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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SYNGENITE
2, t-syngenite, f-polyhalite
K(2)Ca[SO(4)](2).H(2)O
Monoclinic P 2(1)/m Z = 2
R =0.043 NR =1834
12 .2 .1901
Ref.Str.:
Bokii G.B., Pal'chik N.A., Antipin M.Yu. (1978)
* Kristallogr., 23, 257-260
Reserv:
There are U(ij) in the article. D.T.N.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 6.225 alpha = 90.0
b = 7.127 beta = 104.15
c = 9.727 gamma = 90.0
Unit cell volume (cub. angs.) = 418.44
Molar volume ( cub.cm/mol.) = 126.02
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.3325 0.25 0.9679 0.0 Ca = 1.00
2 0.1956 0.007 0.3361 0.0 K = 1.00
3 0.8391 0.25 0.9893 0.0 S = 1.00
4 0.2666 0.25 0.6373 0.0 S = 1.00
5 0.0191 0.25 0.1186 0.0 O = 1.00
6 0.5018 0.25 0.2249 0.0 O = 1.00
7 0.0533 0.25 0.5305 0.0 O = 1.00
8 0.4495 0.25 0.5655 0.0 O = 1.00
9 0.2816 0.0838 0.7308 0.0 O = 1.00
10 0.9405 0.25 0.8664 0.0 O = 1.00
11 0.6938 0.0836 0.9815 0.0 O = 1.00
12 0.571 0.152 0.249 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.3325 0.25 0.9679
2 2 0.1956 0.007 0.3361
3 3 0.8391 0.25 0.9893
4 4 0.2666 0.25 0.6373
5 5 0.0191 0.25 0.1186
6 6 0.5018 0.25 0.2249
7 7 0.0533 0.25 0.5305
8 8 0.4495 0.25 0.5655
9 9 0.2816 0.0838 0.7308
10 10 0.9405 0.25 0.8664
11 11 0.6938 0.0836 0.9815
12 12 0.571 0.152 0.249
13 1 0.6675 0.75 0.0321
14 2 0.8044 0.507 0.6639
15 3 0.1609 0.75 0.0107
16 4 0.7334 0.75 0.3627
17 5 0.9809 0.75 0.8814
18 6 0.4982 0.75 0.7751
19 7 0.9467 0.75 0.4695
20 8 0.5505 0.75 0.4345
21 9 0.7184 0.5838 0.2692
22 10 0.0595 0.75 0.1336
23 11 0.3062 0.5836 0.0185
24 12 0.429 0.652 0.751
25 2 0.1956 0.493 0.3361
26 9 0.2816 0.4162 0.7308
27 11 0.6938 0.4164 0.9815
28 12 0.571 0.348 0.249
29 2 0.8044 0.993 0.6639
30 9 0.7184 0.9162 0.2692
31 11 0.3062 0.9164 0.0185
32 12 0.429 0.848 0.751
X-ray density (g/cm cub.) = 2.61
MU (1/cm) = 198.709 Mass attenuation coefficient (cm**2/g) = 76.263
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca 2.88 9
2.7117 5
2.464 6
2.5426 9
2.3982 10
2.5173 11
2.4416 11
2.5426 9
2.5173 11
2.4416 11
2 K 3.228 8
2.7469 5
2.9683 6
2.8599 7
2.9583 8
2.9021 7
2.8492 8
2.6714 10
2.9532 9
3 S 1.98 4
1.4657 5
1.4821 10
1.4821 11
1.4821 11
4 S 1.98 4
1.4723 7
1.4741 8
1.4824 9
1.4824 9
5 O 3.264 6
2.9289 6
2.3813 10
2.4423 11
3.2628 11
2.4423 11
3.2628 11
6 O 3.264 7
2.9289 5
3.1343 11
2.7165 9
3.1576 11
3.1343 11
2.7165 9
3.1576 11
7 O 3.264 3
2.4059 8
2.4217 9
2.4217 9
8 O 3.264 3
2.4059 7
2.4295 9
2.4295 9
9 O 3.264 7
2.4217 7
2.4295 8
3.0035 10
3.0775 11
2.7165 6
2.369 9
3.0114 11
10 O 3.264 5
2.3813 5
3.0035 9
2.4206 11
3.0035 9
2.4206 11
11 O 3.264 9
2.4423 5
3.1343 6
3.0775 9
2.4206 10
3.2628 5
3.1576 6
2.3719 11
3.0114 9
2.7921 11
12 H 1.632 1
0.824 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 1 4.684 9.369 0.053 296.88 2 32.8 364.8
2 1 0 0 7.332 14.663 0.083 119.86 2 12.6 21.6
3 1 0 -1 7.68 15.359 0.087 109.04 2 0.1 0.0
4 0 1 1 7.786 15.571 0.088 106.04 4 38.0 350.1
5 0 0 2 9.401 18.801 0.106 72.04 2 30.1 74.6
6 1 1 0 9.627 19.254 0.109 68.59 4 42.2 279.3
7 1 0 1 9.642 19.283 0.109 68.38 2 8.9 6.2
8 1 1 -1 9.897 19.793 0.112 64.79 4 35.1 182.6
9 1 0 -2 10.43 20.859 0.118 58.12 2 7.7 3.9
10 0 1 2 11.295 22.59 0.127 49.24 4 27.3 84.0
11 1 1 1 11.498 22.996 0.129 47.45 4 43.2 202.1
12 1 1 -2 12.171 24.343 0.137 42.12 4 11.2 12.0
13 0 2 0 12.483 24.967 0.14 39.94 2 63.5 184.0
14 1 0 2 13.33 26.66 0.15 34.77 2 15.5 9.6
15 0 2 1 13.36 26.72 0.15 34.61 4 56.9 256.0
16 0 0 3 14.182 28.364 0.159 30.49 2 127.7 568.2
17 1 0 -3 14.302 28.604 0.16 29.95 2 0.0 0.0
18 2 0 -1 14.373 28.745 0.161 29.63 2 59.8 121.2
19 1 2 0 14.538 29.075 0.163 28.92 4 7.7 3.9
20 1 2 -1 14.722 29.444 0.165 28.15 4 31.1 62.2
21 1 1 2 14.752 29.504 0.165 28.03 4 22.2 31.6
22 2 0 0 14.787 29.574 0.166 27.89 2 84.9 229.4
23 2 0 -2 15.502 31.004 0.173 25.2 2 15.5 6.9
24 0 1 3 15.533 31.065 0.174 25.09 4 56.5 183.0
25 1 1 -3 15.643 31.285 0.175 24.71 4 10.5 6.2
26 2 1 -1 15.708 31.416 0.176 24.49 4 82.4 379.7
27 0 2 2 15.72 31.439 0.176 24.45 4 83.1 385.7
28 1 2 1 15.87 31.74 0.178 23.96 4 85.4 399.1
29 2 1 0 16.091 32.182 0.18 23.25 4 51.2 139.1
30 1 2 -2 16.377 32.753 0.183 22.38 4 93.5 447.1
31 2 0 1 16.64 33.281 0.186 21.62 2 64.6 103.2
32 2 1 -2 16.756 33.512 0.187 21.3 4 34.3 57.3
33 1 0 3 17.617 35.235 0.196 19.1 2 15.6 5.3
34 2 1 1 17.823 35.646 0.199 18.62 4 0.3 0.0
35 2 0 -3 17.912 35.824 0.2 18.42 2 121.1 308.4
36 1 2 2 18.424 36.847 0.205 17.31 4 42.5 71.3
37 1 0 -4 18.683 37.367 0.208 16.79 2 12.7 3.1
38 1 1 3 18.746 37.493 0.209 16.66 4 40.3 61.9
39 2 1 -3 19.026 38.051 0.212 16.13 4 31.3 36.2
40 0 0 4 19.067 38.134 0.212 16.05 2 24.8 11.3
41 0 2 3 19.07 38.141 0.212 16.04 4 37.9 52.5
42 1 2 -3 19.163 38.325 0.213 15.87 4 70.8 181.6
43 2 2 -1 19.217 38.435 0.214 15.77 4 40.1 57.8
44 0 3 1 19.534 39.068 0.217 15.21 4 3.2 0.3
45 2 2 0 19.54 39.08 0.217 15.2 4 61.1 129.6
46 2 0 2 19.571 39.142 0.217 15.15 2 25.9 11.6
47 1 1 -4 19.76 39.52 0.219 14.83 4 36.6 45.5
48 2 2 -2 20.105 40.21 0.223 14.27 4 10.3 3.5
49 0 1 4 20.126 40.253 0.223 14.24 4 24.9 20.1
50 1 3 0 20.392 40.785 0.226 13.82 4 24.2 18.5
51 1 3 -1 20.53 41.06 0.228 13.62 4 20.1 12.5
52 2 1 2 20.608 41.216 0.228 13.5 4 27.3 23.0
53 2 2 1 21.026 42.051 0.233 12.91 4 12.0 4.3
54 2 0 -4 21.227 42.453 0.235 12.64 2 36.6 19.3
55 0 3 2 21.288 42.576 0.236 12.56 4 27.6 21.9
56 1 3 1 21.404 42.808 0.237 12.41 4 2.2 0.1
57 1 3 -2 21.799 43.598 0.241 11.91 4 49.7 67.1
58 3 0 -1 21.803 43.605 0.241 11.9 2 58.4 46.4
59 1 2 3 21.834 43.669 0.241 11.86 4 7.6 1.6
60 2 2 -3 22.081 44.162 0.244 11.57 4 17.5 8.1
61 3 0 -2 22.192 44.384 0.245 11.44 2 60.5 47.8
62 2 1 -4 22.2 44.4 0.245 11.43 4 53.2 73.8
63 1 0 4 22.251 44.502 0.246 11.37 2 62.1 50.0
64 3 0 0 22.51 45.019 0.249 11.08 2 0.1 0.0
65 1 2 -4 22.733 45.467 0.251 10.83 4 54.5 73.6
66 3 1 -1 22.757 45.513 0.251 10.81 4 20.1 10.0
67 0 2 4 23.061 46.123 0.254 10.49 4 25.3 15.3
68 3 1 -2 23.133 46.266 0.255 10.41 4 29.7 20.9
69 1 1 4 23.19 46.381 0.256 10.35 4 0.7 0.0
70 2 0 3 23.244 46.488 0.256 10.3 2 135.2 215.1
71 1 0 -5 23.386 46.772 0.258 10.16 2 89.2 92.4
72 3 1 0 23.441 46.882 0.258 10.11 4 17.4 7.0
73 1 3 2 23.444 46.888 0.258 10.1 4 41.7 40.2
74 2 2 2 23.495 46.989 0.259 10.05 4 78.6 141.8
75 3 0 -3 23.635 47.27 0.26 9.92 2 33.3 12.6
76 0 3 3 23.979 47.957 0.264 9.6 4 60.5 80.2
77 1 3 -3 24.055 48.111 0.265 9.53 4 0.3 0.0
78 0 0 5 24.101 48.202 0.265 9.49 2 18.0 3.5
79 2 3 -1 24.101 48.202 0.265 9.49 4 60.3 78.7
80 2 1 3 24.153 48.307 0.266 9.44 4 36.2 28.2
81 3 0 1 24.237 48.475 0.266 9.37 2 36.5 14.2
82 1 1 -5 24.291 48.582 0.267 9.32 4 12.7 3.4
83 2 3 0 24.371 48.741 0.268 9.25 4 57.0 68.6
84 3 1 -3 24.533 49.066 0.27 9.11 4 25.4 13.4
85 2 3 -2 24.847 49.694 0.273 8.85 4 47.6 45.8
86 2 2 -4 24.94 49.881 0.274 8.78 4 14.2 4.0
87 0 1 5 24.987 49.973 0.274 8.74 4 29.1 16.9
88 3 1 1 25.12 50.239 0.276 8.64 4 22.8 10.2
89 2 0 -5 25.173 50.345 0.276 8.59 2 26.0 6.6
90 3 2 -1 25.451 50.901 0.279 8.38 4 12.6 3.0
91 0 4 0 25.615 51.229 0.281 8.26 2 135.7 173.7
92 2 3 1 25.632 51.264 0.281 8.25 4 39.9 29.9
93 3 2 -2 25.797 51.595 0.282 8.13 4 26.7 13.2
94 1 2 4 25.85 51.7 0.283 8.09 4 48.2 42.9
95 3 0 -4 25.997 51.993 0.285 7.99 2 22.7 4.7
96 2 1 -5 26.031 52.063 0.285 7.96 4 31.3 17.8
97 3 2 0 26.081 52.163 0.285 7.93 4 42.1 32.1
98 0 4 1 26.102 52.203 0.286 7.91 4 3.3 0.2
99 1 3 3 26.33 52.661 0.288 7.76 4 39.8 28.1
100 2 3 -3 26.545 53.09 0.29 7.62 4 63.5 70.3
101 2 2 3 26.742 53.484 0.292 7.49 4 38.8 25.8
102 1 4 0 26.792 53.585 0.293 7.46 4 24.6 10.3
103 3 1 -4 26.837 53.673 0.293 7.43 4 37.0 23.2
104 3 0 2 26.838 53.676 0.293 7.43 2 19.5 3.2
105 1 2 -5 26.87 53.74 0.293 7.41 4 23.3 9.2
106 1 4 -1 26.904 53.808 0.294 7.39 4 32.4 17.7
107 3 2 -3 27.095 54.19 0.296 7.27 4 47.4 37.2
108 1 3 -4 27.116 54.232 0.296 7.26 4 18.5 5.7
109 1 0 5 27.17 54.34 0.296 7.22 2 15.6 2.0
110 0 3 4 27.404 54.809 0.299 7.08 4 5.8 0.5
111 2 0 4 27.459 54.919 0.299 7.05 2 46.6 17.5
112 0 2 5 27.518 55.036 0.3 7.02 4 48.9 38.3
113 0 4 2 27.526 55.051 0.3 7.01 4 23.2 8.6
114 1 4 1 27.621 55.243 0.301 6.96 4 24.1 9.2
115 3 2 1 27.642 55.285 0.301 6.95 4 48.8 37.8
116 3 1 2 27.66 55.32 0.301 6.94 4 24.2 9.3
117 2 3 2 27.787 55.575 0.303 6.86 4 51.4 41.4
118 1 4 -2 27.949 55.898 0.304 6.77 4 19.8 6.0
119 1 1 5 27.986 55.971 0.305 6.75 4 4.9 0.4
120 2 1 4 28.269 56.538 0.307 6.6 4 13.0 2.6
121 1 0 -6 28.373 56.745 0.308 6.55 2 27.6 5.7
122 2 2 -5 28.497 56.995 0.31 6.48 4 0.8 0.0
123 2 3 -4 29.079 58.158 0.315 6.19 4 37.1 19.4
124 3 0 -5 29.123 58.246 0.316 6.17 2 6.1 0.3
125 1 1 -6 29.166 58.332 0.316 6.15 4 14.7 3.1
126 3 2 -4 29.257 58.513 0.317 6.11 4 17.5 4.3
127 1 4 2 29.338 58.675 0.318 6.07 4 22.8 7.2
128 0 0 6 29.341 58.683 0.318 6.07 2 69.1 33.1
129 3 3 -1 29.54 59.08 0.32 5.98 4 19.2 5.0
130 2 0 -6 29.608 59.215 0.321 5.95 2 43.2 12.7
131 4 0 -2 29.766 59.532 0.322 5.88 2 10.3 0.7
132 4 0 -1 29.791 59.582 0.323 5.86 2 78.7 41.5
133 0 4 3 29.796 59.592 0.323 5.86 4 61.4 50.5
134 3 3 -2 29.854 59.708 0.323 5.84 4 4.8 0.3
135 1 4 -3 29.862 59.725 0.323 5.83 4 21.9 6.4
136 2 4 -1 29.902 59.803 0.324 5.82 4 47.2 29.6
137 1 3 4 29.902 59.804 0.324 5.82 4 6.0 0.5
138 3 1 -5 29.904 59.807 0.324 5.82 4 19.0 4.8
139 3 2 2 30.036 60.073 0.325 5.76 4 8.8 1.0
140 3 3 0 30.112 60.224 0.326 5.73 4 2.9 0.1
141 0 1 6 30.119 60.237 0.326 5.72 4 26.6 9.3
142 2 4 0 30.135 60.269 0.326 5.72 4 25.0 8.2
143 3 0 3 30.163 60.326 0.326 5.7 2 13.1 1.1
144 1 2 5 30.345 60.691 0.328 5.63 4 49.2 31.1
145 2 1 -6 30.381 60.761 0.328 5.61 4 55.9 40.1
146 4 1 -2 30.536 61.073 0.33 5.55 4 12.0 1.8
147 2 4 -2 30.548 61.096 0.33 5.54 4 8.7 1.0
148 4 1 -1 30.561 61.122 0.33 5.54 4 23.3 6.8
149 2 2 4 30.615 61.23 0.331 5.52 4 4.6 0.3
150 4 0 -3 30.62 61.24 0.331 5.52 2 1.9 0.0
151 4 0 0 30.694 61.388 0.331 5.49 2 34.3 7.4
152 2 3 3 30.715 61.429 0.332 5.48 4 31.4 12.3
153 1 3 -5 30.832 61.664 0.333 5.43 4 27.0 9.1
154 3 1 3 30.927 61.855 0.334 5.4 4 17.9 4.0
155 3 3 -3 31.038 62.077 0.335 5.35 4 16.2 3.2
156 2 4 1 31.236 62.471 0.337 5.28 4 20.6 5.1
157 4 1 -3 31.378 62.756 0.338 5.23 4 29.4 10.3
158 0 3 5 31.427 62.855 0.338 5.21 4 11.4 1.5
159 4 1 0 31.451 62.902 0.339 5.2 4 34.3 14.0
160 1 2 -6 31.47 62.941 0.339 5.19 4 37.1 16.3
161 3 3 1 31.542 63.084 0.34 5.17 4 13.1 2.0
162 1 4 3 31.852 63.705 0.343 5.06 4 30.9 11.1
163 2 4 -3 32.043 64.086 0.344 4.99 4 46.3 24.5
164 2 0 5 32.13 64.259 0.345 4.96 2 1.2 0.0
165 3 2 -5 32.176 64.353 0.346 4.95 4 91.4 94.4
166 4 0 -4 32.313 64.625 0.347 4.9 2 82.2 37.9
167 2 3 -5 32.333 64.666 0.347 4.89 4 10.8 1.3
168 0 2 6 32.383 64.765 0.348 4.88 4 16.1 2.9
169 1 0 6 32.392 64.783 0.348 4.88 2 35.2 6.9
170 4 0 1 32.432 64.864 0.348 4.86 2 10.9 0.7
171 1 4 -4 32.552 65.104 0.349 4.82 4 6.3 0.4
172 2 2 -6 32.634 65.269 0.35 4.8 4 30.3 10.1
173 4 2 -2 32.784 65.568 0.351 4.75 4 51.2 28.5
174 4 2 -1 32.808 65.615 0.352 4.74 4 12.7 1.8
175 0 4 4 32.81 65.621 0.352 4.74 4 24.4 6.5
176 2 1 5 32.868 65.736 0.352 4.72 4 22.2 5.3
177 3 0 -6 32.894 65.788 0.353 4.72 2 26.9 3.9
178 3 3 -4 33.039 66.078 0.354 4.67 4 19.3 4.0
179 4 1 -4 33.049 66.098 0.354 4.67 4 25.6 7.0
180 1 1 6 33.127 66.254 0.355 4.65 4 4.6 0.2
181 0 5 1 33.129 66.259 0.355 4.65 4 17.2 3.2
182 2 4 2 33.155 66.31 0.355 4.64 4 11.0 1.3
183 3 2 3 33.16 66.32 0.355 4.64 4 13.8 2.0
184 4 1 1 33.167 66.334 0.355 4.63 4 13.8 2.0
185 4 2 -3 33.595 67.189 0.359 4.51 4 39.3 15.9
186 3 1 -6 33.624 67.247 0.359 4.5 4 20.9 4.5
187 4 2 0 33.665 67.33 0.36 4.49 4 2.3 0.1
188 1 0 -7 33.674 67.347 0.36 4.49 2 39.4 7.9
189 1 5 0 33.729 67.457 0.36 4.47 4 32.8 11.0
190 3 3 2 33.768 67.537 0.361 4.46 4 12.8 1.7
191 1 5 -1 33.826 67.652 0.361 4.45 4 26.2 7.0
192 1 3 5 34.058 68.117 0.364 4.38 4 22.2 4.9
193 3 0 4 34.108 68.216 0.364 4.37 2 18.7 1.7
194 2 3 4 34.312 68.624 0.366 4.32 4 4.2 0.2
195 2 4 -4 34.326 68.652 0.366 4.31 4 63.7 40.0
196 0 5 2 34.37 68.741 0.366 4.3 4 8.1 0.6
197 1 1 -7 34.395 68.79 0.367 4.29 4 30.0 8.9
198 1 5 1 34.455 68.91 0.367 4.28 4 21.4 4.5
199 2 0 -7 34.487 68.974 0.368 4.27 2 43.5 9.2
200 1 5 -2 34.744 69.488 0.37 4.21 4 7.4 0.5
201 3 4 -1 34.747 69.494 0.37 4.21 4 11.0 1.2
202 4 0 -5 34.779 69.559 0.37 4.2 2 1.8 0.0
203 3 1 4 34.825 69.65 0.371 4.19 4 4.4 0.2
204 0 0 7 34.868 69.735 0.371 4.18 2 5.4 0.1
205 4 0 2 34.941 69.881 0.372 4.16 2 80.8 31.0
206 3 4 -2 35.035 70.07 0.373 4.14 4 41.2 16.0
207 2 2 5 35.036 70.071 0.373 4.14 4 70.6 47.0
208 1 4 4 35.079 70.158 0.373 4.13 4 32.6 10.0
209 1 3 -6 35.119 70.239 0.373 4.12 4 11.0 1.1
210 2 1 -7 35.201 70.402 0.374 4.1 4 15.8 2.3
211 4 2 -4 35.211 70.422 0.374 4.09 4 23.0 5.0
212 3 4 0 35.272 70.545 0.375 4.08 4 31.1 9.0
213 1 2 6 35.287 70.574 0.375 4.08 4 41.7 16.2
214 4 2 1 35.326 70.651 0.375 4.07 4 60.3 33.8
215 4 1 -5 35.49 70.981 0.377 4.03 4 8.3 0.6
216 0 1 7 35.578 71.156 0.378 4.01 4 38.0 13.2
217 4 1 2 35.65 71.3 0.378 4.0 4 50.9 23.6
218 3 2 -6 35.769 71.538 0.379 3.97 4 56.9 29.3
219 3 3 -5 35.789 71.578 0.38 3.96 4 16.4 2.4
220 2 4 3 35.828 71.657 0.38 3.96 4 95.3 82.1
221 1 4 -5 35.937 71.874 0.381 3.93 4 53.2 25.4
222 1 5 2 35.982 71.963 0.381 3.92 4 17.3 2.7
223 0 3 6 35.985 71.97 0.381 3.92 4 26.8 6.4
224 3 4 -3 36.128 72.257 0.383 3.89 4 28.1 7.0
225 2 3 -6 36.225 72.449 0.384 3.87 4 72.8 46.9
226 4 3 -2 36.367 72.734 0.385 3.84 4 21.1 3.9
227 4 3 -1 36.39 72.78 0.385 3.84 4 26.8 6.3
228 0 5 3 36.395 72.789 0.385 3.84 4 32.8 9.4
229 1 5 -3 36.454 72.909 0.386 3.83 4 5.0 0.2
230 0 4 5 36.49 72.979 0.386 3.82 4 10.7 1.0
231 2 5 -1 36.49 72.98 0.386 3.82 4 49.8 21.6
232 1 2 -7 36.52 73.041 0.386 3.81 4 23.5 4.8
233 3 4 1 36.596 73.193 0.387 3.8 4 23.8 4.9
234 2 5 0 36.701 73.401 0.388 3.78 4 32.2 8.9
235 3 3 3 36.726 73.452 0.388 3.77 4 21.3 3.9
236 3 2 4 36.94 73.879 0.39 3.73 4 72.9 45.3
237 2 5 -2 37.076 74.152 0.391 3.71 4 28.0 6.7
238 4 3 -3 37.142 74.283 0.392 3.69 4 58.5 28.9
239 4 3 0 37.209 74.418 0.393 3.68 4 42.8 15.4
240 3 0 -7 37.249 74.497 0.393 3.67 2 17.0 1.2
241 2 0 6 37.252 74.504 0.393 3.67 2 67.1 18.9
242 2 2 -7 37.307 74.613 0.393 3.66 4 5.0 0.2
243 2 4 -5 37.335 74.671 0.394 3.66 4 18.5 2.9
244 4 2 -5 37.589 75.179 0.396 3.61 4 57.3 27.1
245 0 2 7 37.675 75.35 0.397 3.6 4 23.6 4.6
246 2 5 1 37.704 75.408 0.397 3.59 4 11.5 1.1
247 4 2 2 37.746 75.492 0.397 3.59 4 12.9 1.4
248 3 1 -7 37.941 75.882 0.399 3.55 4 29.5 7.1
249 2 1 6 37.944 75.888 0.399 3.55 4 23.6 4.5
250 4 0 -6 37.96 75.919 0.399 3.55 2 33.1 4.5
251 1 0 7 37.985 75.97 0.399 3.55 2 32.0 4.2
252 3 4 -4 37.999 75.998 0.4 3.54 4 11.0 1.0
253 4 0 3 38.16 76.32 0.401 3.52 2 2.3 0.0
254 5 0 -2 38.224 76.449 0.402 3.51 2 23.3 2.2
255 1 5 3 38.271 76.542 0.402 3.5 4 31.3 7.8
256 2 5 -3 38.447 76.893 0.404 3.47 4 24.7 4.8
257 2 3 5 38.527 77.054 0.404 3.46 4 60.1 28.5
258 5 0 -1 38.547 77.093 0.404 3.46 2 44.7 7.9
259 3 0 5 38.631 77.263 0.405 3.44 2 8.1 0.3
260 4 1 -6 38.648 77.295 0.405 3.44 4 10.7 0.9
261 1 1 7 38.673 77.345 0.406 3.44 4 23.2 4.2
262 5 0 -3 38.687 77.374 0.406 3.44 2 16.2 1.0
263 3 4 2 38.688 77.376 0.406 3.44 4 4.1 0.1
264 4 3 -4 38.696 77.392 0.406 3.43 4 17.1 2.3
265 1 3 6 38.769 77.538 0.406 3.42 4 14.2 1.6
266 4 3 1 38.807 77.614 0.407 3.42 4 40.7 12.9
267 4 1 3 38.847 77.694 0.407 3.41 4 26.3 5.4
268 5 1 -2 38.911 77.822 0.408 3.4 4 8.1 0.5
269 1 5 -4 38.918 77.836 0.408 3.4 4 31.0 7.5
270 1 4 5 38.963 77.926 0.408 3.39 4 10.4 0.8
271 0 5 4 39.158 78.316 0.41 3.37 4 13.3 1.4
272 2 4 4 39.204 78.408 0.41 3.36 4 11.6 1.0
273 5 1 -1 39.231 78.463 0.411 3.36 4 36.2 10.1
274 3 3 -6 39.236 78.471 0.411 3.36 4 1.0 0.0
275 3 1 5 39.316 78.632 0.411 3.34 4 17.9 2.5
276 1 0 -8 39.371 78.741 0.412 3.34 2 19.6 1.5
277 5 1 -3 39.371 78.742 0.412 3.34 4 5.6 0.2
278 2 5 2 39.479 78.958 0.413 3.32 4 21.1 3.4
279 5 0 0 39.648 79.296 0.414 3.3 2 0.4 0.0
280 2 0 -8 39.842 79.684 0.416 3.27 2 8.6 0.3
281 5 0 -4 39.927 79.853 0.417 3.26 2 36.5 5.0
282 1 3 -7 39.964 79.928 0.417 3.26 4 21.7 3.5
283 1 4 -6 39.973 79.946 0.417 3.26 4 2.2 0.0
284 3 2 -7 39.995 79.989 0.417 3.26 4 26.3 5.2
285 2 2 6 39.998 79.995 0.417 3.25 4 16.6 2.1
286 1 1 -8 40.051 80.103 0.418 3.25 4 17.4 2.2
287 5 1 0 40.327 80.655 0.42 3.21 4 25.1 4.6
288 3 3 4 40.372 80.743 0.42 3.21 4 24.2 4.3
289 0 6 0 40.427 80.853 0.421 3.2 2 67.5 16.7
290 2 1 -8 40.521 81.042 0.422 3.19 4 20.3 3.0
291 2 5 -4 40.577 81.154 0.422 3.19 4 37.9 10.5
292 5 1 -4 40.605 81.21 0.422 3.18 4 18.9 2.6
293 3 4 -5 40.615 81.229 0.423 3.18 4 17.3 2.2
294 4 2 -6 40.691 81.382 0.423 3.17 4 51.4 19.1
295 1 2 7 40.716 81.432 0.423 3.17 4 68.7 34.2
296 2 3 -7 40.729 81.459 0.424 3.17 4 20.9 3.1
297 0 0 8 40.795 81.589 0.424 3.16 2 33.2 4.0
298 0 4 6 40.803 81.606 0.424 3.16 4 59.9 25.9
299 0 6 1 40.813 81.627 0.424 3.16 4 50.7 18.6
300 4 2 3 40.888 81.776 0.425 3.15 4 10.0 0.7
301 5 2 -2 40.951 81.902 0.425 3.14 4 48.4 16.8
302 3 5 -1 40.975 81.949 0.426 3.14 4 21.3 3.3
303 4 3 -5 41.005 82.011 0.426 3.14 4 1.7 0.0
304 2 4 -6 41.033 82.067 0.426 3.13 4 23.4 3.9
305 0 3 7 41.089 82.178 0.427 3.13 4 37.6 10.1
306 4 3 2 41.158 82.316 0.427 3.12 4 72.5 37.5
307 4 4 -2 41.171 82.342 0.427 3.12 4 9.5 0.6
308 4 4 -1 41.193 82.385 0.428 3.12 4 59.3 25.1
309 3 5 -2 41.247 82.495 0.428 3.11 4 12.4 1.1
310 5 2 -1 41.268 82.535 0.428 3.11 4 27.6 5.4
311 1 5 4 41.289 82.578 0.428 3.11 4 5.4 0.2
312 3 2 5 41.351 82.702 0.429 3.1 4 15.2 1.6
313 1 6 0 41.369 82.739 0.429 3.1 4 14.9 1.6
314 5 2 -3 41.406 82.811 0.429 3.1 4 42.6 12.8
315 1 6 -1 41.46 82.921 0.43 3.09 4 42.3 12.6
316 0 1 8 41.47 82.94 0.43 3.09 4 33.5 7.9
317 3 5 0 41.473 82.946 0.43 3.09 4 16.4 1.9
318 5 0 1 41.512 83.025 0.43 3.08 2 8.9 0.3
319 3 4 3 41.517 83.034 0.43 3.08 4 46.2 15.0
320 4 0 -7 41.824 83.647 0.433 3.05 2 67.1 15.7
321 4 4 -3 41.919 83.838 0.434 3.05 4 22.8 3.6
322 5 0 -5 41.926 83.853 0.434 3.05 2 25.7 2.3
323 0 6 2 41.969 83.938 0.434 3.04 4 51.1 18.2
324 4 4 0 41.984 83.968 0.434 3.04 4 11.8 1.0
325 2 5 3 42.002 84.005 0.434 3.04 4 20.1 2.8
326 1 6 1 42.048 84.096 0.435 3.03 4 60.0 24.9
327 4 0 4 42.063 84.126 0.435 3.03 2 22.5 1.8
328 1 2 -8 42.079 84.158 0.435 3.03 4 59.4 24.4
329 1 5 -5 42.106 84.212 0.435 3.03 4 9.7 0.6
330 5 1 1 42.186 84.372 0.436 3.02 4 7.5 0.4
331 3 0 -8 42.195 84.389 0.436 3.02 2 37.8 4.9
332 3 5 -3 42.289 84.578 0.437 3.01 4 19.9 2.7
333 1 6 -2 42.32 84.64 0.437 3.01 4 59.0 23.9
334 5 2 0 42.352 84.704 0.437 3.01 4 40.8 11.5
335 4 1 -7 42.496 84.993 0.439 2.99 4 13.7 1.3
336 2 2 -8 42.544 85.088 0.439 2.99 4 31.8 6.9
337 5 1 -5 42.599 85.197 0.439 2.99 4 11.5 0.9
338 5 2 -4 42.627 85.255 0.44 2.98 4 45.0 13.8
339 0 5 5 42.635 85.27 0.44 2.98 4 25.4 4.4
340 4 1 4 42.735 85.47 0.44 2.97 4 27.5 5.1
341 3 5 1 42.738 85.475 0.441 2.97 4 16.1 1.8
342 3 1 -8 42.866 85.733 0.442 2.96 4 14.6 1.4
343 2 0 7 42.896 85.792 0.442 2.96 2 10.8 0.4
344 2 4 5 43.266 86.531 0.445 2.93 4 0.3 0.0
345 3 3 -7 43.365 86.731 0.446 2.93 4 21.7 3.1
346 2 3 6 43.369 86.737 0.446 2.93 4 7.5 0.4
347 4 4 -4 43.431 86.862 0.446 2.92 4 85.6 48.9
348 2 5 -5 43.449 86.898 0.446 2.92 4 28.3 5.3
349 0 2 8 43.486 86.972 0.447 2.92 4 39.0 10.2
350 1 6 2 43.491 86.982 0.447 2.92 4 39.0 10.1
351 1 4 6 43.502 87.005 0.447 2.92 4 52.3 18.2
352 4 4 1 43.539 87.079 0.447 2.91 4 1.5 0.0
353 2 1 7 43.567 87.133 0.447 2.91 4 21.9 3.2
354 3 0 6 43.763 87.526 0.449 2.9 2 29.8 2.9
355 0 6 3 43.885 87.77 0.45 2.89 4 7.2 0.3
356 1 6 -3 43.942 87.884 0.45 2.89 4 28.1 5.2
357 3 4 -6 43.959 87.918 0.451 2.89 4 12.9 1.1
358 2 6 -1 43.976 87.953 0.451 2.89 4 32.0 6.7
359 4 3 -6 44.054 88.107 0.451 2.88 4 44.2 12.9
360 1 3 7 44.078 88.156 0.452 2.88 4 24.3 3.9
361 1 0 8 44.079 88.158 0.452 2.88 2 40.5 5.4
362 3 5 -4 44.092 88.184 0.452 2.88 4 35.4 8.2
363 5 0 2 44.127 88.255 0.452 2.88 2 52.2 9.0
364 2 6 0 44.178 88.357 0.452 2.87 4 0.4 0.0
365 5 2 1 44.198 88.396 0.453 2.87 4 23.7 3.7
366 4 3 3 44.248 88.496 0.453 2.87 4 32.0 6.7
367 5 3 -2 44.311 88.622 0.453 2.87 4 7.3 0.4
368 3 1 6 44.433 88.865 0.454 2.86 4 29.6 5.7
369 4 2 -7 44.507 89.015 0.455 2.85 4 30.7 6.1
370 2 6 -2 44.539 89.078 0.455 2.85 4 3.4 0.1
371 5 2 -5 44.609 89.219 0.456 2.85 4 11.0 0.8
372 5 3 -1 44.624 89.249 0.456 2.85 4 14.9 1.4
373 1 4 -7 44.675 89.35 0.456 2.85 4 17.4 2.0
374 5 0 -6 44.676 89.352 0.456 2.85 2 31.2 3.2
375 3 3 5 44.707 89.414 0.457 2.84 4 21.4 3.0
376 4 2 4 44.745 89.49 0.457 2.84 4 37.5 9.1
377 1 1 8 44.748 89.497 0.457 2.84 4 10.0 0.7
378 5 3 -3 44.762 89.523 0.457 2.84 4 16.6 1.8
379 3 5 2 44.762 89.525 0.457 2.84 4 20.9 2.8
380 5 1 2 44.797 89.594 0.457 2.84 4 4.4 0.1
381 3 2 -8 44.876 89.752 0.458 2.83 4 37.6 9.2
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 0 0 1 4.684 9.369 9.43175 364.8 47.7 48.4 5.6
2 1 0 0 7.332 14.663 6.03605 21.6 2.8 2.9 5.6
3 0 1 1 7.786 15.571 5.68617 350.1 45.7 46.3 5.6
4 0 0 2 9.401 18.801 4.71587 74.6 9.8 9.8 5.6
5 1 1 0 9.627 19.254 4.60608 285.5 37.3 37.6 5.6
6 1 1 -1 9.897 19.793 4.48175 182.6 23.9 24.1 5.6
7 0 1 2 11.295 22.59 3.93285 84.0 11.0 11.1 5.6
8 1 1 1 11.498 22.996 3.86433 202.1 26.4 26.6 5.6
9 1 1 -2 12.171 24.343 3.65344 12.0 1.6 1.6 5.6
10 0 2 0 12.483 24.967 3.5635 184.0 24.0 24.2 5.6
11 1 0 2 13.33 26.66 3.34092 9.6 1.3 1.3 5.6
12 0 2 1 13.36 26.72 3.33351 256.0 33.4 33.6 5.6
13 0 0 3 14.182 28.364 3.14392 568.2 74.2 74.4 5.6
14 2 0 -1 14.373 28.745 3.10311 121.2 15.8 15.9 5.6
15 1 2 -1 14.722 29.444 3.03103 62.2 8.1 8.1 5.6
16 1 1 2 14.752 29.504 3.02504 31.6 4.1 4.1 5.6
17 2 0 0 14.787 29.574 3.01802 229.4 30.0 30.0 5.6
18 0 1 3 15.533 31.065 2.87648 183.0 23.9 23.9 5.6
19 0 2 2 15.72 31.439 2.84309 765.4 100.0 100.0 5.6
20 1 2 1 15.87 31.74 2.81688 399.1 52.1 52.1 5.6
21 2 1 0 16.091 32.182 2.77912 139.1 18.2 18.2 5.6
22 1 2 -2 16.377 32.753 2.73198 447.1 58.4 58.3 5.6
23 2 0 1 16.64 33.281 2.68987 103.2 13.5 13.5 5.6
24 2 1 -2 16.756 33.512 2.67184 57.3 7.5 7.5 5.7
25 2 0 -3 17.912 35.824 2.50454 308.4 40.3 40.1 5.7
26 1 2 2 18.424 36.847 2.43728 71.3 9.3 9.3 5.7
27 1 1 3 18.746 37.493 2.3968 61.9 8.1 8.0 5.7
28 2 1 -3 19.026 38.051 2.36289 36.2 4.7 4.7 5.7
29 0 2 3 19.07 38.141 2.35754 63.8 8.3 8.3 5.7
30 1 2 -3 19.163 38.325 2.34663 181.6 23.7 23.6 5.7
31 2 2 -1 19.217 38.435 2.34019 57.8 7.6 7.5 5.7
32 2 2 0 19.54 39.08 2.30304 129.6 16.9 16.8 5.7
33 2 0 2 19.571 39.142 2.29953 11.6 1.5 1.5 5.7
34 1 1 -4 19.76 39.52 2.27841 45.5 5.9 5.9 5.7
35 0 1 4 20.126 40.253 2.2386 23.5 3.1 3.1 5.7
36 1 3 0 20.392 40.785 2.21061 18.5 2.4 2.4 5.7
37 1 3 -1 20.53 41.06 2.19643 12.5 1.6 1.6 5.7
38 2 1 2 20.608 41.216 2.18844 23.0 3.0 3.0 5.7
39 2 0 -4 21.227 42.453 2.12752 19.3 2.5 2.5 5.7
40 0 3 2 21.288 42.576 2.12166 21.9 2.9 2.8 5.7
41 1 3 -2 21.799 43.598 2.07427 113.5 14.8 14.7 5.7
42 2 2 -3 22.081 44.162 2.04907 8.1 1.1 1.0 5.7
43 2 1 -4 22.2 44.4 2.03862 121.6 15.9 15.7 5.7
44 1 0 4 22.251 44.502 2.03419 50.0 6.5 6.5 5.7
45 1 2 -4 22.733 45.467 1.99325 83.6 10.9 10.8 5.7
46 0 2 4 23.061 46.123 1.96643 15.3 2.0 2.0 5.7
47 3 1 -2 23.133 46.266 1.96065 20.9 2.7 2.7 5.7
48 2 0 3 23.244 46.488 1.95181 215.1 28.1 27.7 5.7
49 1 0 -5 23.386 46.772 1.94063 92.4 12.1 11.9 5.7
50 1 3 2 23.444 46.888 1.93609 47.1 6.2 6.1 5.7
51 2 2 2 23.495 46.989 1.93217 141.8 18.5 18.2 5.7
52 3 0 -3 23.635 47.27 1.92135 12.6 1.6 1.6 5.7
53 0 3 3 23.979 47.957 1.89539 80.2 10.5 10.3 5.7
54 2 3 -1 24.101 48.202 1.88634 82.2 10.7 10.6 5.7
55 2 1 3 24.153 48.307 1.88249 28.2 3.7 3.6 5.7
56 3 0 1 24.237 48.475 1.87636 14.2 1.9 1.8 5.7
57 2 3 0 24.371 48.741 1.86672 68.6 9.0 8.8 5.7
58 3 1 -3 24.533 49.066 1.85512 13.4 1.8 1.7 5.7
59 2 3 -2 24.847 49.694 1.83315 45.8 6.0 5.9 5.7
60 0 1 5 24.987 49.973 1.82356 16.9 2.2 2.2 5.7
61 3 1 1 25.12 50.239 1.81452 10.2 1.3 1.3 5.8
62 0 4 0 25.615 51.229 1.78175 203.6 26.6 26.1 5.8
63 3 2 -2 25.797 51.595 1.76999 13.2 1.7 1.7 5.8
64 1 2 4 25.85 51.7 1.76662 42.9 5.6 5.5 5.8
65 2 1 -5 26.031 52.063 1.75517 17.8 2.3 2.3 5.8
66 3 2 0 26.081 52.163 1.75204 32.3 4.2 4.1 5.8
67 1 3 3 26.33 52.661 1.73664 28.1 3.7 3.6 5.8
68 2 3 -3 26.545 53.09 1.72361 70.3 9.2 9.0 5.8
69 2 2 3 26.742 53.484 1.71185 25.8 3.4 3.3 5.8
70 1 4 0 26.792 53.585 1.70886 10.3 1.4 1.3 5.8
71 3 1 -4 26.837 53.673 1.70625 26.4 3.5 3.4 5.8
72 1 2 -5 26.87 53.74 1.7043 9.2 1.2 1.2 5.8
73 1 4 -1 26.904 53.808 1.70228 17.7 2.3 2.3 5.8
74 3 2 -3 27.095 54.19 1.69119 42.9 5.6 5.5 5.8
75 2 0 4 27.459 54.919 1.67046 17.5 2.3 2.2 5.8
76 0 2 5 27.518 55.036 1.66717 47.0 6.1 6.0 5.8
77 3 2 1 27.642 55.285 1.66026 56.3 7.4 7.2 5.8
78 2 3 2 27.787 55.575 1.65228 41.4 5.4 5.3 5.8
79 2 3 -4 29.079 58.158 1.58488 19.4 2.5 2.5 5.8
80 0 0 6 29.341 58.683 1.57196 40.3 5.3 5.1 5.8
81 2 0 -6 29.608 59.215 1.55909 12.7 1.7 1.6 5.8
82 0 4 3 29.796 59.592 1.55012 92.0 12.0 11.6 5.8
83 2 4 -1 29.902 59.803 1.54516 34.9 4.6 4.4 5.8
84 0 1 6 30.119 60.237 1.53506 17.4 2.3 2.2 5.8
85 1 2 5 30.345 60.691 1.52467 31.1 4.1 3.9 5.8
86 2 1 -6 30.381 60.761 1.52307 40.1 5.2 5.1 5.8
87 4 1 -1 30.561 61.122 1.51494 9.6 1.3 1.2 5.8
88 2 3 3 30.715 61.429 1.5081 19.7 2.6 2.5 5.8
89 1 3 -5 30.832 61.664 1.50293 9.1 1.2 1.1 5.8
90 4 1 -3 31.378 62.756 1.47936 10.3 1.3 1.3 5.9
91 1 2 -6 31.47 62.941 1.47547 31.9 4.2 4.0 5.9
92 1 4 3 31.852 63.705 1.45961 11.1 1.4 1.4 5.9
93 2 4 -3 32.043 64.086 1.45184 24.5 3.2 3.1 5.9
94 3 2 -5 32.176 64.353 1.44646 94.4 12.3 11.9 5.9
95 4 0 -4 32.313 64.625 1.44101 39.2 5.1 4.9 5.9
96 1 0 6 32.392 64.783 1.43789 9.8 1.3 1.2 5.9
97 2 2 -6 32.634 65.269 1.42836 10.1 1.3 1.3 5.9
98 4 2 -2 32.784 65.568 1.42256 36.7 4.8 4.6 5.9
99 2 1 5 32.868 65.736 1.41932 9.2 1.2 1.2 5.9
100 4 1 -4 33.049 66.098 1.41243 11.0 1.4 1.4 5.9
101 4 2 -3 33.595 67.189 1.39212 20.4 2.7 2.5 5.9
102 1 0 -7 33.674 67.347 1.38924 7.9 1.0 1.0 5.9
103 1 5 0 33.729 67.457 1.38724 11.0 1.4 1.4 5.9
104 2 4 -4 34.326 68.652 1.36599 40.0 5.2 5.0 5.9
105 1 1 -7 34.395 68.79 1.36357 8.9 1.2 1.1 5.9
106 2 0 -7 34.487 68.974 1.36038 9.2 1.2 1.2 5.9
107 4 0 2 34.941 69.881 1.34494 31.0 4.0 3.9 5.9
108 2 2 5 35.036 70.071 1.34175 63.1 8.2 7.8 5.9
109 1 4 4 35.079 70.158 1.3403 10.0 1.3 1.2 5.9
110 1 2 6 35.287 70.574 1.33343 25.2 3.3 3.1 5.9
111 4 2 1 35.326 70.651 1.33215 33.8 4.4 4.2 5.9
112 0 1 7 35.578 71.156 1.32394 13.2 1.7 1.6 5.9
113 4 1 2 35.65 71.3 1.32161 23.6 3.1 2.9 5.9
114 3 2 -6 35.769 71.538 1.3178 31.8 4.2 3.9 5.9
115 2 4 3 35.828 71.657 1.31591 82.1 10.7 10.2 5.9
116 1 4 -5 35.937 71.874 1.31247 25.4 3.3 3.2 5.9
117 0 3 6 35.985 71.97 1.31095 9.1 1.2 1.1 5.9
118 2 3 -6 36.225 72.449 1.30346 46.9 6.1 5.8 5.9
119 0 5 3 36.395 72.789 1.2982 19.6 2.6 2.4 6.0
120 2 5 -1 36.49 72.98 1.29528 22.6 3.0 2.8 6.0
121 2 5 0 36.701 73.401 1.28888 12.8 1.7 1.6 6.0
122 3 2 4 36.94 73.879 1.28172 45.3 5.9 5.6 6.0
123 4 3 -3 37.142 74.283 1.27574 28.9 3.8 3.6 6.0
124 4 3 0 37.209 74.418 1.27377 15.4 2.0 1.9 6.0
125 2 0 6 37.252 74.504 1.27252 20.1 2.6 2.5 6.0
126 4 2 -5 37.589 75.179 1.26276 27.1 3.5 3.3 6.0
127 3 1 -7 37.941 75.882 1.2528 16.0 2.1 2.0 6.0
128 1 5 3 38.271 76.542 1.24363 7.8 1.0 1.0 6.0
129 2 3 5 38.527 77.054 1.23664 36.4 4.8 4.5 6.0
130 1 1 7 38.673 77.345 1.2327 7.7 1.0 0.9 6.0
131 4 3 1 38.807 77.614 1.22911 12.9 1.7 1.6 6.0
132 5 1 -1 39.231 78.463 1.21792 11.1 1.5 1.4 6.0
133 0 6 0 40.427 80.853 1.18783 16.7 2.2 2.0 6.1
134 2 5 -4 40.577 81.154 1.18419 13.1 1.7 1.6 6.1
135 1 2 7 40.716 81.432 1.18085 56.5 7.4 6.9 6.1
136 0 6 1 40.813 81.627 1.17852 48.4 6.3 5.9 6.1
137 5 2 -2 40.951 81.902 1.17526 20.1 2.6 2.4 6.1
138 0 3 7 41.089 82.178 1.17201 10.1 1.3 1.2 6.1
139 4 3 2 41.158 82.316 1.17039 38.1 5.0 4.6 6.1
140 4 4 -1 41.193 82.385 1.16959 25.1 3.3 3.0 6.1
141 5 2 -3 41.406 82.811 1.16464 12.8 1.7 1.6 6.1
142 1 6 -1 41.46 82.921 1.16339 22.5 2.9 2.7 6.1
143 3 4 3 41.517 83.034 1.16208 15.0 2.0 1.8 6.1
144 4 0 -7 41.824 83.647 1.15512 15.7 2.0 1.9 6.1
145 0 6 2 41.969 83.938 1.15186 19.1 2.5 2.3 6.1
146 1 6 1 42.048 84.096 1.15009 26.7 3.5 3.2 6.1
147 1 2 -8 42.079 84.158 1.14941 25.1 3.3 3.0 6.1
148 1 6 -2 42.32 84.64 1.14409 23.9 3.1 2.9 6.1
149 5 2 0 42.352 84.704 1.14338 11.5 1.5 1.4 6.1
150 5 2 -4 42.627 85.255 1.1374 18.2 2.4 2.2 6.1
151 4 4 -4 43.431 86.862 1.12044 54.2 7.1 6.5 6.1
152 1 4 6 43.502 87.005 1.11897 38.5 5.0 4.6 6.1
153 4 3 -6 44.054 88.107 1.10779 22.2 2.9 2.6 6.2
154 3 5 -4 44.092 88.184 1.10703 8.2 1.1 1.0 6.2
155 5 0 2 44.127 88.255 1.10632 9.0 1.2 1.1 6.2
156 4 2 4 44.745 89.49 1.09422 14.4 1.9 1.7 6.2
157 3 2 -8 44.876 89.752 1.0917 9.2 1.2 1.1 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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