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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XANTHOCONITE
2, t-xanthoconite, syn, f-proustite, g-xanthoconite
Ag(3)AsS(3)
Monoclinic C 2/c Z = 8
C2/c
8 .2 .18
Ref.Str.:
Rosenstingl J., Pertlik F. (1993)
* Mitt. Osterr. Mineralog. Gesellschaft., 138, 9-16
R: N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 12.02 alpha = 90.0
b = 6.262 beta = 110.9
c = 17.08 gamma = 90.0
Unit cell volume (cub. angs.) = 1201.01
Molar volume ( cub.cm/mol.) = 90.43
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.1421 0.0329 0.2171 0.0 Ag = 1.00
2 0.0641 0.9403 0.4388 0.0 Ag = 1.00
3 0.3603 0.0463 0.1373 0.0 Ag = 1.00
4 0.3577 0.0559 0.4288 0.0 As = 1.00
5 0.1535 0.1934 0.0846 0.0 S = 1.00
6 0.4255 0.1399 0.3258 0.0 S = 1.00
7 0.1658 0.1436 0.3599 0.0 S = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.1421 0.0329 0.2171
2 2 0.0641 0.9403 0.4388
3 3 0.3603 0.0463 0.1373
4 4 0.3577 0.0559 0.4288
5 5 0.1535 0.1934 0.0846
6 6 0.4255 0.1399 0.3258
7 7 0.1658 0.1436 0.3599
8 1 0.8579 0.9671 0.7829
9 2 0.9359 0.0597 0.5612
10 3 0.6397 0.9537 0.8627
11 4 0.6423 0.9441 0.5712
12 5 0.8465 0.8066 0.9154
13 6 0.5745 0.8601 0.6742
14 7 0.8342 0.8564 0.6401
15 1 0.1421 0.9671 0.7171
16 2 0.0641 0.0597 0.9388
17 3 0.3603 0.9537 0.6373
18 4 0.3577 0.9441 0.9288
19 5 0.1535 0.8066 0.5846
20 6 0.4255 0.8601 0.8258
21 7 0.1658 0.8564 0.8599
22 1 0.8579 0.0329 0.2829
23 2 0.9359 0.9403 0.0612
24 3 0.6397 0.0463 0.3627
25 4 0.6423 0.0559 0.0712
26 5 0.8465 0.1934 0.4154
27 6 0.5745 0.1399 0.1742
28 7 0.8342 0.1436 0.1401
29 1 0.6421 0.4671 0.7171
30 2 0.5641 0.5597 0.9388
31 3 0.8603 0.4537 0.6373
32 4 0.8577 0.4441 0.9288
33 5 0.6535 0.3066 0.5846
34 6 0.9255 0.3601 0.8258
35 7 0.6658 0.3564 0.8599
36 1 0.3579 0.5329 0.2829
37 2 0.4359 0.4403 0.0612
38 3 0.1397 0.5463 0.3627
39 4 0.1423 0.5559 0.0712
40 5 0.3465 0.6934 0.4154
41 6 0.0745 0.6399 0.1742
42 7 0.3342 0.6436 0.1401
43 1 0.6421 0.5329 0.2171
44 2 0.5641 0.4403 0.4388
45 3 0.8603 0.5463 0.1373
46 4 0.8577 0.5559 0.4288
47 5 0.6535 0.6934 0.0846
48 6 0.9255 0.6399 0.3258
49 7 0.6658 0.6436 0.3599
50 1 0.3579 0.4671 0.7829
51 2 0.4359 0.5597 0.5612
52 3 0.1397 0.4537 0.8627
53 4 0.1423 0.4441 0.5712
54 5 0.3465 0.3066 0.9154
55 6 0.0745 0.3601 0.6742
56 7 0.3342 0.3564 0.6401
X-ray density (g/cm cub.) = 5.47
MU (1/cm) = 943.897 Mass attenuation coefficient (cm**2/g) = 172.555
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ag 3.54 5
2.5242 5
3.3148 6
2.4525 7
3.5263 7
2.6132 6
2 Ag 3.54 4
2.4711 7
2.4795 5
2.9609 5
2.783 6
3 Ag 3.54 4
2.4982 5
3.086 6
2.4924 6
2.5437 7
4 As 3.012 3
2.2492 6
2.2517 7
2.2806 5
5 S 4.368 7
4.2619 6
4.2804 7
3.4782 6
4.0366 6
3.4778 7
4.0001 7
4.3611 5
6 S 4.368 9
4.2619 5
3.3736 7
3.6361 6
4.0366 5
3.4782 5
4.3278 7
4.2941 7
4.175 7
4.1401 7
7 S 4.368 8
3.3736 6
4.2804 5
4.0001 5
3.4778 5
4.2941 6
4.3278 6
4.1401 6
4.175 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 0 0 2 5.54 11.081 0.063 211.58 2 8.7 2.2
2 2 0 -2 7.858 15.716 0.089 104.04 2 45.8 30.3
3 2 0 0 7.885 15.771 0.089 103.31 2 24.2 8.4
4 1 1 -1 8.09 16.18 0.091 98.04 4 136.7 508.3
5 1 1 0 8.097 16.193 0.091 97.88 4 157.3 671.9
6 1 1 -2 8.993 17.986 0.101 78.92 4 88.1 170.0
7 1 1 1 9.011 18.021 0.102 78.6 4 14.8 4.8
8 1 1 -3 10.582 21.163 0.119 56.4 4 143.6 322.6
9 1 1 2 10.607 21.214 0.119 56.12 4 73.3 83.7
10 2 0 -4 11.122 22.243 0.125 50.86 2 55.0 21.3
11 0 0 4 11.134 22.267 0.125 50.74 2 327.7 755.5
12 2 0 2 11.18 22.36 0.126 50.3 2 295.7 609.8
13 1 1 -4 12.612 25.223 0.142 39.09 4 117.7 150.1
14 1 1 3 12.642 25.284 0.142 38.89 4 119.9 155.1
15 3 1 -2 13.262 26.524 0.149 35.15 4 309.6 934.6
16 3 1 -1 13.274 26.549 0.149 35.08 4 199.9 388.8
17 3 1 -3 13.836 27.672 0.155 32.13 4 70.2 43.9
18 3 1 0 13.872 27.744 0.156 31.96 4 168.9 252.9
19 0 2 0 14.242 28.484 0.16 30.22 2 851.4 3037.0
20 0 2 1 14.519 29.039 0.163 29.0 4 434.9 1521.2
21 4 0 -2 14.853 29.706 0.166 27.62 2 45.3 7.9
22 1 1 -5 14.919 29.838 0.167 27.36 4 9.3 0.7
23 3 1 -4 14.934 29.869 0.167 27.3 4 851.2 5485.2
24 1 1 4 14.953 29.905 0.167 27.23 4 785.9 4664.3
25 3 1 1 14.99 29.98 0.168 27.09 4 8.4 0.5
26 0 2 2 15.324 30.649 0.172 25.83 4 61.3 26.9
27 2 0 -6 15.825 31.65 0.177 24.11 2 532.8 948.7
28 4 0 -4 15.869 31.739 0.177 23.96 2 289.8 279.0
29 2 0 4 15.895 31.791 0.178 23.88 2 196.3 127.5
30 4 0 0 15.925 31.851 0.178 23.78 2 935.2 2883.6
31 2 2 -1 16.105 32.21 0.18 23.21 4 325.9 683.6
32 2 2 -2 16.347 32.694 0.183 22.47 4 15.5 1.5
33 2 2 0 16.361 32.722 0.183 22.43 4 41.1 10.5
34 3 1 -5 16.462 32.924 0.184 22.13 4 28.6 5.0
35 3 1 2 16.533 33.066 0.185 21.93 4 494.6 1487.4
36 0 2 3 16.587 33.175 0.185 21.77 4 16.4 1.6
37 0 0 6 16.837 33.674 0.188 21.08 2 308.1 277.3
38 2 2 -3 17.068 34.136 0.191 20.46 4 364.7 754.6
39 2 2 1 17.094 34.188 0.191 20.39 4 92.7 48.6
40 1 1 -6 17.413 34.826 0.194 19.59 4 365.7 726.5
41 1 1 5 17.449 34.897 0.195 19.5 4 57.2 17.7
42 2 2 -4 18.217 36.435 0.203 17.74 4 189.5 176.7
43 0 2 4 18.225 36.45 0.203 17.73 4 17.9 1.6
44 2 2 2 18.255 36.509 0.203 17.66 4 348.3 594.3
45 3 1 -6 18.325 36.649 0.204 17.52 4 276.9 372.4
46 3 1 3 18.408 36.816 0.205 17.34 4 46.2 10.3
47 4 0 -6 18.67 37.341 0.208 16.81 2 363.8 308.5
48 4 0 2 18.768 37.535 0.209 16.62 2 287.2 190.1
49 2 2 -5 19.731 39.463 0.219 14.88 4 203.2 170.3
50 2 2 3 19.778 39.556 0.22 14.8 4 46.1 8.7
51 1 1 -7 20.046 40.091 0.222 14.36 4 33.7 4.5
52 1 1 6 20.083 40.166 0.223 14.3 4 162.3 104.5
53 5 1 -3 20.118 40.236 0.223 14.25 4 51.2 10.3
54 5 1 -2 20.132 40.264 0.223 14.23 4 453.0 809.7
55 0 2 5 20.161 40.321 0.224 14.18 4 293.5 338.7
56 3 1 -7 20.449 40.897 0.227 13.74 4 91.2 31.7
57 5 1 -4 20.514 41.027 0.227 13.64 4 22.5 1.9
58 3 1 4 20.541 41.083 0.228 13.6 4 39.9 6.0
59 5 1 -1 20.556 41.112 0.228 13.58 4 69.0 17.9
60 4 2 -2 20.811 41.623 0.231 13.21 4 40.1 5.9
61 4 2 -3 21.001 42.001 0.233 12.95 4 60.3 13.1
62 4 2 -1 21.023 42.045 0.233 12.92 4 551.8 1090.4
63 2 0 -8 21.149 42.297 0.234 12.74 2 875.4 1354.2
64 2 0 6 21.225 42.45 0.235 12.64 2 571.7 572.8
65 5 1 -5 21.301 42.602 0.236 12.54 4 35.8 4.4
66 5 1 0 21.369 42.738 0.237 12.45 4 12.3 0.5
67 2 2 -6 21.548 43.095 0.238 12.22 4 292.0 288.9
68 4 2 -4 21.582 43.163 0.239 12.18 4 116.0 45.4
69 2 2 4 21.602 43.203 0.239 12.15 4 172.8 100.7
70 4 2 0 21.625 43.25 0.239 12.12 4 539.1 977.1
71 1 3 -1 22.043 44.086 0.244 11.61 4 224.5 162.3
72 1 3 0 22.046 44.092 0.244 11.61 4 68.1 14.9
73 0 2 6 22.335 44.671 0.247 11.27 4 208.7 136.2
74 1 3 -2 22.422 44.843 0.248 11.17 4 38.1 4.5
75 1 3 1 22.43 44.859 0.248 11.17 4 109.3 37.0
76 5 1 -6 22.446 44.893 0.248 11.15 4 28.0 2.4
77 4 2 -5 22.53 45.061 0.249 11.05 4 73.0 16.3
78 5 1 1 22.538 45.075 0.249 11.04 4 127.0 49.4
79 4 2 1 22.593 45.186 0.249 10.98 4 121.7 45.1
80 4 0 -8 22.693 45.385 0.25 10.88 2 324.1 158.3
81 0 0 8 22.718 45.436 0.251 10.85 2 285.4 122.5
82 3 1 -8 22.78 45.561 0.251 10.78 4 109.1 35.6
83 6 0 -4 22.785 45.57 0.251 10.78 2 444.7 295.5
84 1 1 -8 22.793 45.586 0.251 10.77 4 354.8 375.8
85 6 0 -2 22.816 45.632 0.252 10.74 2 302.0 135.9
86 4 0 4 22.817 45.634 0.252 10.74 2 640.4 610.8
87 1 1 7 22.832 45.664 0.252 10.73 4 200.6 119.7
88 3 1 5 22.881 45.762 0.252 10.67 4 113.8 38.3
89 1 3 -3 23.167 46.334 0.255 10.38 4 316.4 288.0
90 1 3 2 23.18 46.359 0.256 10.37 4 275.1 217.5
91 2 2 -7 23.614 47.228 0.26 9.94 4 602.3 999.6
92 2 2 5 23.674 47.349 0.261 9.88 4 81.4 18.1
93 4 2 -6 23.812 47.624 0.262 9.75 4 280.5 212.8
94 4 2 2 23.892 47.784 0.263 9.68 4 314.3 265.1
95 5 1 -7 23.91 47.82 0.263 9.66 4 101.5 27.6
96 5 1 2 24.022 48.043 0.264 9.56 4 364.4 352.0
97 6 0 -6 24.215 48.431 0.266 9.39 2 657.6 562.9
98 1 3 -4 24.252 48.505 0.267 9.35 4 133.3 46.1
99 1 3 3 24.27 48.539 0.267 9.34 4 620.1 995.9
100 6 0 0 24.304 48.608 0.267 9.31 2 288.7 107.6
101 3 3 -2 24.629 49.258 0.271 9.03 4 309.1 239.3
102 3 3 -1 24.636 49.273 0.271 9.03 4 188.7 89.1
103 0 2 7 24.708 49.416 0.271 8.97 4 90.4 20.3
104 3 3 -3 24.973 49.945 0.274 8.75 4 301.6 220.8
105 3 3 0 24.994 49.989 0.274 8.73 4 225.5 123.2
106 3 1 -9 25.287 50.573 0.277 8.51 4 50.9 6.1
107 4 2 -7 25.39 50.78 0.278 8.43 4 35.6 3.0
108 3 1 6 25.394 50.788 0.278 8.42 4 194.6 88.5
109 4 2 3 25.485 50.97 0.279 8.36 4 226.5 118.8
110 1 3 -5 25.647 51.293 0.281 8.24 4 225.2 115.8
111 1 1 -9 25.647 51.294 0.281 8.24 4 61.8 8.7
112 5 1 -8 25.652 51.305 0.281 8.23 4 189.5 82.0
113 3 3 -4 25.656 51.313 0.281 8.23 4 715.4 1168.0
114 1 3 4 25.668 51.336 0.281 8.22 4 622.3 882.8
115 1 1 8 25.687 51.374 0.281 8.21 4 132.7 40.1
116 3 3 1 25.692 51.384 0.281 8.2 4 216.6 106.7
117 5 1 3 25.782 51.564 0.282 8.14 4 231.6 121.0
118 2 2 -8 25.892 51.785 0.283 8.06 4 510.5 582.4
119 2 2 6 25.958 51.916 0.284 8.01 4 451.2 452.4
120 3 3 -5 26.662 53.323 0.291 7.54 4 120.9 30.6
121 3 3 2 26.71 53.42 0.292 7.51 4 186.0 72.0
122 2 0 -10 26.894 53.788 0.294 7.39 2 271.3 75.4
123 6 0 -8 26.931 53.863 0.294 7.37 2 714.9 522.2
124 2 0 8 26.976 53.953 0.294 7.34 2 328.4 109.8
125 6 0 2 27.068 54.136 0.295 7.28 2 77.1 6.0
126 6 2 -3 27.16 54.32 0.296 7.23 4 318.6 203.5
127 4 2 -8 27.229 54.459 0.297 7.19 4 57.7 6.6
128 0 2 8 27.252 54.503 0.297 7.17 4 129.7 33.4
129 6 2 -4 27.31 54.621 0.298 7.14 4 113.9 25.7
130 1 3 -6 27.317 54.635 0.298 7.13 4 96.3 18.4
131 6 2 -2 27.337 54.675 0.298 7.12 4 274.1 148.3
132 4 2 4 27.338 54.676 0.298 7.12 4 185.6 68.0
133 1 3 5 27.342 54.684 0.298 7.12 4 6.4 0.1
134 4 0 -10 27.543 55.086 0.3 7.0 2 319.7 99.3
135 5 1 -9 27.64 55.28 0.301 6.95 4 151.7 44.3
136 4 0 6 27.687 55.373 0.302 6.92 2 571.6 313.5
137 7 1 -4 27.752 55.505 0.302 6.88 4 344.7 226.8
138 7 1 -3 27.768 55.536 0.302 6.87 4 45.6 4.0
139 6 2 -5 27.785 55.57 0.303 6.86 4 208.3 82.6
140 5 1 4 27.786 55.571 0.303 6.86 4 345.9 227.8
141 6 2 -1 27.839 55.678 0.303 6.83 4 130.6 32.3
142 3 1 -10 27.948 55.895 0.304 6.77 4 107.7 21.8
143 3 3 -6 27.965 55.93 0.304 6.76 4 45.3 3.8
144 3 3 3 28.025 56.05 0.305 6.73 4 264.1 130.2
145 7 1 -5 28.06 56.119 0.305 6.71 4 105.8 20.8
146 3 1 7 28.061 56.122 0.305 6.71 4 56.6 6.0
147 7 1 -2 28.106 56.213 0.306 6.69 4 587.0 639.1
148 2 2 -9 28.357 56.713 0.308 6.55 4 151.0 41.4
149 2 2 7 28.427 56.854 0.309 6.52 4 531.9 511.4
150 6 2 -6 28.574 57.148 0.31 6.44 4 398.6 283.9
151 1 1 -10 28.607 57.215 0.311 6.43 4 500.6 446.5
152 1 1 9 28.649 57.298 0.311 6.4 4 79.7 11.3
153 6 2 0 28.653 57.306 0.311 6.4 4 138.7 34.2
154 7 1 -6 28.683 57.366 0.312 6.39 4 143.4 36.4
155 7 1 -1 28.76 57.519 0.312 6.35 4 87.9 13.6
156 0 0 10 28.865 57.73 0.313 6.3 2 311.9 84.9
157 1 3 -7 29.236 58.471 0.317 6.12 4 155.8 41.2
158 1 3 6 29.264 58.528 0.317 6.1 4 23.5 0.9
159 5 3 -3 29.29 58.581 0.318 6.09 4 169.7 48.7
160 5 3 -2 29.301 58.602 0.318 6.09 4 154.9 40.5
161 4 2 -9 29.302 58.604 0.318 6.09 4 218.8 80.8
162 4 2 5 29.423 58.846 0.319 6.03 4 4.1 0.0
163 0 4 0 29.474 58.949 0.319 6.01 2 193.2 31.1
164 3 3 -7 29.542 59.083 0.32 5.98 4 20.6 0.7
165 5 3 -4 29.592 59.183 0.321 5.95 4 164.5 44.7
166 7 1 -7 29.61 59.219 0.321 5.95 4 173.5 49.6
167 3 3 4 29.613 59.225 0.321 5.94 4 69.0 7.8
168 5 3 -1 29.624 59.247 0.321 5.94 4 112.2 20.7
169 0 4 1 29.63 59.26 0.321 5.94 4 248.3 101.5
170 6 2 -7 29.66 59.32 0.321 5.92 4 270.1 119.8
171 7 1 0 29.715 59.429 0.322 5.9 4 279.4 127.7
172 6 2 1 29.763 59.526 0.322 5.88 4 285.3 132.6
173 5 1 -10 29.846 59.692 0.323 5.84 4 339.3 186.5
174 0 2 9 29.953 59.906 0.324 5.79 4 71.0 8.1
175 5 1 5 30.006 60.013 0.325 5.77 4 92.6 13.7
176 0 4 2 30.094 60.188 0.325 5.73 4 83.3 11.0
177 5 3 -5 30.199 60.398 0.327 5.69 4 273.9 118.3
178 5 3 0 30.252 60.504 0.327 5.67 4 106.9 17.9
179 2 4 -1 30.561 61.122 0.33 5.54 4 289.7 128.9
180 6 0 -10 30.702 61.404 0.331 5.48 2 294.8 66.1
181 2 4 -2 30.709 61.418 0.331 5.48 4 58.0 5.1
182 2 4 0 30.717 61.435 0.332 5.48 4 59.3 5.3
183 3 1 -11 30.755 61.51 0.332 5.46 4 118.5 21.3
184 7 1 -8 30.823 61.646 0.333 5.44 4 70.1 7.4
185 8 0 -4 30.842 61.684 0.333 5.43 2 127.7 12.3
186 0 4 3 30.858 61.715 0.333 5.42 4 175.9 46.5
187 3 1 8 30.874 61.749 0.333 5.42 4 21.9 0.7
188 6 0 4 30.878 61.756 0.333 5.41 2 134.1 13.5
189 7 1 1 30.955 61.91 0.334 5.38 4 125.5 23.5
190 2 2 -10 30.992 61.984 0.334 5.37 4 6.9 0.1
191 6 2 -8 31.026 62.052 0.335 5.36 4 429.1 273.6
192 2 2 8 31.067 62.134 0.335 5.34 4 225.0 75.0
193 5 3 -6 31.102 62.203 0.335 5.33 4 27.8 1.1
194 6 2 2 31.151 62.302 0.336 5.31 4 173.1 44.1
195 2 4 -3 31.159 62.318 0.336 5.31 4 335.8 166.0
196 5 3 1 31.175 62.349 0.336 5.3 4 293.4 126.5
197 2 4 1 31.176 62.351 0.336 5.3 4 13.7 0.3
198 3 3 -8 31.369 62.738 0.338 5.23 4 52.0 3.9
199 1 3 -8 31.379 62.759 0.338 5.23 4 152.3 33.6
200 1 3 7 31.411 62.821 0.338 5.21 4 33.5 1.6
201 8 0 -6 31.412 62.824 0.338 5.21 2 443.5 142.2
202 3 3 5 31.45 62.9 0.339 5.2 4 168.0 40.7
203 8 0 -2 31.478 62.957 0.339 5.19 2 246.3 43.6
204 4 2 -10 31.586 63.173 0.34 5.15 4 196.6 55.2
205 1 1 -11 31.681 63.363 0.341 5.12 4 165.4 38.8
206 4 2 6 31.719 63.437 0.341 5.1 4 356.7 180.1
207 1 1 10 31.725 63.45 0.341 5.1 4 415.1 243.7
208 2 4 -4 31.904 63.807 0.343 5.04 4 57.1 4.6
209 0 4 4 31.909 63.818 0.343 5.04 4 88.8 11.0
210 2 4 2 31.928 63.857 0.343 5.03 4 51.9 3.8
211 5 1 -11 32.254 64.508 0.346 4.92 4 21.1 0.6
212 5 3 -7 32.286 64.573 0.347 4.91 4 410.2 229.1
213 7 1 -9 32.305 64.611 0.347 4.9 4 85.4 9.9
214 5 3 2 32.378 64.756 0.348 4.88 4 234.6 74.5
215 5 1 6 32.427 64.855 0.348 4.86 4 266.0 95.4
216 7 1 2 32.463 64.925 0.348 4.85 4 344.3 159.5
217 6 2 -9 32.652 65.305 0.35 4.79 4 155.5 32.1
218 6 2 3 32.798 65.597 0.352 4.75 4 195.1 50.1
219 0 2 10 32.808 65.615 0.352 4.74 4 213.6 60.0
220 2 4 -5 32.932 65.865 0.353 4.71 4 266.5 92.7
221 2 4 3 32.965 65.929 0.353 4.7 4 44.9 2.6
222 4 0 -12 33.052 66.104 0.354 4.67 2 421.1 114.8
223 2 0 -12 33.067 66.134 0.354 4.66 2 235.7 35.9
224 8 0 -8 33.154 66.308 0.355 4.64 2 160.9 16.7
225 2 0 10 33.156 66.312 0.355 4.64 2 49.8 1.6
226 4 0 8 33.213 66.427 0.356 4.62 2 291.8 54.6
227 0 4 5 33.233 66.467 0.356 4.61 4 193.0 47.7
228 8 0 0 33.283 66.566 0.356 4.6 2 117.6 8.8
229 3 3 -9 33.43 66.859 0.358 4.56 4 115.5 16.8
230 3 3 6 33.52 67.04 0.358 4.53 4 66.5 5.6
231 4 4 -2 33.697 67.394 0.36 4.48 4 10.9 0.1
232 3 1 -12 33.71 67.419 0.36 4.48 4 190.6 45.1
233 1 3 -9 33.733 67.466 0.36 4.47 4 82.4 8.4
234 5 3 -8 33.738 67.475 0.361 4.47 4 82.7 8.5
235 1 3 8 33.767 67.534 0.361 4.46 4 227.5 64.0
236 2 2 -11 33.793 67.586 0.361 4.46 4 61.5 4.7
237 4 4 -3 33.834 67.667 0.361 4.44 4 151.3 28.2
238 3 1 9 33.835 67.671 0.361 4.44 4 66.0 5.4
239 5 3 3 33.847 67.695 0.362 4.44 4 503.3 311.9
240 4 4 -1 33.85 67.699 0.362 4.44 4 524.0 338.0
241 2 2 9 33.873 67.746 0.362 4.43 4 138.2 23.5
242 7 1 -10 34.041 68.082 0.363 4.39 4 425.4 220.2
243 4 2 -11 34.071 68.141 0.364 4.38 4 196.4 46.8
244 4 2 7 34.214 68.427 0.365 4.34 4 121.2 17.7
245 7 1 3 34.222 68.443 0.365 4.34 4 63.3 4.8
246 2 4 -6 34.232 68.465 0.365 4.34 4 154.7 28.8
247 4 4 -4 34.257 68.515 0.365 4.33 4 40.6 2.0
248 2 4 4 34.272 68.544 0.366 4.33 4 17.7 0.4
249 4 4 0 34.289 68.578 0.366 4.32 4 211.4 53.6
250 6 2 -10 34.524 69.048 0.368 4.26 4 174.0 35.8
251 8 2 -4 34.656 69.312 0.369 4.23 4 102.6 12.3
252 6 2 4 34.69 69.38 0.369 4.22 4 109.7 14.1
253 8 2 -5 34.783 69.565 0.37 4.2 4 212.0 52.3
254 8 2 -3 34.814 69.628 0.371 4.19 4 74.6 6.5
255 0 4 6 34.817 69.634 0.371 4.19 4 147.5 25.3
256 5 1 -12 34.854 69.707 0.371 4.18 4 383.2 170.2
257 1 1 -12 34.883 69.765 0.371 4.17 4 176.6 36.1
258 1 1 11 34.928 69.856 0.372 4.16 4 93.5 10.1
259 4 4 -5 34.964 69.927 0.372 4.15 4 182.6 38.4
260 4 4 1 35.011 70.022 0.372 4.14 4 113.5 14.8
261 5 1 7 35.04 70.081 0.373 4.14 4 3.2 0.0
262 8 2 -6 35.193 70.387 0.374 4.1 4 394.2 176.7
263 8 2 -2 35.256 70.512 0.375 4.08 4 240.1 65.3
264 6 0 -12 35.358 70.715 0.376 4.06 2 82.7 3.9
265 0 0 12 35.401 70.802 0.376 4.05 2 151.3 12.9
266 5 3 -9 35.442 70.884 0.376 4.04 4 398.0 177.5
267 7 3 -4 35.54 71.081 0.377 4.02 4 303.4 102.6
268 7 3 -3 35.554 71.108 0.377 4.02 4 245.8 67.3
269 6 0 6 35.569 71.137 0.378 4.01 2 465.3 120.5
270 5 3 4 35.569 71.138 0.378 4.01 4 226.0 56.8
271 3 3 -10 35.71 71.421 0.379 3.98 4 58.1 3.7
272 2 4 -7 35.791 71.583 0.38 3.96 4 501.8 276.8
273 7 3 -5 35.809 71.617 0.38 3.96 4 250.3 68.8
274 3 3 7 35.81 71.619 0.38 3.96 4 162.3 28.9
275 0 2 11 35.82 71.64 0.38 3.96 4 23.2 0.6
276 2 4 5 35.838 71.676 0.38 3.95 4 43.6 2.1
277 7 3 -2 35.849 71.699 0.38 3.95 4 270.1 80.0
278 8 2 -7 35.883 71.767 0.38 3.94 4 302.3 100.0
279 4 4 -6 35.945 71.89 0.381 3.93 4 8.8 0.1
280 8 2 -1 35.977 71.953 0.381 3.92 4 146.7 23.4
281 8 0 -10 35.981 71.963 0.381 3.92 2 0.4 0.0
282 4 4 2 36.007 72.014 0.382 3.92 4 224.0 54.5
283 7 1 -11 36.016 72.032 0.382 3.92 4 113.5 14.0
284 9 1 -5 36.164 72.328 0.383 3.88 4 26.9 0.8
285 8 0 2 36.168 72.335 0.383 3.88 2 211.4 24.1
286 9 1 -4 36.181 72.363 0.383 3.88 4 296.7 94.7
287 7 1 4 36.22 72.439 0.384 3.87 4 367.8 145.3
288 1 3 -10 36.289 72.579 0.384 3.86 4 399.3 170.6
289 1 3 9 36.326 72.652 0.385 3.85 4 147.1 23.1
290 7 3 -6 36.356 72.712 0.385 3.85 4 69.1 5.1
291 7 3 -1 36.424 72.847 0.385 3.83 4 18.0 0.3
292 9 1 -6 36.427 72.853 0.385 3.83 4 166.6 29.5
293 9 1 -3 36.479 72.957 0.386 3.82 4 163.4 28.3
294 6 2 -11 36.629 73.258 0.387 3.79 4 15.3 0.2
295 0 4 7 36.648 73.296 0.387 3.79 4 151.5 24.1
296 4 2 -12 36.75 73.499 0.388 3.77 4 437.8 200.3
297 2 2 -12 36.764 73.528 0.389 3.76 4 67.9 4.8
298 6 2 5 36.814 73.628 0.389 3.76 4 66.2 4.6
299 3 1 -13 36.821 73.642 0.389 3.75 4 41.6 1.8
300 8 2 -8 36.847 73.694 0.389 3.75 4 9.1 0.1
301 2 2 10 36.849 73.697 0.389 3.75 4 141.7 20.9
302 4 2 8 36.904 73.807 0.39 3.74 4 128.3 17.1
303 3 1 10 36.954 73.907 0.39 3.73 4 677.7 474.9
304 9 1 -7 36.967 73.933 0.39 3.73 4 13.5 0.2
305 8 2 0 36.97 73.94 0.39 3.73 4 194.7 39.1
306 9 1 -2 37.053 74.106 0.391 3.71 4 206.4 43.8
307 7 3 -7 37.178 74.356 0.392 3.69 4 242.6 60.2
308 4 4 -7 37.193 74.386 0.392 3.68 4 109.4 12.2
309 4 4 3 37.27 74.539 0.393 3.67 4 50.3 2.6
310 7 3 0 37.272 74.544 0.393 3.67 4 268.0 73.1
311 5 3 -10 37.389 74.779 0.394 3.65 4 391.0 154.7
312 5 3 5 37.533 75.066 0.395 3.62 4 228.8 52.6
313 2 4 -8 37.599 75.199 0.396 3.61 4 177.5 31.6
314 5 1 -13 37.645 75.29 0.396 3.6 4 38.4 1.5
315 2 4 6 37.653 75.306 0.397 3.6 4 177.3 31.4
316 9 1 -8 37.78 75.559 0.398 3.58 4 114.3 13.0
317 5 1 8 37.845 75.691 0.398 3.57 4 58.2 3.4
318 9 1 -1 37.9 75.799 0.399 3.56 4 40.3 1.6
319 8 2 -9 38.076 76.152 0.4 3.53 4 98.1 9.4
320 3 3 -11 38.207 76.414 0.401 3.51 4 119.9 14.0
321 7 1 -12 38.223 76.446 0.402 3.51 4 60.1 3.5
322 8 2 1 38.228 76.456 0.402 3.51 4 141.2 19.4
323 1 5 -1 38.231 76.462 0.402 3.51 4 234.5 53.5
324 1 1 -13 38.232 76.463 0.402 3.51 4 29.3 0.8
325 1 5 0 38.233 76.465 0.402 3.51 4 59.0 3.4
326 7 3 -8 38.268 76.537 0.402 3.5 4 116.7 13.2
327 1 1 12 38.279 76.558 0.402 3.5 4 81.7 6.5
328 3 3 8 38.315 76.63 0.402 3.49 4 15.4 0.2
329 7 3 1 38.388 76.776 0.403 3.48 4 58.0 3.3
330 7 1 5 38.449 76.898 0.404 3.47 4 61.8 3.7
331 1 5 -2 38.503 77.007 0.404 3.46 4 67.1 4.3
332 1 5 1 38.509 77.018 0.404 3.46 4 70.1 4.7
333 6 4 -3 38.642 77.284 0.405 3.44 4 170.1 27.6
334 4 4 -8 38.7 77.4 0.406 3.43 4 4.3 0.0
335 0 4 8 38.719 77.437 0.406 3.43 4 22.1 0.5
336 6 4 -4 38.768 77.535 0.406 3.42 4 95.4 8.6
337 6 4 -2 38.79 77.58 0.407 3.42 4 125.1 14.8
338 4 4 4 38.791 77.582 0.407 3.42 4 118.0 13.2
339 9 1 -9 38.861 77.721 0.407 3.41 4 119.1 13.4
340 6 2 -12 38.962 77.924 0.408 3.39 4 24.8 0.6
341 0 2 12 39.004 78.007 0.409 3.39 4 267.9 67.5
342 9 1 0 39.014 78.027 0.409 3.39 4 220.0 45.5
343 1 5 -3 39.048 78.097 0.409 3.38 4 168.7 26.7
344 1 3 -11 39.049 78.098 0.409 3.38 4 590.3 326.8
345 1 5 2 39.058 78.116 0.409 3.38 4 239.2 53.7
346 1 3 10 39.089 78.177 0.409 3.38 4 257.4 62.0
347 6 2 6 39.166 78.331 0.41 3.37 4 479.3 214.4
348 6 4 -5 39.166 78.332 0.41 3.37 4 347.4 112.7
349 6 4 -1 39.211 78.422 0.41 3.36 4 106.4 10.6
350 4 0 -14 39.217 78.433 0.41 3.36 2 462.4 99.6
351 4 0 10 39.397 78.795 0.412 3.33 2 96.8 4.3
352 8 2 -10 39.565 79.13 0.413 3.31 4 56.5 2.9
353 5 3 -11 39.573 79.147 0.414 3.31 4 320.8 94.4
354 7 3 -9 39.621 79.242 0.414 3.3 4 60.3 3.3
355 4 2 -13 39.629 79.257 0.414 3.3 4 210.1 40.4
356 2 4 -9 39.649 79.299 0.414 3.3 4 136.7 17.1
357 2 4 7 39.71 79.419 0.415 3.29 4 635.4 368.6
358 5 3 6 39.733 79.466 0.415 3.29 4 21.8 0.4
359 8 2 2 39.745 79.49 0.415 3.29 4 209.9 40.2
360 7 3 2 39.765 79.531 0.415 3.28 4 215.1 42.1
361 2 0 -14 39.782 79.564 0.415 3.28 2 266.7 32.4
362 4 2 9 39.794 79.588 0.415 3.28 4 223.4 45.4
363 8 0 -12 39.81 79.621 0.416 3.28 2 204.2 19.0
364 6 4 -6 39.835 79.669 0.416 3.28 4 194.8 34.5
365 1 5 -4 39.863 79.726 0.416 3.27 4 45.9 1.9
366 1 5 3 39.876 79.752 0.416 3.27 4 752.0 512.9
367 2 0 12 39.88 79.759 0.416 3.27 2 118.2 6.3
368 6 4 0 39.902 79.804 0.416 3.27 4 144.1 18.8
369 2 2 -13 39.918 79.835 0.417 3.27 4 74.0 5.0
370 10 0 -6 39.971 79.943 0.417 3.26 2 539.9 131.7
371 2 2 11 40.008 80.015 0.417 3.25 4 249.2 56.0
372 10 0 -4 40.009 80.018 0.417 3.25 2 352.1 55.9
373 8 0 4 40.05 80.101 0.418 3.25 2 203.6 18.7
374 3 1 -14 40.107 80.214 0.418 3.24 4 216.4 42.1
375 3 5 -2 40.151 80.302 0.419 3.24 4 134.7 16.3
376 3 5 -1 40.157 80.313 0.419 3.24 4 159.6 22.9
377 9 1 -10 40.204 80.408 0.419 3.23 4 477.5 204.2
378 3 1 11 40.247 80.495 0.419 3.22 4 118.5 12.6
379 9 1 1 40.389 80.778 0.421 3.21 4 8.9 0.1
380 3 5 -3 40.416 80.832 0.421 3.2 4 465.7 192.7
381 3 5 0 40.433 80.866 0.421 3.2 4 168.3 25.2
382 4 4 -9 40.46 80.92 0.421 3.2 4 116.8 12.1
383 4 4 5 40.565 81.13 0.422 3.19 4 160.5 22.8
384 5 1 -14 40.637 81.274 0.423 3.18 4 120.6 12.8
385 7 1 -13 40.66 81.32 0.423 3.18 4 18.3 0.3
386 6 4 -7 40.771 81.542 0.424 3.16 4 156.1 21.4
387 6 0 -14 40.843 81.686 0.425 3.16 2 318.2 44.3
388 5 1 9 40.852 81.704 0.425 3.15 4 113.1 11.2
389 6 4 1 40.86 81.721 0.425 3.15 4 371.8 120.9
390 7 1 6 40.908 81.816 0.425 3.15 4 117.0 12.0
391 3 3 -12 40.922 81.843 0.425 3.15 4 161.2 22.7
392 1 5 -5 40.943 81.886 0.425 3.14 4 186.6 30.4
393 3 5 -4 40.951 81.902 0.425 3.14 4 37.3 1.2
394 1 5 4 40.96 81.92 0.426 3.14 4 29.5 0.8
395 3 5 1 40.979 81.957 0.426 3.14 4 300.9 78.9
396 10 0 -8 41.016 82.031 0.426 3.14 2 53.0 1.2
397 0 4 9 41.026 82.052 0.426 3.14 4 151.4 19.9
398 3 3 9 41.039 82.078 0.426 3.13 4 5.8 0.0
399 6 0 8 41.089 82.178 0.427 3.13 2 126.1 6.9
400 10 0 -2 41.127 82.255 0.427 3.12 2 68.0 2.0
401 7 3 -10 41.231 82.462 0.428 3.11 4 315.2 85.8
402 8 2 -11 41.308 82.617 0.428 3.11 4 234.4 47.3
403 7 3 3 41.4 82.801 0.429 3.1 4 102.0 8.9
404 8 2 3 41.517 83.033 0.43 3.08 4 312.1 83.3
405 6 2 -13 41.524 83.048 0.43 3.08 4 264.5 59.8
406 6 2 7 41.747 83.494 0.432 3.06 4 114.2 11.1
407 3 5 -5 41.753 83.506 0.432 3.06 4 328.4 91.5
408 1 1 -14 41.757 83.515 0.432 3.06 4 145.0 17.8
409 3 5 2 41.792 83.584 0.433 3.06 4 90.0 6.9
410 9 1 -11 41.805 83.61 0.433 3.06 4 45.4 1.7
411 1 1 13 41.807 83.615 0.433 3.06 4 71.9 4.4
412 2 4 -10 41.941 83.882 0.434 3.04 4 84.5 6.0
413 6 4 -8 41.971 83.942 0.434 3.04 4 91.9 7.1
414 5 3 -12 41.995 83.989 0.434 3.04 4 299.8 75.8
415 2 4 8 42.008 84.016 0.434 3.04 4 233.9 46.1
416 1 3 -12 42.022 84.044 0.435 3.04 4 168.3 23.9
417 9 1 2 42.022 84.045 0.435 3.04 4 370.5 115.6
418 1 3 11 42.065 84.129 0.435 3.03 4 40.9 1.4
419 6 4 2 42.083 84.165 0.435 3.03 4 83.6 5.9
420 5 3 7 42.171 84.342 0.436 3.02 4 263.2 58.1
421 1 5 -6 42.286 84.572 0.437 3.01 4 54.5 2.5
422 1 5 5 42.306 84.613 0.437 3.01 4 36.9 1.1
423 0 2 13 42.382 84.764 0.438 3.0 4 61.8 3.2
424 4 4 -10 42.471 84.943 0.438 3.0 4 9.1 0.1
425 0 0 14 42.52 85.04 0.439 2.99 2 688.4 196.6
426 4 4 6 42.59 85.18 0.439 2.99 4 139.0 16.0
427 4 2 -14 42.721 85.442 0.44 2.98 4 296.8 72.7
428 3 5 -6 42.82 85.641 0.441 2.97 4 233.4 44.8
429 3 5 3 42.87 85.741 0.442 2.96 4 192.7 30.5
430 4 2 10 42.899 85.798 0.442 2.96 4 23.4 0.4
431 7 3 -11 43.097 86.194 0.443 2.95 4 31.4 0.8
432 10 0 -10 43.127 86.253 0.444 2.94 2 85.8 3.0
433 9 3 -5 43.238 86.476 0.445 2.94 4 0.5 0.0
434 9 3 -4 43.255 86.509 0.445 2.93 4 272.2 60.3
435 2 2 -14 43.278 86.555 0.445 2.93 4 157.5 20.2
436 7 3 4 43.291 86.582 0.445 2.93 4 373.3 113.3
437 8 2 -12 43.306 86.611 0.445 2.93 4 203.9 33.8
438 10 0 0 43.312 86.623 0.445 2.93 2 701.2 199.8
439 7 1 -14 43.333 86.666 0.445 2.93 4 152.9 19.0
440 10 2 -5 43.349 86.698 0.446 2.93 4 59.4 2.9
441 2 2 12 43.374 86.748 0.446 2.93 4 6.2 0.0
442 6 4 -9 43.434 86.868 0.446 2.92 4 132.4 14.2
443 10 2 -6 43.464 86.929 0.447 2.92 4 401.1 130.3
444 9 3 -6 43.489 86.978 0.447 2.92 4 44.0 1.6
445 10 2 -4 43.501 87.003 0.447 2.92 4 137.4 15.3
446 9 3 -3 43.539 87.077 0.447 2.91 4 494.0 197.2
447 8 2 4 43.542 87.084 0.447 2.91 4 34.1 0.9
448 6 4 3 43.567 87.134 0.447 2.91 4 101.5 8.3
449 0 4 10 43.575 87.15 0.447 2.91 4 46.4 1.7
450 3 1 -15 43.596 87.192 0.448 2.91 4 170.4 23.4
451 7 1 7 43.605 87.21 0.448 2.91 4 36.5 1.1
452 9 1 -12 43.664 87.328 0.448 2.91 4 175.0 24.7
453 3 1 12 43.746 87.492 0.449 2.9 4 21.2 0.4
454 10 2 -7 43.847 87.694 0.45 2.89 4 95.8 7.4
455 5 1 -15 43.849 87.698 0.45 2.89 4 134.9 14.6
456 3 3 -13 43.867 87.734 0.45 2.89 4 26.4 0.6
457 1 5 -7 43.89 87.781 0.45 2.89 4 121.0 11.7
458 9 1 3 43.913 87.827 0.45 2.89 4 131.6 13.9
459 1 5 6 43.914 87.829 0.45 2.89 4 105.0 8.8
460 10 2 -3 43.921 87.841 0.45 2.89 4 55.9 2.5
461 5 5 -3 43.937 87.874 0.45 2.89 4 203.0 33.0
462 5 5 -2 43.946 87.892 0.45 2.89 4 46.2 1.7
463 3 3 10 43.994 87.989 0.451 2.88 4 360.8 104.1
464 9 3 -7 44.007 88.014 0.451 2.88 4 174.9 24.5
465 5 1 10 44.08 88.16 0.452 2.88 4 223.6 39.9
466 9 3 -2 44.09 88.18 0.452 2.88 4 107.5 9.2
467 3 5 -7 44.152 88.304 0.452 2.88 4 15.0 0.2
468 5 5 -4 44.195 88.39 0.452 2.87 4 37.2 1.1
469 3 5 4 44.213 88.426 0.453 2.87 4 86.2 5.9
470 5 5 -1 44.223 88.445 0.453 2.87 4 125.2 12.5
471 6 2 -14 44.325 88.651 0.454 2.86 4 136.3 14.8
472 2 4 -11 44.48 88.96 0.455 2.86 4 189.9 28.6
473 10 2 -8 44.496 88.993 0.455 2.85 4 106.2 8.9
474 2 4 9 44.554 89.108 0.455 2.85 4 48.8 1.9
475 6 2 8 44.569 89.138 0.456 2.85 4 122.4 11.8
476 10 2 -2 44.607 89.214 0.456 2.85 4 125.7 12.5
477 8 0 -14 44.616 89.232 0.456 2.85 2 392.0 60.7
478 5 3 -13 44.661 89.323 0.456 2.85 4 207.2 33.9
479 5 5 -5 44.72 89.44 0.457 2.84 4 257.8 52.4
480 4 4 -11 44.737 89.474 0.457 2.84 4 94.7 7.1
481 5 5 0 44.766 89.532 0.457 2.84 4 10.6 0.1
482 9 3 -8 44.792 89.583 0.457 2.84 4 65.9 3.4
483 5 3 8 44.855 89.71 0.458 2.84 4 75.7 4.5
484 4 4 7 44.87 89.74 0.458 2.83 4 18.6 0.3
485 9 3 -1 44.908 89.816 0.458 2.83 4 124.6 12.2
486 8 0 6 44.911 89.823 0.458 2.83 2 351.9 48.6
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 8.097 16.193 5.46909 1180.2 11.6 11.7 5.6
2 1 1 -2 8.993 17.986 4.92788 174.8 1.7 1.7 5.6
3 1 1 -3 10.582 21.163 4.19458 406.3 4.0 4.0 5.6
4 0 0 4 11.134 22.267 3.98905 776.9 7.7 7.7 5.6
5 2 0 2 11.18 22.36 3.97272 609.8 6.0 6.0 5.6
6 1 1 -4 12.612 25.223 3.52787 150.1 1.5 1.5 5.6
7 1 1 3 12.642 25.284 3.51955 155.1 1.5 1.5 5.6
8 3 1 -2 13.262 26.524 3.35774 1323.4 13.0 13.1 5.6
9 3 1 0 13.872 27.744 3.21283 252.9 2.5 2.5 5.6
10 0 2 0 14.242 28.484 3.131 3037.0 29.9 30.0 5.6
11 0 2 1 14.519 29.039 3.07241 1521.2 15.0 15.0 5.6
12 3 1 -4 14.934 29.869 2.98891 10149.4 100.0 100.0 5.6
13 2 0 -6 15.825 31.65 2.82463 948.7 9.3 9.3 5.6
14 4 0 -4 15.869 31.739 2.81694 406.6 4.0 4.0 5.6
15 4 0 0 15.925 31.851 2.80728 2883.6 28.4 28.4 5.6
16 2 2 -1 16.105 32.21 2.77677 683.6 6.7 6.7 5.6
17 3 1 2 16.533 33.066 2.70685 1487.4 14.7 14.6 5.6
18 0 0 6 16.837 33.674 2.65937 277.3 2.7 2.7 5.7
19 2 2 -3 17.068 34.136 2.62443 803.2 7.9 7.9 5.7
20 1 1 -6 17.413 34.826 2.57395 726.5 7.2 7.1 5.7
21 2 2 -4 18.217 36.435 2.46394 178.3 1.8 1.7 5.7
22 2 2 2 18.255 36.509 2.45908 594.3 5.9 5.8 5.7
23 3 1 -6 18.325 36.649 2.44999 372.4 3.7 3.6 5.7
24 4 0 -6 18.67 37.341 2.40619 308.5 3.0 3.0 5.7
25 4 0 2 18.768 37.535 2.39417 190.1 1.9 1.9 5.7
26 2 2 -5 19.731 39.463 2.28156 170.3 1.7 1.7 5.7
27 1 1 6 20.083 40.166 2.24324 104.5 1.0 1.0 5.7
28 5 1 -2 20.132 40.264 2.23798 820.0 8.1 8.0 5.7
29 0 2 5 20.161 40.321 2.23495 338.7 3.3 3.3 5.7
30 4 2 -1 21.023 42.045 2.1472 1103.4 10.9 10.7 5.7
31 2 0 -8 21.149 42.297 2.135 1354.2 13.3 13.2 5.7
32 2 0 6 21.225 42.45 2.12764 572.8 5.6 5.6 5.7
33 2 2 -6 21.548 43.095 2.09729 288.9 2.8 2.8 5.7
34 4 2 0 21.625 43.25 2.09016 1123.2 11.1 10.9 5.7
35 1 3 -1 22.043 44.086 2.05241 177.2 1.7 1.7 5.7
36 0 2 6 22.335 44.671 2.02691 136.2 1.3 1.3 5.7
37 4 0 -8 22.693 45.385 1.99665 280.9 2.8 2.7 5.7
38 4 0 4 22.817 45.634 1.98636 1573.1 15.5 15.3 5.7
39 1 3 -3 23.167 46.334 1.95796 505.6 5.0 4.9 5.7
40 2 2 -7 23.614 47.228 1.92293 999.6 9.8 9.7 5.7
41 4 2 -6 23.812 47.624 1.90787 212.8 2.1 2.1 5.7
42 4 2 2 23.892 47.784 1.90187 292.7 2.9 2.8 5.7
43 5 1 2 24.022 48.043 1.89219 352.0 3.5 3.4 5.7
44 6 0 -6 24.215 48.431 1.87796 562.9 5.5 5.4 5.7
45 1 3 3 24.27 48.539 1.87401 1042.1 10.3 10.1 5.7
46 6 0 0 24.304 48.608 1.87152 107.6 1.1 1.0 5.7
47 3 3 -2 24.629 49.258 1.84833 328.5 3.2 3.2 5.7
48 3 3 -3 24.973 49.945 1.82451 343.9 3.4 3.3 5.7
49 4 2 3 25.485 50.97 1.7902 118.8 1.2 1.1 5.8
50 1 3 4 25.668 51.336 1.7783 2404.2 23.7 23.2 5.8
51 5 1 3 25.782 51.564 1.77096 121.0 1.2 1.2 5.8
52 2 2 -8 25.892 51.785 1.76393 582.4 5.7 5.6 5.8
53 2 2 6 25.958 51.916 1.75978 452.4 4.5 4.4 5.8
54 6 0 -8 26.931 53.863 1.70069 522.2 5.1 5.0 5.8
55 2 0 8 26.976 53.953 1.69807 109.8 1.1 1.1 5.8
56 6 2 -3 27.16 54.32 1.68746 203.5 2.0 2.0 5.8
57 4 2 4 27.338 54.676 1.67729 260.4 2.6 2.5 5.8
58 4 0 6 27.687 55.373 1.65781 313.5 3.1 3.0 5.8
59 7 1 -4 27.752 55.505 1.65419 230.7 2.3 2.2 5.8
60 5 1 4 27.786 55.571 1.65238 310.3 3.1 3.0 5.8
61 3 3 3 28.025 56.05 1.63939 130.2 1.3 1.2 5.8
62 7 1 -2 28.106 56.213 1.63503 639.1 6.3 6.1 5.8
63 2 2 7 28.427 56.854 1.6181 511.4 5.0 4.9 5.8
64 6 2 -6 28.574 57.148 1.61048 283.9 2.8 2.7 5.8
65 1 1 -10 28.607 57.215 1.60876 446.5 4.4 4.3 5.8
66 4 2 -9 29.302 58.604 1.57389 170.0 1.7 1.6 5.8
67 0 4 1 29.63 59.26 1.55802 224.4 2.2 2.1 5.8
68 6 2 -7 29.66 59.32 1.55658 119.8 1.2 1.1 5.8
69 7 1 0 29.715 59.429 1.55398 127.7 1.3 1.2 5.8
70 6 2 1 29.763 59.526 1.55168 132.6 1.3 1.3 5.8
71 5 1 -10 29.846 59.692 1.54776 186.5 1.8 1.8 5.8
72 5 3 -5 30.199 60.398 1.53136 118.3 1.2 1.1 5.8
73 2 4 -1 30.561 61.122 1.51495 128.9 1.3 1.2 5.8
74 6 2 -8 31.026 62.052 1.49446 273.6 2.7 2.6 5.8
75 5 3 1 31.175 62.349 1.48803 336.9 3.3 3.2 5.8
76 8 0 -6 31.412 62.824 1.47792 143.8 1.4 1.4 5.9
77 1 1 10 31.725 63.45 1.46486 423.8 4.2 4.0 5.9
78 5 3 -7 32.286 64.573 1.44207 239.0 2.4 2.3 5.9
79 7 1 2 32.463 64.925 1.43509 159.5 1.6 1.5 5.9
80 0 2 10 32.808 65.615 1.42165 110.1 1.1 1.0 5.9
81 4 0 -12 33.052 66.104 1.41232 150.7 1.5 1.4 5.9
82 4 0 8 33.213 66.427 1.40624 102.2 1.0 1.0 5.9
83 4 4 -1 33.85 67.699 1.38287 707.0 7.0 6.7 5.9
84 7 1 -10 34.041 68.082 1.37603 220.2 2.2 2.1 5.9
85 5 1 -12 34.854 69.707 1.34786 206.3 2.0 1.9 5.9
86 8 2 -6 35.193 70.387 1.33651 176.7 1.7 1.7 5.9
87 5 3 -9 35.442 70.884 1.32834 177.5 1.7 1.7 5.9
88 6 0 6 35.569 71.137 1.32424 347.2 3.4 3.2 5.9
89 2 4 -7 35.791 71.583 1.31709 375.1 3.7 3.5 5.9
90 9 1 -4 36.181 72.363 1.3048 118.8 1.2 1.1 5.9
91 7 1 4 36.22 72.439 1.30361 145.3 1.4 1.4 5.9
92 1 3 -10 36.289 72.579 1.30145 170.6 1.7 1.6 6.0
93 4 2 -12 36.75 73.499 1.2874 205.1 2.0 1.9 6.0
94 3 1 10 36.954 73.907 1.2813 514.3 5.1 4.8 6.0
95 5 3 -10 37.389 74.779 1.26851 154.7 1.5 1.4 6.0
96 0 2 12 39.004 78.007 1.22389 112.9 1.1 1.0 6.0
97 1 5 2 39.058 78.116 1.22247 407.1 4.0 3.8 6.0
98 6 2 6 39.166 78.331 1.21964 327.1 3.2 3.0 6.0
99 4 0 -14 39.217 78.433 1.21831 110.1 1.1 1.0 6.0
100 2 4 7 39.71 79.419 1.20564 369.0 3.6 3.4 6.0
101 4 2 9 39.794 79.588 1.20351 179.0 1.8 1.6 6.0
102 1 5 3 39.876 79.752 1.20144 538.1 5.3 4.9 6.0
103 10 0 -6 39.971 79.943 1.19906 131.7 1.3 1.2 6.0
104 2 2 11 40.008 80.015 1.19815 112.0 1.1 1.0 6.0
105 9 1 -10 40.204 80.408 1.19329 204.2 2.0 1.9 6.0
106 3 5 -3 40.416 80.832 1.18809 217.9 2.1 2.0 6.1
107 6 4 1 40.86 81.721 1.1774 176.4 1.7 1.6 6.1
108 8 2 3 41.517 83.033 1.1621 143.1 1.4 1.3 6.1
109 1 1 -14 41.757 83.515 1.15662 120.5 1.2 1.1 6.1
110 9 1 2 42.022 84.045 1.15067 261.3 2.6 2.4 6.1
111 0 0 14 42.52 85.04 1.13973 196.6 1.9 1.8 6.1
112 10 0 0 43.312 86.623 1.12291 368.7 3.6 3.3 6.1
113 10 2 -6 43.464 86.929 1.11975 144.5 1.4 1.3 6.1
114 9 3 -3 43.539 87.077 1.11822 206.5 2.0 1.9 6.1
115 3 3 10 43.994 87.989 1.10897 128.6 1.3 1.2 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)
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