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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ANGELELLITE
1
Fe'''(4)O(3)[AsO(4)](2)
Triclinic P 1(-) Z = 1
R =0.076 NR =1620
10 .6 .1994
Ref.Str.:
Moore P.B., Araki T. (1978)
* Neues Jb. Miner., Abh., 132, 91-100
Reserv:
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 6.461 alpha = 106.21
b = 6.594 beta = 98.35
c = 5.036 gamma = 108.86
Unit cell volume (cub. angs.) = 188.3
Molar volume ( cub.cm/mol.) = 113.42
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.7555 0.0288 0.0974 0.0 Fe = 1.00
2 0.3742 0.7483 0.3453 0.0 Fe = 1.00
3 0.8166 0.6078 0.3367 0.0 As = 1.00
4 0.6569 0.7362 0.2109 0.0 O = 1.00
5 0.0911 0.7898 0.4633 0.0 O = 1.00
6 0.725 0.5429 0.6065 0.0 O = 1.00
7 0.7939 0.3705 0.0744 0.0 O = 1.00
8 0.0 0.0 0.0 0.0 O = 1.00
9 0.4707 0.0454 0.262 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.7555 0.0288 0.0974
2 2 0.3742 0.7483 0.3453
3 3 0.8166 0.6078 0.3367
4 4 0.6569 0.7362 0.2109
5 5 0.0911 0.7898 0.4633
6 6 0.725 0.5429 0.6065
7 7 0.7939 0.3705 0.0744
8 8 0.0 0.0 0.0
9 9 0.4707 0.0454 0.262
10 1 0.2445 0.9712 0.9026
11 2 0.6258 0.2517 0.6547
12 3 0.1834 0.3922 0.6633
13 4 0.3431 0.2638 0.7891
14 5 0.9089 0.2102 0.5367
15 6 0.275 0.4571 0.3935
16 7 0.2061 0.6295 0.9256
17 9 0.5293 0.9546 0.738
X-ray density (g/cm cub.) = 4.84
MU (1/cm) = 300.677 Mass attenuation coefficient (cm**2/g) = 62.102
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Fe 2.592 6
2.0933 4
2.2236 7
1.7718 8
2.1465 9
2.104 5
1.9815 9
2 Fe 2.592 6
2.0552 4
2.079 5
2.0366 9
1.9148 6
2.0296 7
1.9511 9
3 As 2.46 4
1.6904 4
1.6913 5
1.6655 6
1.69 7
4 O 3.264 12
2.7718 5
2.7043 6
3.1094 6
2.7753 7
2.8793 8
2.6558 9
3.0492 4
2.8606 5
2.9982 6
2.8174 7
3.0114 9
3.2462 9
5 O 3.264 11
2.7718 4
2.7252 6
2.7603 7
2.9105 8
3.1057 8
2.9811 9
2.8606 4
2.7792 6
2.9101 7
2.9148 7
2.6729 9
6 O 3.264 11
3.1094 4
2.7043 4
2.7252 5
2.9259 7
2.7648 7
2.8895 8
2.9968 9
2.9982 4
2.7792 5
2.7597 6
3.0757 7
7 O 3.264 12
2.7753 4
2.7603 5
2.7648 6
2.9259 6
3.1015 8
2.9425 9
2.8174 4
2.9101 5
2.9148 5
3.0757 6
2.9874 7
2.6168 9
8 O 3.264 12
2.8793 4
3.1057 5
2.9105 5
2.8895 6
3.1015 7
3.0174 9
2.8793 4
2.9105 5
3.1057 5
2.8895 6
3.1015 7
3.0174 9
9 O 3.264 11
2.6558 4
2.9811 5
2.9968 6
2.9425 7
3.0174 8
3.0114 4
3.2462 4
2.6729 5
2.6168 7
2.6329 9
2.6495 9
X-ray diffraction powder data (II), X-Ray W.L. = 1.78892(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 1 0 0 8.712 17.424 0.085 84.24 2 8.3 32.8
2 0 1 0 8.796 17.592 0.085 82.59 2 1.8 1.5
3 -1 1 0 9.734 19.469 0.095 67.04 2 29.3 323.7
4 0 0 1 11.041 22.082 0.107 51.64 2 22.2 143.2
5 0 -1 1 11.487 22.974 0.111 47.54 2 5.3 7.6
6 -1 0 1 12.19 24.38 0.118 41.98 2 43.5 448.2
7 1 -1 1 14.166 28.333 0.137 30.56 2 10.2 17.8
8 1 1 0 14.662 29.323 0.141 28.4 2 11.7 21.8
9 -1 -1 1 14.806 29.613 0.143 27.81 2 43.6 298.5
10 -1 1 1 15.412 30.825 0.149 25.52 2 1.4 0.3
11 1 0 1 15.856 31.712 0.153 24.0 2 54.1 395.7
12 -2 1 0 16.396 32.792 0.158 22.33 2 64.0 515.3
13 0 1 1 16.478 32.957 0.159 22.09 2 127.6 2029.0
14 -1 2 0 16.535 33.071 0.159 21.92 2 34.5 147.0
15 0 -2 1 17.399 34.797 0.167 19.62 2 107.6 1280.6
16 2 0 0 17.634 35.268 0.169 19.06 2 83.6 751.5
17 1 -2 1 17.648 35.296 0.169 19.02 2 79.5 678.3
18 0 2 0 17.809 35.617 0.171 18.65 2 12.5 16.4
19 -2 0 1 18.28 36.559 0.175 17.61 2 83.0 683.8
20 -2 1 1 19.064 38.129 0.183 16.05 2 70.0 443.1
21 -2 2 0 19.765 39.53 0.189 14.82 2 77.2 498.2
22 2 -1 1 20.793 41.586 0.198 13.24 2 84.7 535.3
23 0 -1 2 21.073 42.147 0.201 12.85 2 99.5 717.9
24 -1 -2 1 21.372 42.743 0.204 12.45 2 58.2 237.8
25 1 1 1 21.655 43.31 0.206 12.08 2 4.9 1.7
26 -2 -1 1 21.711 43.421 0.207 12.02 2 27.3 50.4
27 -1 0 2 21.938 43.876 0.209 11.74 2 15.6 16.2
28 -1 -1 2 21.965 43.929 0.209 11.71 2 10.1 6.8
29 2 -2 1 21.997 43.994 0.209 11.67 2 13.9 12.7
30 -1 2 1 22.256 44.511 0.212 11.36 2 19.0 23.0
31 0 0 2 22.521 45.041 0.214 11.06 2 21.0 27.5
32 2 1 0 22.837 45.674 0.217 10.72 2 16.1 15.7
33 1 2 0 22.943 45.886 0.218 10.61 2 83.1 412.8
34 2 0 1 23.462 46.923 0.223 10.09 2 47.8 129.8
35 0 -2 2 23.472 46.943 0.223 10.08 2 12.4 8.8
36 -2 2 1 23.716 47.431 0.225 9.84 2 50.3 140.5
37 1 -1 2 23.932 47.864 0.227 9.64 2 48.7 128.8
38 1 -3 1 24.403 48.806 0.231 9.22 2 65.0 219.7
39 0 2 1 24.427 48.854 0.231 9.2 2 0.2 0.0
40 1 -2 2 24.817 49.634 0.235 8.88 2 7.3 2.7
41 -3 1 0 24.853 49.707 0.235 8.85 2 3.9 0.8
42 -2 0 2 24.98 49.96 0.236 8.75 2 63.4 198.4
43 -1 3 0 25.118 50.236 0.237 8.64 2 50.0 121.6
44 0 -3 1 25.544 51.087 0.241 8.31 2 67.6 214.3
45 -1 1 2 25.55 51.101 0.241 8.31 2 46.2 99.9
46 -1 -2 2 25.622 51.243 0.242 8.26 2 46.7 101.7
47 -3 1 1 25.742 51.483 0.243 8.17 2 62.0 177.1
48 -3 2 0 26.103 52.206 0.246 7.91 2 22.1 21.7
49 -2 3 0 26.263 52.526 0.247 7.8 2 37.6 62.3
50 -2 -1 2 26.306 52.613 0.248 7.77 2 49.2 106.3
51 -3 0 1 26.426 52.852 0.249 7.69 2 63.7 176.1
52 1 0 2 26.544 53.088 0.25 7.62 2 70.4 212.7
53 2 -3 1 26.661 53.321 0.251 7.54 2 4.9 1.0
54 3 0 0 27.027 54.053 0.254 7.31 2 21.8 19.6
55 -2 1 2 27.066 54.133 0.254 7.29 2 51.2 107.8
56 0 3 0 27.307 54.614 0.256 7.14 2 61.3 151.5
57 0 1 2 27.337 54.674 0.257 7.12 2 46.7 87.7
58 -2 -2 1 28.115 56.23 0.263 6.68 2 51.2 98.6
59 -3 2 1 28.383 56.765 0.266 6.54 2 53.2 104.5
60 1 -3 2 28.967 57.934 0.271 6.25 2 26.6 25.0
61 3 -2 1 28.968 57.935 0.271 6.25 2 25.8 23.4
62 0 -3 2 28.981 57.962 0.271 6.24 2 14.3 7.2
63 2 1 1 29.184 58.368 0.273 6.14 2 48.2 80.5
64 3 -1 1 29.201 58.402 0.273 6.13 2 2.5 0.2
65 2 -2 2 29.306 58.612 0.274 6.08 2 41.3 58.5
66 1 2 1 29.632 59.265 0.276 5.94 2 0.1 0.0
67 2 -1 2 29.715 59.431 0.277 5.9 2 40.7 55.1
68 -1 -3 1 29.805 59.61 0.278 5.86 2 14.4 6.9
69 -3 -1 1 30.281 60.562 0.282 5.65 2 37.2 44.0
70 2 2 0 30.412 60.825 0.283 5.6 2 0.4 0.0
71 -3 3 0 30.48 60.96 0.284 5.57 2 8.2 2.1
72 -2 -2 2 30.738 61.475 0.286 5.47 2 41.3 52.6
73 -3 0 2 30.852 61.704 0.287 5.42 2 14.3 6.3
74 -1 3 1 30.855 61.709 0.287 5.42 2 52.3 83.7
75 -2 3 1 30.892 61.784 0.287 5.41 2 50.3 77.0
76 -3 1 2 31.561 63.122 0.293 5.16 2 43.8 55.8
77 3 -3 1 31.812 63.624 0.295 5.07 2 43.3 53.6
78 -1 2 2 31.899 63.799 0.295 5.04 2 22.6 14.5
79 2 -3 2 31.963 63.925 0.296 5.02 2 64.9 119.1
80 -1 -3 2 32.002 64.005 0.296 5.01 2 55.8 88.0
81 1 1 2 32.052 64.104 0.297 4.99 2 90.7 231.5
82 -2 2 2 32.109 64.217 0.297 4.97 2 43.2 52.2
83 3 1 0 32.144 64.289 0.297 4.96 2 56.4 89.1
84 1 3 0 32.369 64.737 0.299 4.88 2 38.3 40.4
85 -1 -1 3 32.446 64.893 0.3 4.86 2 48.5 64.5
86 3 0 1 32.472 64.945 0.3 4.85 2 47.6 62.1
87 0 -1 3 32.725 65.451 0.302 4.77 2 40.7 44.5
88 1 -4 1 32.976 65.951 0.304 4.69 2 20.0 10.6
89 2 0 2 33.123 66.247 0.305 4.65 2 58.7 90.4
90 -3 -1 2 33.135 66.27 0.306 4.64 2 7.5 1.5
91 0 -2 3 33.287 66.574 0.307 4.6 2 16.7 7.2
92 -1 0 3 33.704 67.408 0.31 4.48 2 28.1 19.9
93 0 3 1 33.73 67.459 0.31 4.47 2 8.0 1.6
94 2 -4 1 33.78 67.561 0.311 4.46 2 43.5 47.6
95 -3 3 1 33.837 67.675 0.311 4.44 2 7.8 1.5
96 -1 -2 3 34.114 68.227 0.314 4.37 2 29.1 20.9
97 -4 1 1 34.232 68.464 0.314 4.34 2 21.6 11.5
98 -4 2 0 34.371 68.741 0.316 4.3 2 114.4 317.4
99 -4 1 0 34.42 68.84 0.316 4.29 2 12.8 4.0
100 0 2 2 34.563 69.125 0.317 4.25 2 46.0 50.9
101 -2 4 0 34.696 69.391 0.318 4.22 2 0.0 0.0
102 -1 4 0 34.826 69.651 0.319 4.19 2 80.5 153.1
103 0 -4 1 35.014 70.028 0.321 4.14 2 43.1 43.5
104 -2 -1 3 35.02 70.039 0.321 4.14 2 29.8 20.7
105 0 0 3 35.066 70.132 0.321 4.13 2 66.0 101.5
106 -2 0 3 35.162 70.324 0.322 4.11 2 36.1 30.3
107 -3 2 2 35.165 70.329 0.322 4.11 2 32.0 23.8
108 1 -2 3 35.291 70.583 0.323 4.08 2 34.1 26.7
109 -4 2 1 35.429 70.859 0.324 4.04 2 9.0 1.9
110 1 -4 2 35.651 71.301 0.326 4.0 2 95.8 206.8
111 1 -1 3 35.823 71.647 0.327 3.96 2 22.1 10.9
112 -4 0 1 35.887 71.775 0.328 3.94 2 88.2 173.0
113 3 -2 2 36.204 72.408 0.33 3.88 2 6.0 0.8
114 -2 -3 1 36.515 73.03 0.333 3.81 2 21.0 9.5
115 0 -3 3 36.687 73.374 0.334 3.78 2 41.8 37.2
116 -3 -2 1 36.704 73.408 0.334 3.78 2 18.6 7.4
117 0 -4 2 36.729 73.459 0.334 3.77 2 16.1 5.5
118 2 2 1 37.096 74.193 0.337 3.7 2 16.4 5.6
119 -4 3 0 37.149 74.297 0.338 3.69 2 2.0 0.1
120 4 0 0 37.291 74.583 0.339 3.67 2 3.6 0.3
121 2 -4 2 37.325 74.65 0.339 3.66 2 21.6 9.7
122 -3 4 0 37.332 74.665 0.339 3.66 2 112.3 260.4
123 3 -4 1 37.343 74.685 0.339 3.66 2 64.7 86.4
124 1 -3 3 37.569 75.139 0.341 3.62 2 121.5 301.1
125 3 -3 2 37.571 75.142 0.341 3.62 2 57.0 66.2
126 3 -1 2 37.628 75.256 0.341 3.61 2 35.5 25.7
127 -2 -3 2 37.633 75.265 0.341 3.61 2 31.0 19.6
128 -2 -2 3 37.687 75.373 0.342 3.6 2 32.4 21.4
129 0 4 0 37.711 75.421 0.342 3.59 2 28.6 16.5
130 4 -2 1 37.744 75.489 0.342 3.59 2 29.2 17.3
131 -1 1 3 37.747 75.495 0.342 3.59 2 39.9 32.3
132 -2 1 3 38.101 76.203 0.345 3.53 2 119.7 285.0
133 -3 -2 2 38.137 76.273 0.345 3.52 2 129.1 331.2
134 3 1 1 38.366 76.733 0.347 3.48 2 49.6 48.3
135 -4 1 2 38.454 76.909 0.348 3.47 2 70.2 96.6
136 -1 -3 3 38.528 77.055 0.348 3.46 2 80.8 127.4
137 -4 0 2 38.852 77.704 0.351 3.41 2 11.9 2.7
138 4 -1 1 38.992 77.985 0.352 3.39 2 126.3 305.0
139 1 0 3 39.121 78.243 0.353 3.37 2 17.8 6.0
140 2 1 2 39.13 78.26 0.353 3.37 2 47.6 43.0
141 1 3 1 39.204 78.407 0.353 3.36 2 133.3 336.7
142 4 -3 1 39.248 78.496 0.354 3.35 2 21.0 8.3
143 -3 0 3 39.305 78.611 0.354 3.35 2 16.1 4.9
144 -4 3 1 39.373 78.746 0.355 3.34 2 69.1 89.8
145 -2 3 2 39.51 79.02 0.356 3.32 2 38.9 28.3
146 3 2 0 39.608 79.216 0.356 3.31 2 58.1 62.9
147 -1 -4 1 39.704 79.407 0.357 3.29 2 64.5 77.3
148 2 3 0 39.737 79.474 0.357 3.29 2 34.9 22.6
149 1 2 2 39.834 79.668 0.358 3.28 2 8.2 1.2
150 -2 4 1 39.944 79.888 0.359 3.26 2 9.0 1.5
151 2 -2 3 39.945 79.889 0.359 3.26 2 37.5 25.9
152 0 1 3 40.086 80.173 0.36 3.24 2 42.4 32.9
153 -3 -1 3 40.203 80.406 0.361 3.23 2 86.8 137.1
154 -4 -1 1 40.255 80.51 0.361 3.22 2 10.3 1.9
155 -1 3 2 40.351 80.702 0.362 3.21 2 61.9 69.3
156 -1 -4 2 40.482 80.965 0.363 3.2 2 53.9 52.3
157 -4 2 2 40.788 81.575 0.365 3.16 2 37.7 25.4
158 -1 4 1 40.94 81.88 0.366 3.14 2 43.3 33.3
159 2 -3 3 41.119 82.238 0.368 3.13 2 24.1 10.3
160 -3 1 3 41.128 82.257 0.368 3.12 2 34.4 20.8
161 -3 3 2 41.334 82.669 0.369 3.1 2 87.8 134.9
162 2 -1 3 41.482 82.964 0.37 3.09 2 69.6 84.4
163 -3 4 1 41.608 83.217 0.371 3.08 2 23.0 9.1
164 3 -4 2 41.638 83.277 0.371 3.07 2 7.6 1.0
165 3 0 2 41.749 83.498 0.372 3.06 2 7.1 0.9
166 -4 -1 2 41.961 83.922 0.374 3.04 2 3.5 0.2
167 1 -4 3 42.505 85.01 0.378 2.99 2 39.2 25.9
168 -4 4 0 42.557 85.114 0.378 2.99 2 13.3 3.0
169 0 -4 3 42.673 85.345 0.379 2.98 2 2.9 0.1
170 4 1 0 42.787 85.574 0.38 2.97 2 53.1 47.2
171 2 -5 1 42.92 85.84 0.381 2.96 2 1.4 0.0
172 4 0 1 42.929 85.858 0.381 2.96 2 11.4 2.2
173 -2 -3 3 42.99 85.979 0.381 2.95 2 17.2 5.0
174 1 4 0 43.168 86.335 0.382 2.94 2 0.6 0.0
175 1 -5 1 43.198 86.395 0.383 2.94 2 47.4 37.2
176 4 -4 1 43.43 86.861 0.384 2.92 2 72.8 87.3
177 -2 2 3 43.661 87.321 0.386 2.91 2 11.1 2.0
178 -3 -2 3 43.787 87.574 0.387 2.9 2 22.0 7.9
179 0 3 2 43.828 87.657 0.387 2.9 2 22.9 8.6
180 -1 2 3 44.334 88.668 0.391 2.86 2 39.5 25.2
181 -5 2 0 44.411 88.821 0.391 2.86 2 5.9 0.6
182 -5 1 1 44.436 88.873 0.391 2.86 2 9.6 1.5
183 1 -5 2 44.52 89.04 0.392 2.85 2 30.2 14.6
184 -5 2 1 44.543 89.086 0.392 2.85 2 23.6 8.9
185 0 4 1 44.566 89.131 0.392 2.85 2 12.2 2.4
186 -2 5 0 44.942 89.884 0.395 2.83 2 26.7 11.4
187 2 -4 3 44.97 89.941 0.395 2.83 2 6.1 0.6
X-ray diffraction powder data (I)...X-Ray wave length = 1.78892 (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 0 0 8.712 17.424 5.90529 32.8 1.6 1.6 5.6
2 -1 1 0 9.734 19.469 5.29015 323.7 16.0 16.1 5.6
3 0 0 1 11.041 22.082 4.67063 143.2 7.1 7.1 5.6
4 -1 0 1 12.19 24.38 4.23611 448.2 22.1 22.2 5.6
5 1 1 0 14.662 29.323 3.53387 21.8 1.1 1.1 5.6
6 -1 -1 1 14.806 29.613 3.50009 298.5 14.7 14.8 5.6
7 1 0 1 15.856 31.712 3.27375 395.7 19.5 19.5 5.6
8 -2 1 0 16.396 32.792 3.1688 515.3 25.4 25.4 5.6
9 0 1 1 16.478 32.957 3.15336 2029.0 100.0 100.0 5.6
10 -1 2 0 16.535 33.071 3.14277 147.0 7.2 7.2 5.6
11 0 -2 1 17.399 34.797 2.99132 1280.6 63.1 63.0 5.7
12 2 0 0 17.634 35.268 2.95265 1429.8 70.5 70.3 5.7
13 -2 0 1 18.28 36.559 2.85173 683.8 33.7 33.6 5.7
14 -2 1 1 19.064 38.129 2.73846 443.1 21.8 21.7 5.7
15 -2 2 0 19.765 39.53 2.64508 498.2 24.6 24.4 5.7
16 2 -1 1 20.793 41.586 2.51968 535.3 26.4 26.2 5.7
17 0 -1 2 21.073 42.147 2.48764 717.9 35.4 35.1 5.7
18 -1 -2 1 21.372 42.743 2.45451 237.8 11.7 11.6 5.7
19 -2 -1 1 21.711 43.421 2.41798 50.4 2.5 2.5 5.7
20 -1 0 2 21.938 43.876 2.39416 23.0 1.1 1.1 5.7
21 -1 2 1 22.256 44.511 2.36167 23.0 1.1 1.1 5.7
22 0 0 2 22.521 45.041 2.33531 27.5 1.4 1.3 5.7
23 1 2 0 22.943 45.886 2.29458 412.8 20.3 20.1 5.7
24 2 0 1 23.462 46.923 2.24663 138.6 6.8 6.7 5.7
25 -2 2 1 23.716 47.431 2.22394 140.5 6.9 6.8 5.7
26 1 -1 2 23.932 47.864 2.20499 128.8 6.3 6.3 5.7
27 1 -3 1 24.403 48.806 2.16498 219.7 10.8 10.7 5.7
28 -2 0 2 24.98 49.96 2.11805 198.4 9.8 9.6 5.7
29 -1 3 0 25.118 50.236 2.10719 121.6 6.0 5.9 5.8
30 0 -3 1 25.544 51.087 2.07435 314.1 15.5 15.2 5.8
31 -1 -2 2 25.622 51.243 2.06847 101.7 5.0 4.9 5.8
32 -3 1 1 25.742 51.483 2.05948 177.1 8.7 8.6 5.8
33 -3 2 0 26.103 52.206 2.03293 21.7 1.1 1.1 5.8
34 -2 3 0 26.263 52.526 2.02143 62.3 3.1 3.0 5.8
35 -2 -1 2 26.306 52.613 2.01832 106.3 5.2 5.1 5.8
36 -3 0 1 26.426 52.852 2.00985 176.1 8.7 8.5 5.8
37 1 0 2 26.544 53.088 2.00153 212.7 10.5 10.3 5.8
38 -2 1 2 27.066 54.133 1.96575 107.8 5.3 5.2 5.8
39 0 3 0 27.307 54.614 1.94975 151.5 7.5 7.3 5.8
40 0 1 2 27.337 54.674 1.94778 87.7 4.3 4.2 5.8
41 -2 -2 1 28.115 56.23 1.89809 98.6 4.9 4.7 5.8
42 -3 2 1 28.383 56.765 1.88166 104.5 5.2 5.0 5.8
43 1 -3 2 28.967 57.934 1.84689 55.6 2.7 2.7 5.8
44 2 1 1 29.184 58.368 1.83435 80.7 4.0 3.9 5.8
45 2 -2 2 29.306 58.612 1.82739 58.5 2.9 2.8 5.8
46 2 -1 2 29.715 59.431 1.80447 55.1 2.7 2.6 5.8
47 -3 -1 1 30.281 60.562 1.77388 44.0 2.2 2.1 5.8
48 -2 -2 2 30.738 61.475 1.75004 52.6 2.6 2.5 5.8
49 -1 3 1 30.855 61.709 1.74406 90.0 4.4 4.3 5.8
50 -2 3 1 30.892 61.784 1.74214 77.0 3.8 3.7 5.8
51 -3 1 2 31.561 63.122 1.70892 55.8 2.7 2.7 5.9
52 3 -3 1 31.812 63.624 1.69685 53.6 2.6 2.5 5.9
53 2 -3 2 31.963 63.925 1.68968 119.1 5.9 5.7 5.9
54 -1 -3 2 32.002 64.005 1.68781 88.0 4.3 4.2 5.9
55 1 1 2 32.052 64.104 1.68547 231.5 11.4 11.0 5.9
56 -2 2 2 32.109 64.217 1.68281 52.2 2.6 2.5 5.9
57 3 1 0 32.144 64.289 1.68115 89.1 4.4 4.2 5.9
58 1 3 0 32.369 64.737 1.67075 40.4 2.0 1.9 5.9
59 -1 -1 3 32.446 64.893 1.66718 126.7 6.2 6.0 5.9
60 0 -1 3 32.725 65.451 1.65453 44.5 2.2 2.1 5.9
61 2 0 2 33.123 66.247 1.63688 91.9 4.5 4.3 5.9
62 -1 0 3 33.704 67.408 1.61191 21.5 1.1 1.0 5.9
63 2 -4 1 33.78 67.561 1.60871 47.6 2.3 2.2 5.9
64 -1 -2 3 34.114 68.227 1.59487 20.9 1.0 1.0 5.9
65 -4 2 0 34.371 68.741 1.5844 317.4 15.6 15.0 5.9
66 0 2 2 34.563 69.125 1.57668 50.9 2.5 2.4 5.9
67 -1 4 0 34.826 69.651 1.56626 153.1 7.5 7.2 5.9
68 0 -4 1 35.014 70.028 1.55889 64.2 3.2 3.0 5.9
69 0 0 3 35.066 70.132 1.55688 101.5 5.0 4.8 5.9
70 -2 0 3 35.162 70.324 1.55318 54.0 2.7 2.5 5.9
71 1 -2 3 35.291 70.583 1.54822 26.7 1.3 1.3 5.9
72 1 -4 2 35.651 71.301 1.53466 206.8 10.2 9.7 5.9
73 -4 0 1 35.887 71.775 1.52588 173.0 8.5 8.1 5.9
74 0 -3 3 36.687 73.374 1.49715 44.6 2.2 2.1 6.0
75 3 -4 1 37.343 74.685 1.47459 356.5 17.6 16.6 6.0
76 1 -3 3 37.569 75.139 1.467 367.3 18.1 17.1 6.0
77 3 -1 2 37.628 75.256 1.46505 45.3 2.2 2.1 6.0
78 -2 -2 3 37.687 75.373 1.4631 37.9 1.9 1.8 6.0
79 -1 1 3 37.747 75.495 1.4611 49.5 2.4 2.3 6.0
80 -2 1 3 38.101 76.203 1.44956 285.0 14.0 13.2 6.0
81 -3 -2 2 38.137 76.273 1.44843 331.2 16.3 15.4 6.0
82 3 1 1 38.366 76.733 1.44108 48.3 2.4 2.2 6.0
83 -4 1 2 38.454 76.909 1.43829 96.6 4.8 4.5 6.0
84 -1 -3 3 38.528 77.055 1.43598 127.4 6.3 5.9 6.0
85 4 -1 1 38.992 77.985 1.42154 305.0 15.0 14.1 6.0
86 2 1 2 39.13 78.26 1.41735 49.0 2.4 2.3 6.0
87 1 3 1 39.204 78.407 1.41511 336.7 16.6 15.6 6.0
88 -4 3 1 39.373 78.746 1.41001 89.8 4.4 4.1 6.0
89 -2 3 2 39.51 79.02 1.40592 28.3 1.4 1.3 6.0
90 3 2 0 39.608 79.216 1.403 62.9 3.1 2.9 6.0
91 -1 -4 1 39.704 79.407 1.40019 77.3 3.8 3.6 6.0
92 2 3 0 39.737 79.474 1.39921 22.6 1.1 1.0 6.0
93 2 -2 3 39.945 79.889 1.39313 27.4 1.4 1.3 6.0
94 0 1 3 40.086 80.173 1.38904 32.9 1.6 1.5 6.0
95 -3 -1 3 40.203 80.406 1.3857 137.1 6.8 6.3 6.0
96 -1 3 2 40.351 80.702 1.38147 69.3 3.4 3.2 6.1
97 -1 -4 2 40.482 80.965 1.37776 52.3 2.6 2.4 6.1
98 -4 2 2 40.788 81.575 1.36923 25.4 1.3 1.2 6.1
99 -1 4 1 40.94 81.88 1.36503 33.3 1.6 1.5 6.1
100 -3 1 3 41.128 82.257 1.35988 31.1 1.5 1.4 6.1
101 -3 3 2 41.334 82.669 1.35432 134.9 6.7 6.2 6.1
102 2 -1 3 41.482 82.964 1.35037 84.4 4.2 3.9 6.1
103 1 -4 3 42.505 85.01 1.32384 25.9 1.3 1.2 6.1
104 4 1 0 42.787 85.574 1.31678 47.2 2.3 2.1 6.1
105 1 -5 1 43.198 86.395 1.30671 37.2 1.8 1.7 6.1
106 4 -4 1 43.43 86.861 1.30109 87.3 4.3 4.0 6.1
107 -1 2 3 44.334 88.668 1.27992 25.2 1.2 1.1 6.2
108 1 -5 2 44.52 89.04 1.27569 23.6 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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