Institute of Experimental Mineralogy
Russian Academy of Sciences
-------------------------------------------------
142432, Chernogolovka, Moscow district
A.V. Chichagov +7(496)52-22320
***
*** W W W - X R A Y P O L ***
***********************
MIARGYRITE
3, f-stephanite, s-miargyrite
AgSbS(2)
Monoclinic C 2 Z = 8
R =0.049 NR =74
25 .10 .1901
Ref.Str.:
J.V. Smith, J.J. Pluth, Sh. Han (1997)
* Miner. Mag., 61, 671-675
Reserv:
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 12.824 alpha = 90.0
b = 4.406 beta = 98.57
c = 13.193 gamma = 90.0
Unit cell volume (cub. angs.) = 737.12
Molar volume ( cub.cm/mol.) = 55.5
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.0 0.0 0.0 Ag = 1.00
2 0.0005 0.47 0.2499 0.0 Ag = 1.00
3 0.0 0.9409 0.5 0.0 Ag = 1.00
4 0.2554 0.9306 0.3766 0.0 Sb = 1.00
5 0.7447 0.9998 0.1234 0.0 Sb = 1.00
6 0.1434 0.314 0.4496 0.0 S = 1.00
7 0.8566 0.6144 0.0505 0.0 S = 1.00
8 0.1117 0.1438 0.1676 0.0 S = 1.00
9 0.8883 0.7853 0.3325 0.0 S = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.0 0.0
2 2 0.0005 0.47 0.2499
3 3 0.0 0.9409 0.5
4 4 0.2554 0.9306 0.3766
5 5 0.7447 0.9998 0.1234
6 6 0.1434 0.314 0.4496
7 7 0.8566 0.6144 0.0505
8 8 0.1117 0.1438 0.1676
9 9 0.8883 0.7853 0.3325
10 2 0.9995 0.47 0.7501
11 4 0.7446 0.9306 0.6234
12 5 0.2553 0.9998 0.8766
13 6 0.8566 0.314 0.5504
14 7 0.1434 0.6144 0.9495
15 8 0.8883 0.1438 0.8324
16 9 0.1117 0.7853 0.6675
17 1 0.5 0.5 0.0
18 2 0.4995 0.97 0.7501
19 3 0.5 0.4409 0.5
20 4 0.2446 0.4306 0.6234
21 5 0.7553 0.4998 0.8766
22 6 0.3566 0.814 0.5504
23 7 0.6434 0.1144 0.9495
24 8 0.3883 0.6438 0.8324
25 9 0.6117 0.2853 0.6675
26 2 0.5005 0.97 0.2499
27 4 0.7554 0.4306 0.3766
28 5 0.2447 0.4998 0.1234
29 6 0.6434 0.814 0.4496
30 7 0.3566 0.1144 0.0505
31 8 0.6117 0.6438 0.1676
32 9 0.3883 0.2853 0.3325
X-ray density (g/cm cub.) = 5.29
MU (1/cm) = 1118.811 Mass attenuation coefficient (cm**2/g) = 211.416
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ag 3.54 6
3.3941 7
2.6605 7
2.53 8
3.3941 7
2.6605 7
2.53 8
2 Ag 3.54 5
3.0546 6
3.0469 7
3.5337 8
2.3957 8
2.3774 9
3 Ag 3.54 6
2.6249 6
3.4376 6
2.5417 9
2.6249 6
3.4376 6
2.5417 9
4 Sb 3.264 4
2.5015 6
3.2196 8
2.514 6
2.4455 9
5 Sb 3.264 4
2.5055 7
3.2231 9
2.5131 7
2.4509 8
6 S 4.368 9
3.7566 8
3.9862 9
4.1236 9
4.0928 6
3.618 9
3.7688 9
3.6079 6
3.6079 6
3.7032 9
7 S 4.368 9
4.126 8
3.9852 8
3.7579 9
4.0948 7
3.7737 8
3.6193 8
3.6081 7
3.6081 7
3.7033 8
8 S 4.368 8
3.7566 6
3.9852 7
4.126 7
4.1577 9
3.6193 7
3.7737 7
3.7033 7
3.9252 9
9 S 4.368 8
4.1236 6
3.9862 6
3.7579 7
4.1577 8
3.7688 6
3.618 6
3.7032 6
3.9252 8
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 3.385 6.77 0.038 570.7 2 0.1 0.0
2 0 0 2 6.782 13.564 0.077 140.46 2 43.9 99.4
3 2 0 0 6.978 13.956 0.079 132.55 2 33.0 53.1
4 2 0 -1 7.292 14.583 0.082 121.21 2 0.9 0.0
5 2 0 1 8.208 16.416 0.093 95.18 2 0.9 0.0
6 2 0 -2 8.992 17.984 0.101 78.94 2 18.0 9.4
7 0 0 3 10.203 20.406 0.115 60.83 2 0.2 0.0
8 2 0 2 10.463 20.926 0.118 57.74 2 92.7 182.6
9 1 1 0 10.666 21.331 0.12 55.48 4 19.0 14.8
10 1 1 -1 11.04 22.08 0.124 51.64 4 37.1 52.4
11 1 1 1 11.361 22.723 0.128 48.64 4 7.7 2.1
12 2 0 -3 11.497 22.993 0.129 47.46 2 1.7 0.1
13 1 1 -2 12.393 24.786 0.139 40.55 4 15.3 7.0
14 1 1 2 12.965 25.93 0.146 36.87 4 570.8 8846.0
15 2 0 3 13.252 26.503 0.149 35.21 2 1.0 0.0
16 0 0 4 13.661 27.322 0.153 33.01 2 39.8 19.2
17 4 0 -1 13.966 27.932 0.157 31.5 2 2.4 0.1
18 4 0 0 14.062 28.124 0.158 31.04 2 482.5 2660.2
19 2 0 -4 14.417 28.834 0.162 29.44 2 473.2 2425.8
20 1 1 -3 14.469 28.937 0.162 29.22 4 70.1 105.7
21 3 1 0 14.627 29.255 0.164 28.54 4 62.4 81.9
22 3 1 -1 14.66 29.32 0.164 28.41 4 211.6 935.9
23 4 0 -2 14.705 29.409 0.165 28.22 2 8.7 0.8
24 4 0 1 14.978 29.956 0.168 27.13 2 2.0 0.0
25 1 1 3 15.21 30.421 0.17 26.25 4 61.8 73.8
26 3 1 1 15.394 30.787 0.172 25.58 4 46.9 41.5
27 3 1 -2 15.488 30.975 0.173 25.25 4 743.3 10269.4
28 4 0 -3 16.174 32.347 0.181 23.0 2 1.6 0.0
29 2 0 4 16.333 32.667 0.183 22.51 2 803.2 5346.2
30 4 0 2 16.591 33.181 0.185 21.76 2 22.9 4.2
31 3 1 2 16.861 33.722 0.188 21.01 4 11.6 2.1
32 3 1 -3 17.005 34.01 0.19 20.63 4 183.5 511.5
33 1 1 -4 17.028 34.057 0.19 20.57 4 11.6 2.0
34 0 0 5 17.171 34.342 0.192 20.2 2 0.2 0.0
35 2 0 -5 17.58 35.161 0.196 19.18 2 1.8 0.0
36 1 1 4 17.884 35.769 0.199 18.48 4 21.3 6.2
37 4 0 -4 18.216 36.432 0.203 17.75 2 10.2 0.7
38 4 0 3 18.742 37.483 0.209 16.67 2 1.5 0.0
39 3 1 3 18.885 37.77 0.21 16.39 4 28.1 9.5
40 3 1 -4 19.068 38.136 0.212 16.05 4 5.8 0.4
41 2 0 5 19.607 39.213 0.218 15.09 2 0.6 0.0
42 1 1 -5 19.919 39.837 0.221 14.57 4 118.9 151.6
43 5 1 -1 20.352 40.703 0.226 13.89 4 96.0 94.2
44 0 2 0 20.466 40.932 0.227 13.71 2 485.2 1188.5
45 5 1 0 20.514 41.028 0.227 13.64 4 78.2 61.4
46 4 0 -5 20.689 41.379 0.229 13.39 2 1.6 0.0
47 0 0 6 20.748 41.497 0.23 13.3 2 38.6 7.3
48 0 2 1 20.769 41.538 0.23 13.27 4 256.7 644.0
49 5 1 -2 20.797 41.594 0.23 13.23 4 29.2 8.3
50 1 1 5 20.856 41.712 0.231 13.15 4 3.2 0.1
51 2 0 -6 20.915 41.831 0.232 13.06 2 57.1 15.7
52 6 0 -1 21.126 42.253 0.234 12.77 2 2.2 0.0
53 5 1 1 21.273 42.547 0.236 12.58 4 87.5 70.9
54 4 0 4 21.297 42.593 0.236 12.55 2 12.3 0.7
55 3 1 4 21.336 42.671 0.236 12.49 4 15.7 2.3
56 6 0 0 21.374 42.749 0.237 12.44 2 1.6 0.0
57 6 0 -2 21.469 42.938 0.238 12.32 2 95.0 40.9
58 3 1 -5 21.548 43.097 0.238 12.22 4 70.9 45.2
59 0 2 2 21.657 43.314 0.24 12.08 4 1.8 0.0
60 2 2 0 21.725 43.45 0.24 12.0 4 18.2 2.9
61 5 1 -3 21.82 43.64 0.241 11.88 4 11.6 1.2
62 2 2 -1 21.837 43.675 0.241 11.86 4 14.9 2.0
63 2 2 1 22.19 44.379 0.245 11.44 4 89.6 67.6
64 6 0 1 22.197 44.394 0.245 11.43 2 2.1 0.0
65 6 0 -3 22.38 44.761 0.247 11.22 2 3.0 0.0
66 2 2 -2 22.519 45.039 0.249 11.07 4 16.7 2.3
67 5 1 2 22.58 45.16 0.249 11.0 4 634.2 3256.0
68 2 0 6 23.033 46.066 0.254 10.52 2 130.7 66.2
69 1 1 -6 23.054 46.108 0.254 10.49 4 643.9 3202.6
70 0 2 3 23.076 46.153 0.254 10.47 4 54.8 23.1
71 2 2 2 23.203 46.407 0.256 10.34 4 4.3 0.1
72 5 1 -4 23.36 46.72 0.257 10.19 4 20.2 3.1
73 4 0 -6 23.492 46.983 0.259 10.06 2 4.4 0.1
74 6 0 2 23.547 47.094 0.259 10.0 2 19.2 1.4
75 2 2 -3 23.732 47.465 0.261 9.83 4 60.1 26.1
76 6 0 -4 23.809 47.618 0.262 9.75 2 724.5 1884.6
77 1 1 6 24.057 48.113 0.265 9.53 4 18.1 2.3
78 3 1 5 24.117 48.234 0.265 9.47 4 68.4 32.7
79 4 0 5 24.164 48.327 0.266 9.43 2 1.4 0.0
80 3 1 -6 24.353 48.707 0.268 9.27 4 30.0 6.2
81 5 1 3 24.366 48.732 0.268 9.26 4 203.7 282.7
82 2 0 -7 24.398 48.795 0.268 9.23 2 0.6 0.0
83 0 0 7 24.413 48.826 0.268 9.22 2 1.1 0.0
84 2 2 3 24.714 49.429 0.271 8.96 4 168.0 186.3
85 0 2 4 24.957 49.915 0.274 8.76 4 20.3 2.7
86 4 2 -1 25.142 50.283 0.276 8.62 4 60.5 23.2
87 4 2 0 25.2 50.4 0.276 8.57 4 590.6 2201.7
88 5 1 -5 25.346 50.691 0.278 8.46 4 4.1 0.1
89 6 0 3 25.36 50.719 0.278 8.45 2 2.3 0.0
90 2 2 -4 25.419 50.838 0.279 8.41 4 593.4 2178.9
91 4 2 -2 25.599 51.199 0.28 8.27 4 65.7 26.2
92 6 0 -5 25.69 51.381 0.281 8.21 2 3.0 0.0
93 4 2 1 25.773 51.545 0.282 8.15 4 28.7 4.9
94 1 1 -7 26.393 52.785 0.289 7.72 4 195.8 217.7
95 4 2 -3 26.554 53.108 0.29 7.61 4 4.7 0.1
96 4 0 -7 26.561 53.122 0.29 7.61 2 2.0 0.0
97 5 1 4 26.562 53.124 0.29 7.6 4 104.9 61.6
98 2 0 7 26.604 53.208 0.291 7.58 2 0.2 0.0
99 2 2 4 26.661 53.322 0.291 7.54 4 453.3 1140.9
100 4 2 2 26.835 53.67 0.293 7.43 4 44.9 11.0
101 7 1 -1 27.089 54.178 0.296 7.27 4 33.5 6.0
102 3 1 6 27.17 54.34 0.296 7.22 4 483.4 1242.6
103 0 2 5 27.233 54.467 0.297 7.18 4 12.1 0.8
104 4 0 6 27.288 54.576 0.298 7.15 2 137.1 49.5
105 7 1 -2 27.299 54.598 0.298 7.15 4 462.3 1124.2
106 7 1 0 27.37 54.741 0.298 7.1 4 24.8 3.2
107 3 1 -7 27.426 54.852 0.299 7.07 4 5.2 0.1
108 1 1 7 27.454 54.909 0.299 7.05 4 53.2 14.7
109 2 2 -5 27.519 55.038 0.3 7.02 4 16.8 1.5
110 6 0 4 27.573 55.146 0.3 6.99 2 451.5 524.2
111 5 1 -6 27.712 55.425 0.302 6.91 4 455.4 1054.1
112 6 0 -6 27.963 55.926 0.304 6.77 2 39.0 3.8
113 4 2 -4 27.97 55.941 0.304 6.76 4 22.7 2.6
114 7 1 -3 27.993 55.985 0.305 6.75 4 11.1 0.6
115 2 0 -8 28.026 56.052 0.305 6.73 2 5.3 0.1
116 7 1 1 28.133 56.265 0.306 6.67 4 1.7 0.0
117 0 0 8 28.187 56.374 0.307 6.64 2 433.9 460.4
118 4 2 3 28.35 56.7 0.308 6.56 4 29.3 4.2
119 8 0 -1 28.732 57.463 0.312 6.36 2 3.5 0.0
120 8 0 -2 28.861 57.723 0.313 6.3 2 136.3 43.1
121 2 2 5 28.988 57.975 0.315 6.24 4 258.2 306.1
122 8 0 0 29.074 58.149 0.315 6.19 2 620.3 877.4
123 5 1 5 29.11 58.221 0.316 6.18 4 3.3 0.0
124 7 1 -4 29.147 58.294 0.316 6.16 4 42.3 8.1
125 7 1 2 29.352 58.703 0.318 6.06 4 23.2 2.4
126 8 0 -3 29.459 58.919 0.319 6.01 2 2.8 0.0
127 4 2 -5 29.806 59.612 0.323 5.86 4 40.8 7.2
128 0 2 6 29.852 59.703 0.323 5.84 4 62.0 16.5
129 4 0 -8 29.865 59.73 0.323 5.83 2 650.8 909.3
130 8 0 1 29.879 59.759 0.323 5.83 2 3.2 0.0
131 1 1 -8 29.922 59.844 0.324 5.81 4 55.3 13.1
132 2 2 -6 29.98 59.96 0.324 5.78 4 0.4 0.0
133 6 0 5 30.135 60.27 0.326 5.72 2 2.1 0.0
134 6 2 -1 30.143 60.286 0.326 5.71 4 16.7 1.2
135 4 2 4 30.275 60.55 0.327 5.66 4 26.0 2.8
136 2 0 8 30.328 60.656 0.328 5.63 2 32.9 2.2
137 6 2 0 30.335 60.671 0.328 5.63 4 16.2 1.1
138 6 2 -2 30.409 60.818 0.329 5.6 4 37.5 5.8
139 5 1 -7 30.411 60.821 0.329 5.6 4 41.5 7.1
140 3 1 7 30.463 60.927 0.329 5.58 4 45.8 8.6
141 8 0 -4 30.509 61.018 0.33 5.56 2 45.8 4.3
142 6 0 -7 30.577 61.155 0.33 5.53 2 2.3 0.0
143 4 0 7 30.643 61.286 0.331 5.51 2 1.4 0.0
144 7 1 -5 30.73 61.461 0.332 5.47 4 37.6 5.7
145 3 1 -8 30.739 61.477 0.332 5.47 4 12.7 0.7
146 6 2 1 30.982 61.964 0.334 5.37 4 5.3 0.1
147 7 1 3 30.994 61.989 0.334 5.37 4 76.3 23.0
148 1 1 8 31.043 62.085 0.335 5.35 4 58.9 13.6
149 8 0 2 31.125 62.249 0.336 5.32 2 154.7 46.9
150 6 2 -3 31.127 62.255 0.336 5.32 4 231.5 209.8
151 2 2 6 31.65 63.3 0.341 5.13 4 5.1 0.1
152 2 0 -9 31.815 63.629 0.342 5.07 2 0.7 0.0
153 1 3 0 31.869 63.738 0.343 5.05 4 36.1 4.8
154 5 1 6 31.972 63.943 0.344 5.02 4 8.8 0.3
155 8 0 -5 31.984 63.967 0.344 5.01 2 2.4 0.0
156 4 2 -6 32.021 64.043 0.344 5.0 4 35.2 4.6
157 1 3 -1 32.023 64.047 0.344 5.0 4 76.0 21.3
158 6 2 2 32.066 64.132 0.345 4.98 4 107.0 42.0
159 0 0 9 32.1 64.2 0.345 4.97 2 0.7 0.0
160 1 3 1 32.159 64.319 0.346 4.95 4 157.0 89.8
161 6 2 -4 32.28 64.56 0.347 4.91 4 404.0 590.2
162 4 2 5 32.571 65.142 0.349 4.82 4 88.6 27.8
163 1 3 -2 32.619 65.238 0.35 4.8 4 21.2 1.6
164 7 1 -6 32.708 65.416 0.351 4.77 4 8.3 0.2
165 2 2 -7 32.764 65.529 0.351 4.76 4 25.6 2.3
166 0 2 7 32.777 65.554 0.351 4.75 4 100.7 35.5
167 8 0 3 32.782 65.564 0.351 4.75 2 2.2 0.0
168 1 3 2 32.888 65.776 0.352 4.72 4 555.2 1070.6
169 6 0 6 33.011 66.021 0.354 4.68 2 28.1 1.4
170 7 1 4 33.027 66.054 0.354 4.68 4 113.5 44.3
171 4 0 -9 33.395 66.791 0.357 4.57 2 2.2 0.0
172 5 1 -8 33.41 66.819 0.357 4.56 4 47.7 7.6
173 6 0 -8 33.502 67.003 0.358 4.54 2 60.5 6.1
174 6 2 3 33.566 67.132 0.359 4.52 4 108.4 39.1
175 1 3 -3 33.643 67.286 0.36 4.5 4 30.8 3.1
176 1 1 -9 33.648 67.297 0.36 4.5 4 19.3 1.2
177 3 3 0 33.727 67.453 0.36 4.47 4 22.2 1.6
178 3 3 -1 33.744 67.488 0.361 4.47 4 195.5 125.7
179 6 2 -5 33.845 67.689 0.362 4.44 4 183.1 109.6
180 8 0 -6 33.855 67.711 0.362 4.44 2 40.8 2.7
181 3 1 8 33.99 67.98 0.363 4.4 4 9.3 0.3
182 1 3 3 34.04 68.08 0.363 4.39 4 170.4 93.8
183 3 3 1 34.141 68.281 0.364 4.36 4 6.5 0.1
184 3 3 -2 34.193 68.385 0.365 4.35 4 289.3 267.8
185 4 0 8 34.225 68.451 0.365 4.34 2 533.7 454.8
186 2 0 9 34.227 68.454 0.365 4.34 2 0.2 0.0
187 3 1 -9 34.284 68.568 0.366 4.32 4 48.4 7.5
188 4 2 -7 34.585 69.169 0.368 4.25 4 173.1 93.7
189 2 2 7 34.622 69.243 0.369 4.24 4 5.9 0.1
190 9 1 -1 34.652 69.305 0.369 4.23 4 34.9 3.8
191 9 1 -2 34.704 69.408 0.37 4.22 4 10.5 0.3
192 8 0 4 34.825 69.649 0.371 4.19 2 9.4 0.1
193 1 1 9 34.833 69.666 0.371 4.19 4 30.8 2.9
194 3 3 2 34.979 69.957 0.372 4.15 4 24.2 1.8
195 9 1 0 35.027 70.054 0.373 4.14 4 37.2 4.2
196 7 1 -7 35.051 70.102 0.373 4.13 4 23.7 1.7
197 3 3 -3 35.064 70.128 0.373 4.13 4 172.1 90.1
198 1 3 -4 35.078 70.156 0.373 4.13 4 6.3 0.1
199 5 1 7 35.124 70.249 0.373 4.12 4 3.6 0.0
200 9 1 -3 35.181 70.362 0.374 4.1 4 15.4 0.7
201 4 2 6 35.21 70.42 0.374 4.1 4 9.3 0.3
202 7 1 5 35.421 70.842 0.376 4.05 4 2.8 0.0
203 6 2 4 35.457 70.915 0.377 4.04 4 478.4 680.4
204 1 3 4 35.597 71.194 0.378 4.01 4 44.5 5.8
205 2 0 -10 35.79 71.58 0.38 3.96 2 55.6 4.5
206 6 2 -6 35.797 71.594 0.38 3.96 4 29.3 2.5
207 9 1 1 35.822 71.644 0.38 3.96 4 70.8 14.6
208 2 2 -8 35.852 71.704 0.38 3.95 4 34.5 3.5
209 0 2 8 35.993 71.986 0.381 3.92 4 486.9 684.2
210 9 1 -4 36.075 72.151 0.382 3.9 4 86.5 21.5
211 8 0 -7 36.099 72.197 0.382 3.9 2 3.7 0.0
212 6 0 7 36.183 72.366 0.383 3.88 2 1.7 0.0
213 0 0 10 36.188 72.377 0.383 3.88 2 71.6 7.3
214 3 3 3 36.228 72.455 0.384 3.87 4 65.8 12.3
215 3 3 -4 36.346 72.691 0.385 3.85 4 39.0 4.3
216 8 2 -1 36.471 72.943 0.386 3.82 4 106.5 31.9
217 8 2 -2 36.586 73.172 0.387 3.8 4 24.7 1.7
218 5 1 -9 36.697 73.394 0.388 3.78 4 11.8 0.4
219 6 0 -9 36.721 73.443 0.388 3.77 2 1.9 0.0
220 8 2 0 36.774 73.549 0.389 3.76 4 389.5 420.3
221 1 3 -5 36.904 73.809 0.39 3.74 4 182.3 91.5
222 10 0 -2 36.962 73.925 0.39 3.73 2 25.8 0.9
223 10 0 -1 36.976 73.952 0.39 3.72 2 2.7 0.0
224 9 1 2 37.026 74.051 0.391 3.72 4 422.3 487.6
225 8 2 -3 37.116 74.232 0.392 3.7 4 107.5 31.5
226 4 0 -10 37.163 74.326 0.392 3.69 2 58.9 4.7
227 5 3 -1 37.195 74.391 0.392 3.68 4 53.3 7.7
228 8 0 5 37.23 74.46 0.393 3.68 2 2.1 0.0
229 5 3 0 37.306 74.611 0.393 3.66 4 3.1 0.0
230 10 0 -3 37.364 74.727 0.394 3.65 2 3.8 0.0
231 9 1 -5 37.376 74.752 0.394 3.65 4 147.7 58.6
232 10 0 0 37.404 74.808 0.394 3.65 2 20.2 0.5
233 4 2 -8 37.478 74.956 0.395 3.63 4 385.6 397.7
234 8 2 1 37.491 74.981 0.395 3.63 4 230.2 141.7
235 5 3 -2 37.499 74.999 0.395 3.63 4 33.4 3.0
236 1 3 5 37.54 75.08 0.396 3.62 4 68.1 12.4
237 1 1 -10 37.595 75.19 0.396 3.61 4 22.5 1.3
238 6 2 5 37.72 75.439 0.397 3.59 4 30.0 2.4
239 7 1 -8 37.74 75.48 0.397 3.59 4 41.0 4.4
240 3 1 9 37.762 75.523 0.398 3.58 4 28.9 2.2
241 5 3 1 37.829 75.658 0.398 3.57 4 155.8 63.9
242 3 3 4 37.873 75.745 0.398 3.57 4 99.8 26.1
243 2 2 8 37.893 75.786 0.399 3.56 4 22.1 1.3
244 3 3 -5 38.022 76.044 0.4 3.54 4 28.9 2.2
245 4 0 9 38.05 76.1 0.4 3.54 2 0.6 0.0
246 8 2 -4 38.056 76.112 0.4 3.53 4 13.6 0.5
247 3 1 -10 38.077 76.153 0.4 3.53 4 407.8 432.3
248 6 2 -7 38.118 76.235 0.401 3.52 4 78.7 16.1
249 7 1 6 38.16 76.319 0.401 3.52 4 465.6 561.3
250 10 0 -4 38.175 76.351 0.401 3.52 2 349.7 158.2
251 4 2 7 38.177 76.354 0.401 3.52 4 70.8 13.0
252 5 3 -3 38.214 76.428 0.402 3.51 4 59.1 9.0
253 10 0 1 38.242 76.485 0.402 3.5 2 3.0 0.0
254 2 0 10 38.337 76.674 0.403 3.49 2 24.7 0.8
255 5 1 8 38.567 77.134 0.405 3.45 4 23.3 1.4
256 8 2 2 38.613 77.225 0.405 3.45 4 30.7 2.4
257 9 1 3 38.625 77.251 0.405 3.44 4 25.8 1.7
258 8 0 -8 38.697 77.394 0.406 3.43 2 334.4 141.4
259 5 3 2 38.76 77.52 0.406 3.42 4 296.0 221.0
260 1 1 10 38.855 77.709 0.407 3.41 4 482.8 585.2
261 9 1 -6 39.07 78.14 0.409 3.38 4 505.3 635.3
262 1 3 -6 39.106 78.212 0.409 3.37 4 285.8 202.9
263 2 2 -9 39.241 78.482 0.411 3.36 4 48.2 5.7
264 5 3 -4 39.332 78.665 0.411 3.34 4 13.9 0.5
265 10 0 -5 39.389 78.779 0.412 3.33 2 4.5 0.0
266 8 2 -5 39.396 78.792 0.412 3.33 4 17.1 0.7
267 10 0 2 39.482 78.964 0.413 3.32 2 178.3 38.9
268 0 2 9 39.503 79.005 0.413 3.32 4 8.6 0.2
269 6 0 8 39.654 79.309 0.414 3.3 2 10.4 0.1
270 1 3 6 39.855 79.709 0.416 3.27 4 19.1 0.9
271 3 3 5 39.901 79.801 0.416 3.27 4 127.2 38.9
272 8 0 6 39.986 79.972 0.417 3.26 2 10.1 0.1
273 2 0 -11 39.995 79.989 0.417 3.26 2 1.1 0.0
274 3 3 -6 40.08 80.16 0.418 3.24 4 37.9 3.4
275 5 3 3 40.09 80.18 0.418 3.24 4 181.4 78.5
276 8 2 3 40.131 80.261 0.418 3.24 4 14.0 0.5
277 6 0 -10 40.242 80.484 0.419 3.22 2 45.7 2.5
278 5 1 -10 40.281 80.561 0.42 3.22 4 7.9 0.1
279 6 2 6 40.342 80.684 0.42 3.21 4 85.9 17.5
280 0 0 11 40.503 81.006 0.422 3.19 2 0.2 0.0
281 9 1 4 40.61 81.22 0.423 3.18 4 32.1 2.4
282 4 2 -9 40.699 81.397 0.423 3.17 4 212.2 105.1
283 7 1 -9 40.769 81.538 0.424 3.16 4 102.1 24.3
284 6 2 -8 40.797 81.595 0.424 3.16 4 19.6 0.9
285 5 3 -5 40.846 81.693 0.425 3.15 4 152.5 54.0
286 10 0 -6 40.997 81.994 0.426 3.14 2 20.9 0.5
287 10 0 3 41.115 82.231 0.427 3.13 2 3.6 0.0
288 8 2 -6 41.127 82.254 0.427 3.12 4 25.4 1.5
289 9 1 -7 41.146 82.292 0.427 3.12 4 106.8 26.2
290 4 0 -11 41.199 82.398 0.428 3.12 2 1.7 0.0
291 7 1 7 41.239 82.478 0.428 3.11 4 150.0 51.6
292 4 2 8 41.473 82.947 0.43 3.09 4 393.8 352.6
293 2 2 9 41.475 82.95 0.43 3.09 4 17.6 0.7
294 8 0 -9 41.646 83.292 0.431 3.07 2 4.0 0.0
295 1 3 -7 41.676 83.351 0.432 3.07 4 165.5 61.9
296 1 1 -11 41.804 83.608 0.433 3.06 4 9.1 0.2
297 3 1 10 41.811 83.621 0.433 3.06 4 20.7 1.0
298 5 3 4 41.812 83.623 0.433 3.06 4 45.6 4.7
299 8 2 4 42.037 84.073 0.435 3.03 4 24.2 1.3
300 3 1 -11 42.15 84.3 0.436 3.02 4 52.5 6.1
301 4 0 10 42.153 84.307 0.436 3.02 2 157.4 27.6
302 7 3 -1 42.239 84.477 0.436 3.02 4 167.9 62.6
303 3 3 6 42.304 84.609 0.437 3.01 4 450.8 450.4
304 5 1 9 42.319 84.638 0.437 3.01 4 100.6 22.4
305 7 3 -2 42.41 84.82 0.438 3.0 4 478.9 506.8
306 7 3 0 42.468 84.937 0.438 3.0 4 75.2 12.5
307 3 3 -7 42.514 85.028 0.439 2.99 4 53.0 6.2
308 1 3 7 42.537 85.074 0.439 2.99 4 55.9 6.9
309 2 0 11 42.712 85.423 0.44 2.98 2 0.5 0.0
310 5 3 -6 42.75 85.5 0.441 2.97 4 492.4 530.7
311 2 2 -10 42.951 85.902 0.442 2.96 4 18.4 0.7
312 9 1 5 42.974 85.948 0.442 2.96 4 19.5 0.8
313 7 3 -3 42.982 85.964 0.443 2.96 4 123.6 33.2
314 10 0 -7 42.993 85.986 0.443 2.95 2 2.8 0.0
315 8 0 7 43.097 86.194 0.443 2.95 2 2.2 0.0
316 7 3 1 43.099 86.197 0.444 2.95 4 49.0 5.2
317 11 1 -2 43.134 86.269 0.444 2.94 4 454.3 447.3
318 10 0 4 43.136 86.273 0.444 2.94 2 443.4 213.0
319 1 1 11 43.156 86.312 0.444 2.94 4 156.4 53.0
320 11 1 -1 43.209 86.417 0.444 2.94 4 151.9 49.9
321 8 2 -7 43.245 86.49 0.445 2.94 4 50.1 5.4
322 6 2 7 43.325 86.651 0.445 2.93 4 42.1 3.8
323 0 2 10 43.331 86.661 0.445 2.93 4 51.3 5.7
324 6 0 9 43.447 86.895 0.446 2.92 2 1.6 0.0
325 11 1 -3 43.46 86.92 0.446 2.92 4 38.8 3.2
326 9 1 -8 43.602 87.205 0.448 2.91 4 52.3 5.9
327 11 1 0 43.683 87.366 0.448 2.9 4 115.3 28.4
328 6 2 -9 43.841 87.681 0.45 2.89 4 20.4 0.9
329 5 3 5 43.922 87.844 0.45 2.89 4 11.1 0.3
330 7 3 -4 43.953 87.906 0.451 2.89 4 80.8 13.9
331 10 2 -2 44.072 88.144 0.451 2.88 4 68.6 10.0
332 10 2 -1 44.085 88.17 0.452 2.88 4 17.7 0.7
333 6 0 -11 44.091 88.182 0.452 2.88 2 3.3 0.0
334 7 3 2 44.128 88.255 0.452 2.88 4 25.6 1.4
335 7 1 -10 44.151 88.302 0.452 2.88 4 481.4 490.4
336 11 1 -4 44.186 88.371 0.452 2.87 4 105.4 23.5
337 5 1 -11 44.19 88.381 0.452 2.87 4 18.8 0.7
338 4 2 -10 44.265 88.53 0.453 2.87 4 36.0 2.7
339 8 2 5 44.329 88.659 0.454 2.86 4 8.6 0.2
340 0 4 0 44.371 88.742 0.454 2.86 2 261.7 72.2
341 10 2 -3 44.458 88.917 0.455 2.86 4 35.6 2.7
342 2 0 -12 44.492 88.984 0.455 2.86 2 494.0 256.5
343 10 2 0 44.497 88.995 0.455 2.85 4 14.3 0.4
344 11 1 1 44.557 89.113 0.455 2.85 4 5.4 0.1
345 0 4 1 44.571 89.141 0.456 2.85 4 127.9 34.3
346 1 3 -8 44.618 89.236 0.456 2.85 4 71.2 10.6
347 7 1 8 44.674 89.349 0.456 2.85 4 115.8 28.1
348 8 0 -10 44.959 89.918 0.459 2.83 2 61.0 3.9
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 2 0 2 10.463 20.926 4.24166 182.6 1.8 1.8 5.6
2 1 1 2 12.965 25.93 3.43329 8846.0 86.1 86.5 5.6
3 4 0 0 14.062 28.124 3.17023 2660.2 25.9 26.0 5.6
4 2 0 -4 14.417 28.834 3.09376 2425.8 23.6 23.7 5.6
5 1 1 -3 14.469 28.937 3.08299 105.7 1.0 1.0 5.6
6 3 1 -1 14.66 29.32 3.04356 935.9 9.1 9.1 5.6
7 3 1 -2 15.488 30.975 2.88462 10269.4 100.0 100.0 5.6
8 2 0 4 16.333 32.667 2.73903 5346.2 52.1 52.0 5.6
9 3 1 -3 17.005 34.01 2.63383 513.5 5.0 5.0 5.7
10 1 1 -5 19.919 39.837 2.26097 151.6 1.5 1.5 5.7
11 0 2 0 20.466 40.932 2.203 1188.5 11.6 11.5 5.7
12 0 2 1 20.769 41.538 2.17225 659.6 6.4 6.4 5.7
13 5 1 2 22.58 45.16 2.00606 3256.0 31.7 31.3 5.7
14 1 1 -6 23.054 46.108 1.96703 3291.9 32.1 31.6 5.7
15 6 0 -4 23.809 47.618 1.9081 1884.6 18.4 18.1 5.7
16 5 1 3 24.366 48.732 1.86704 288.9 2.8 2.8 5.7
17 2 2 3 24.714 49.429 1.84237 186.3 1.8 1.8 5.7
18 4 2 0 25.2 50.4 1.80909 2201.7 21.4 21.0 5.8
19 2 2 -4 25.419 50.838 1.79453 2178.9 21.2 20.8 5.8
20 1 1 -7 26.393 52.785 1.73283 217.7 2.1 2.1 5.8
21 2 2 4 26.661 53.322 1.71665 1140.9 11.1 10.9 5.8
22 3 1 6 27.17 54.34 1.68689 1242.6 12.1 11.8 5.8
23 7 1 -2 27.299 54.598 1.6795 1173.7 11.4 11.1 5.8
24 6 0 4 27.573 55.146 1.66411 524.2 5.1 5.0 5.8
25 5 1 -6 27.712 55.425 1.6564 1054.1 10.3 10.0 5.8
26 0 0 8 28.187 56.374 1.63072 460.4 4.5 4.4 5.8
27 2 2 5 28.988 57.975 1.58945 306.1 3.0 2.9 5.8
28 8 0 0 29.074 58.149 1.58511 877.4 8.5 8.3 5.8
29 4 0 -8 29.865 59.73 1.54688 925.8 9.0 8.7 5.8
30 6 2 -3 31.127 62.255 1.49007 256.7 2.5 2.4 5.8
31 6 2 -4 32.28 64.56 1.44231 590.2 5.7 5.5 5.9
32 1 3 2 32.888 65.776 1.41857 1070.6 10.4 10.0 5.9
33 3 3 -1 33.744 67.488 1.38668 127.3 1.2 1.2 5.9
34 6 2 -5 33.845 67.689 1.38305 112.3 1.1 1.0 5.9
35 3 3 -2 34.193 68.385 1.37067 267.8 2.6 2.5 5.9
36 4 0 8 34.225 68.451 1.36951 454.8 4.4 4.2 5.9
37 6 2 4 35.457 70.915 1.32785 680.4 6.6 6.3 5.9
38 0 2 8 35.993 71.986 1.3107 684.2 6.7 6.3 5.9
39 8 2 0 36.774 73.549 1.28666 420.3 4.1 3.9 6.0
40 9 1 2 37.026 74.051 1.27917 487.6 4.7 4.5 6.0
41 4 2 -8 37.478 74.956 1.26596 542.4 5.3 5.0 6.0
42 3 1 -10 38.077 76.153 1.249 432.3 4.2 4.0 6.0
43 7 1 6 38.16 76.319 1.2467 732.5 7.1 6.7 6.0
44 8 0 -8 38.697 77.394 1.23205 141.4 1.4 1.3 6.0
45 5 3 2 38.76 77.52 1.23037 221.0 2.2 2.0 6.0
46 1 1 10 38.855 77.709 1.22784 585.2 5.7 5.3 6.0
47 9 1 -6 39.07 78.14 1.22215 635.3 6.2 5.8 6.0
48 1 3 -6 39.106 78.212 1.22119 202.9 2.0 1.9 6.0
49 4 2 -9 40.699 81.397 1.18127 105.1 1.0 1.0 6.1
50 4 2 8 41.473 82.947 1.16309 353.3 3.4 3.2 6.1
51 3 3 6 42.304 84.609 1.14443 472.9 4.6 4.2 6.1
52 7 3 -2 42.41 84.82 1.14212 506.8 4.9 4.6 6.1
53 5 3 -6 42.75 85.5 1.13477 530.7 5.2 4.8 6.1
54 11 1 -2 43.134 86.269 1.12662 713.2 6.9 6.4 6.1
55 7 1 -10 44.151 88.302 1.10585 491.8 4.8 4.4 6.2
56 2 0 -12 44.492 88.984 1.09913 256.9 2.5 2.3 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)
|