0.35 4.8 8 176.3 132.4
95 4 3 5 32.64 65.28 0.35 4.8 8 80.2 27.4
96 5 0 5 32.64 65.28 0.35 4.8 8 82.4 28.9
97 2 6 0 32.937 65.874 0.353 4.7 4 123.7 32.0
98 6 2 0 32.937 65.874 0.353 4.7 4 820.9 1407.5
99 2 4 6 33.251 66.503 0.356 4.61 8 729.1 2176.4
100 4 2 6 33.251 66.503 0.356 4.61 8 286.7 336.5
101 2 0 8 33.29 66.58 0.356 4.6 8 112.3 51.5
102 2 3 7 33.467 66.934 0.358 4.55 8 447.6 809.1
103 3 2 7 33.467 66.934 0.358 4.55 8 260.9 275.0
104 4 4 4 33.487 66.975 0.358 4.54 8 185.5 138.7
105 4 5 1 33.664 67.327 0.36 4.49 8 6.0 0.1
106 5 4 1 33.664 67.327 0.36 4.49 8 159.3 101.2
107 1 6 3 33.936 67.873 0.362 4.42 8 571.3 1280.0
108 6 1 3 33.936 67.873 0.362 4.42 8 187.6 138.0
109 2 6 2 33.995 67.99 0.363 4.4 8 114.8 51.5
110 6 2 2 33.995 67.99 0.363 4.4 8 193.2 145.9
111 3 5 4 34.402 68.803 0.367 4.29 8 252.1 242.4
112 5 3 4 34.402 68.803 0.367 4.29 8 89.2 30.4
113 2 5 5 34.479 68.957 0.367 4.27 8 266.4 269.5
114 5 2 5 34.479 68.957 0.367 4.27 8 216.9 178.5
115 2 2 8 35.112 70.224 0.373 4.12 8 194.1 137.8
116 1 4 7 35.285 70.569 0.375 4.08 8 405.2 594.7
117 4 1 7 35.285 70.569 0.375 4.08 8 676.3 1656.5
118 6 0 4 35.305 70.609 0.375 4.07 8 204.7 151.5
119 3 6 1 35.477 70.953 0.377 4.03 8 424.7 646.1
120 6 3 1 35.477 70.953 0.377 4.03 8 295.8 313.5
121 4 5 3 35.743 71.486 0.379 3.97 8 574.2 1163.9
122 5 4 3 35.743 71.486 0.379 3.97 8 576.4 1172.7
123 1 5 6 35.97 71.94 0.381 3.93 8 98.6 33.9
124 5 1 6 35.97 71.94 0.381 3.93 8 25.3 2.2
125 1 3 8 36.007 72.014 0.382 3.92 8 353.9 435.8
126 3 1 8 36.007 72.014 0.382 3.92 8 29.3 3.0
127 1 0 9 36.347 72.694 0.385 3.85 8 1.0 0.0
128 2 6 4 37.082 74.164 0.391 3.7 8 206.4 140.2
129 6 2 4 37.082 74.164 0.391 3.7 8 92.7 28.3
130 7 0 1 37.251 74.502 0.393 3.67 8 234.8 180.0
131 1 7 0 37.438 74.875 0.395 3.64 4 73.9 8.8
132 5 5 0 37.438 74.875 0.395 3.64 4 45.3 3.3
133 7 1 0 37.438 74.875 0.395 3.64 4 403.2 262.8
134 3 6 3 37.512 75.024 0.395 3.63 8 406.0 531.0
135 6 3 3 37.512 75.024 0.395 3.63 8 238.4 183.1
136 1 6 5 38.033 76.065 0.4 3.54 8 118.1 43.8
137 6 1 5 38.033 76.065 0.4 3.54 8 73.2 16.8
138 1 2 9 38.106 76.211 0.401 3.53 8 148.1 68.7
139 2 1 9 38.106 76.211 0.401 3.53 8 286.2 256.5
140 4 6 0 38.311 76.623 0.402 3.49 4 345.3 185.0
141 6 4 0 38.311 76.623 0.402 3.49 4 475.2 350.3
142 1 7 2 38.441 76.882 0.404 3.47 8 342.6 362.2
143 5 5 2 38.441 76.882 0.404 3.47 8 347.2 371.9
144 7 1 2 38.441 76.882 0.404 3.47 8 5.5 0.1
145 4 4 6 38.607 77.213 0.405 3.45 8 109.8 36.9
146 4 0 8 38.643 77.286 0.405 3.44 8 17.6 0.9
147 3 4 7 38.809 77.619 0.407 3.42 8 164.8 82.4
148 4 3 7 38.809 77.619 0.407 3.42 8 467.4 663.0
149 5 0 7 38.809 77.619 0.407 3.42 8 480.4 700.5
150 2 7 1 38.995 77.99 0.408 3.39 8 110.7 36.9
151 7 2 1 38.995 77.99 0.408 3.39 8 128.0 49.3
152 7 0 3 39.252 78.505 0.411 3.35 8 837.5 2089.2
153 4 6 2 39.308 78.615 0.411 3.35 8 46.6 6.4
154 6 4 2 39.308 78.615 0.411 3.35 8 226.6 152.6
155 3 5 6 39.472 78.945 0.413 3.32 8 119.8 42.4
156 5 3 6 39.472 78.945 0.413 3.32 8 124.5 45.7
157 3 3 8 39.508 79.017 0.413 3.32 8 254.8 191.4
158 4 5 5 39.766 79.532 0.415 3.28 8 87.9 22.6
159 5 4 5 39.766 79.532 0.415 3.28 8 159.2 73.9
160 3 0 9 39.838 79.676 0.416 3.28 8 174.7 88.8
161 6 0 6 40.333 80.666 0.42 3.21 8 118.4 40.0
162 2 4 8 40.369 80.737 0.42 3.21 8 355.9 361.1
163 4 2 8 40.369 80.737 0.42 3.21 8 212.0 128.2
164 2 5 7 40.533 81.066 0.422 3.19 8 308.5 269.6
165 5 2 7 40.533 81.066 0.422 3.19 8 139.9 55.4
166 0 0 10 40.66 81.319 0.423 3.18 2 288.0 58.5
167 3 7 0 40.899 81.798 0.425 3.15 4 289.8 117.5
168 7 3 0 40.899 81.798 0.425 3.15 4 214.1 64.1
169 2 7 3 40.971 81.943 0.426 3.14 8 160.0 71.5
170 7 2 3 40.971 81.943 0.426 3.14 8 237.1 156.8
171 1 7 4 41.408 82.815 0.429 3.1 8 230.3 145.8
172 5 5 4 41.408 82.815 0.429 3.1 8 255.7 179.8
173 7 1 4 41.408 82.815 0.429 3.1 8 364.4 365.2
174 3 6 5 41.48 82.96 0.43 3.09 8 154.0 65.1
175 6 3 5 41.48 82.96 0.43 3.09 8 106.2 30.9
176 1 1 10 41.515 83.029 0.43 3.08 8 151.5 62.9
177 2 3 9 41.551 83.103 0.431 3.08 8 25.6 1.8
178 3 2 9 41.551 83.103 0.431 3.08 8 226.6 140.5
179 3 7 2 41.88 83.759 0.433 3.05 8 81.5 18.0
180 7 3 2 41.88 83.759 0.433 3.05 8 84.3 19.2
181 2 6 6 42.042 84.084 0.435 3.03 8 32.3 2.8
182 6 2 6 42.042 84.084 0.435 3.03 8 590.4 939.5
183 4 6 4 42.26 84.52 0.437 3.01 8 85.5 19.6
184 6 4 4 42.26 84.52 0.437 3.01 8 730.1 1427.2
185 2 0 10 42.366 84.733 0.437 3.01 8 367.2 360.0
186 5 6 1 42.423 84.846 0.438 3.0 8 181.8 88.1
187 6 5 1 42.423 84.846 0.438 3.0 8 72.3 13.9
188 1 5 8 42.928 85.856 0.442 2.96 8 47.6 6.0
189 5 1 8 42.928 85.856 0.442 2.96 8 1.4 0.0
190 7 0 5 43.182 86.363 0.444 2.94 8 237.9 147.8
191 1 4 9 43.252 86.505 0.445 2.94 8 51.4 6.9
192 4 1 9 43.252 86.505 0.445 2.94 8 128.9 43.3
193 8 0 0 43.453 86.906 0.446 2.92 4 26.3 0.9
194 1 6 7 43.939 87.878 0.45 2.89 8 85.6 18.8
195 6 1 7 43.939 87.878 0.45 2.89 8 74.8 14.4
196 2 2 10 44.064 88.128 0.451 2.88 8 300.5 231.0
197 1 8 1 44.12 88.24 0.452 2.88 8 241.6 149.1
198 4 7 1 44.12 88.24 0.452 2.88 8 180.4 83.1
199 7 4 1 44.12 88.24 0.452 2.88 8 121.7 37.8
200 8 1 1 44.12 88.24 0.452 2.88 8 135.6 47.0
201 5 6 3 44.372 88.745 0.454 2.86 8 175.2 78.1
202 6 5 3 44.372 88.745 0.454 2.86 8 197.2 98.8
203 8 0 2 44.427 88.853 0.454 2.86 8 33.4 2.8
204 3 7 4 44.805 89.609 0.457 2.84 8 89.2 20.0
205 7 3 4 44.805 89.609 0.457 2.84 8 91.2 20.9
206 2 7 5 44.877 89.753 0.458 2.83 8 15.4 0.6
207 7 2 5 44.877 89.753 0.458 2.83 8 163.7 67.5
208 1 3 10 44.911 89.822 0.458 2.83 8 323.4 263.2
209 3 1 10 44.911 89.822 0.458 2.83 8 613.6 947.3
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 6.983 13.967 6.33561 464.7 3.7 3.8 5.6
2 0 0 2 7.488 14.975 5.911 575.7 4.6 4.7 5.6
3 1 1 2 10.266 20.532 4.32203 395.5 3.2 3.2 5.6
4 1 2 1 11.711 23.422 3.79493 1066.8 8.6 8.7 5.6
5 1 0 3 12.33 24.66 3.6072 699.9 5.6 5.7 5.6
6 2 0 2 12.459 24.918 3.57037 746.4 6.0 6.1 5.6
7 0 0 4 15.107 30.214 2.9555 2028.1 16.3 16.5 5.6
8 3 1 0 15.775 31.55 2.83337 6231.7 50.0 50.6 5.6
9 2 1 3 15.912 31.824 2.80963 11021.9 88.4 89.5 5.6
10 3 1 2 17.546 35.093 2.55501 7946.3 63.7 64.3 5.7
11 2 0 4 18.194 36.388 2.46701 3254.3 26.1 26.3 5.7
12 2 3 1 18.466 36.932 2.43188 4849.0 38.9 39.2 5.7
13 3 0 3 18.882 37.763 2.38025 3270.7 26.2 26.4 5.7
14 1 0 5 19.69 39.38 2.28614 1346.9 10.8 10.9 5.7
15 4 0 0 20.113 40.227 2.23997 156.1 1.3 1.3 5.7
16 2 2 4 20.882 41.764 2.16101 2150.0 17.2 17.3 5.7
17 4 1 1 21.125 42.25 2.13729 6053.0 48.5 48.7 5.7
18 3 3 0 21.391 42.783 2.11187 657.1 5.3 5.3 5.7
19 2 3 3 21.497 42.994 2.10198 5242.2 42.0 42.1 5.7
20 4 0 2 21.576 43.153 2.09462 185.0 1.5 1.5 5.7
21 3 1 4 22.124 44.248 2.04531 12468.2 100.0 100.0 5.7
22 2 1 5 22.227 44.453 2.03632 180.4 1.4 1.4 5.7
23 2 4 0 22.611 45.221 2.00349 7105.1 57.0 56.9 5.7
24 0 0 6 23.013 46.026 1.97033 3592.8 28.8 28.8 5.7
25 1 4 3 23.878 47.755 1.90293 2087.8 16.7 16.7 5.7
26 2 4 2 23.951 47.902 1.89746 430.8 3.5 3.4 5.7
27 4 0 4 25.562 51.124 1.78519 585.2 4.7 4.7 5.8
28 5 0 1 25.77 51.54 1.77174 1389.4 11.1 11.0 5.8
29 1 5 0 25.999 51.999 1.75718 223.3 1.8 1.8 5.8
30 3 3 4 26.634 53.268 1.71828 825.8 6.6 6.6 5.8
31 1 0 7 27.654 55.307 1.65963 358.4 2.9 2.8 5.8
32 5 2 1 27.874 55.747 1.64757 390.3 3.1 3.1 5.8
33 5 0 3 28.178 56.355 1.63124 827.1 6.6 6.5 5.8
34 3 1 6 28.436 56.872 1.61765 450.2 3.6 3.6 5.8
35 1 4 5 28.779 57.558 1.59997 150.6 1.2 1.2 5.8
36 1 2 7 29.667 59.333 1.55627 508.6 4.1 4.0 5.8
37 3 5 0 30.085 60.17 1.53661 391.8 3.1 3.1 5.8
38 2 5 3 30.168 60.336 1.53279 663.7 5.3 5.2 5.8
39 0 0 8 31.416 62.833 1.47775 793.9 6.4 6.2 5.9
40 3 3 6 32.321 64.642 1.44068 220.3 1.8 1.7 5.9
41 3 4 5 32.64 65.28 1.42815 188.8 1.5 1.5 5.9
42 6 2 0 32.937 65.874 1.41668 1439.4 11.5 11.2 5.9
43 2 4 6 33.251 66.503 1.40481 2512.9 20.2 19.6 5.9
44 2 3 7 33.467 66.934 1.39681 1222.8 9.8 9.5 5.9
45 1 6 3 33.936 67.873 1.37976 1418.0 11.4 11.0 5.9
46 6 2 2 33.995 67.99 1.37767 197.4 1.6 1.5 5.9
47 3 5 4 34.402 68.803 1.36335 272.7 2.2 2.1 5.9
48 2 5 5 34.479 68.957 1.36068 448.0 3.6 3.5 5.9
49 2 2 8 35.112 70.224 1.3392 137.8 1.1 1.1 5.9
50 4 1 7 35.285 70.569 1.3335 2402.7 19.3 18.6 5.9
51 3 6 1 35.477 70.953 1.32722 959.6 7.7 7.4 5.9
52 5 4 3 35.743 71.486 1.31863 2336.6 18.7 18.0 5.9
53 1 3 8 36.007 72.014 1.31025 438.8 3.5 3.4 5.9
54 2 6 4 37.082 74.164 1.2775 168.5 1.4 1.3 6.0
55 7 0 1 37.251 74.502 1.27255 180.0 1.4 1.4 6.0
56 7 1 0 37.438 74.875 1.26712 274.9 2.2 2.1 6.0
57 3 6 3 37.512 75.024 1.26498 714.0 5.7 5.5 6.0
58 2 1 9 38.106 76.211 1.2482 325.2 2.6 2.5 6.0
59 6 4 0 38.311 76.623 1.24251 535.3 4.3 4.1 6.0
60 5 5 2 38.441 76.882 1.23897 734.2 5.9 5.6 6.0
61 5 0 7 38.809 77.619 1.22904 1445.9 11.6 11.0 6.0
62 7 0 3 39.252 78.505 1.21738 2089.2 16.8 15.9 6.0
63 6 4 2 39.308 78.615 1.21594 159.1 1.3 1.2 6.0
64 3 3 8 39.508 79.017 1.21077 191.4 1.5 1.5 6.0
65 2 4 8 40.369 80.737 1.18925 489.3 3.9 3.7 6.1
66 2 5 7 40.533 81.066 1.18525 325.1 2.6 2.5 6.1
67 3 7 0 40.899 81.798 1.17649 181.6 1.5 1.4 6.1
68 7 2 3 40.971 81.943 1.17477 228.3 1.8 1.7 6.1
69 7 1 4 41.408 82.815 1.1646 690.7 5.5 5.2 6.1
70 3 2 9 41.551 83.103 1.1613 142.3 1.1 1.1 6.1
71 6 2 6 42.042 84.084 1.15023 942.3 7.6 7.1 6.1
72 6 4 4 42.26 84.52 1.14541 1446.8 11.6 10.8 6.1
73 2 0 10 42.366 84.733 1.14307 360.0 2.9 2.7 6.1
74 7 0 5 43.182 86.363 1.12563 147.8 1.2 1.1 6.1
75 2 2 10 44.064 88.128 1.10759 231.0 1.9 1.7 6.2
76 1 8 1 44.12 88.24 1.10646 317.0 2.5 2.4 6.2
77 6 5 3 44.372 88.745 1.10147 176.9 1.4 1.3 6.2
78 3 1 10 44.911 89.822 1.09104 1210.4 9.7 8.9 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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