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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HELMUTWINKLERITE
1, f-arsenbrackebuschite
PbZn(2)[AsO(4)](2)[OH,H(2)O](2)
Triclinic P 1(-) Z = 1
R =0.029 NR =662
20 .10 .1998
Ref.Str.:
Krause W., Belendorff K., Effenberger H. et al. (1998)
* Eur. J. Mineral., 10, 179-206
Reserv:
N.A.D
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.606 alpha = 70.19
b = 5.61 beta = 69.91
c = 7.617 gamma = 69.18
Unit cell volume (cub. angs.) = 203.77
Molar volume ( cub.cm/mol.) = 122.74
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 2.72 Pb = 1.00
2 0.0 0.5 0.5 1.82 Zn = 1.00
3 0.5 0.0 0.5 1.84 Zn = 1.00
4 0.421 0.4232 0.7776 1.74 As = 1.00
5 0.1554 0.1572 0.4059 3.1 O = 1.00
6 0.3131 0.3093 0.6509 1.89 O = 1.00
7 0.2495 0.6831 0.2581 2.56 O = 1.00
8 0.6842 0.2471 0.261 2.42 O = 1.00
9 0.2786 0.2874 0.0085 5.03 O = 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 0.0 0.5 0.5
3 3 0.5 0.0 0.5
4 4 0.421 0.4232 0.7776
5 5 0.1554 0.1572 0.4059
6 6 0.3131 0.3093 0.6509
7 7 0.2495 0.6831 0.2581
8 8 0.6842 0.2471 0.261
9 9 0.2786 0.2874 0.0085
10 4 0.579 0.5768 0.2224
11 5 0.8446 0.8428 0.5941
12 6 0.6869 0.6907 0.3491
13 7 0.7505 0.3169 0.7419
14 8 0.3158 0.7529 0.739
15 9 0.7214 0.7126 0.9915
X-ray density (g/cm cub.) = 5.28
MU (1/cm) = 743.218 Mass attenuation coefficient (cm**2/g) = 140.836
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Pb 3.144 8
2.999 6
2.5951 7
2.5911 8
2.6407 9
2.999 6
2.5951 7
2.5911 8
2.6407 9
2 Zn 2.628 6
2.0701 5
2.1827 6
2.0915 7
2.0701 5
2.1827 6
2.0915 7
3 Zn 2.628 6
2.0821 5
2.1591 6
2.0779 8
2.0821 5
2.1591 6
2.0779 8
4 As 2.46 4
1.6731 6
1.6943 9
1.6803 7
1.6824 8
5 O 3.264 11
2.7823 6
2.9491 7
3.0404 7
2.9493 8
3.0214 8
2.7563 9
2.6375 5
3.202 6
3.2184 6
2.9364 7
2.9338 8
6 O 3.264 10
2.7823 5
3.07 7
3.0351 8
2.6268 9
3.202 5
3.2184 5
2.7851 7
2.9753 7
2.7945 8
2.9576 8
7 O 3.264 8
3.0404 5
2.9491 5
3.07 6
2.7722 8
2.9364 5
2.7851 6
2.9753 6
2.7464 9
8 O 3.264 8
3.0214 5
2.9493 5
3.0351 6
2.7722 7
2.9338 5
2.7945 6
2.9576 6
2.7453 9
9 O 3.264 5
2.7563 5
2.6268 6
2.7464 7
2.7453 8
3.1993 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 0 0 1 7.414 14.828 0.072 117.17 2 23.9 323.1
2 0 1 0 10.139 20.277 0.098 61.63 2 16.3 79.2
3 1 0 0 10.164 20.329 0.099 61.31 2 17.2 87.1
4 1 0 1 10.974 21.949 0.106 52.29 2 90.6 2066.2
5 0 1 1 11.001 22.003 0.107 52.02 2 88.9 1979.0
6 1 1 1 11.42 22.839 0.111 48.13 2 79.1 1450.5
7 1 1 0 12.292 24.584 0.119 41.26 2 50.2 501.2
8 0 -1 1 14.04 28.081 0.136 31.15 2 29.2 128.1
9 -1 0 1 14.099 28.199 0.136 30.87 2 29.4 128.5
10 1 1 2 14.93 29.861 0.144 27.32 2 39.2 202.0
11 0 0 2 14.956 29.911 0.144 27.22 2 56.6 419.4
12 1 0 2 15.855 31.71 0.153 24.01 2 126.2 1840.6
13 0 1 2 15.91 31.82 0.153 23.83 2 126.1 1825.0
14 -1 1 0 16.317 32.635 0.157 22.56 2 85.7 797.5
15 -1 -1 1 16.924 33.849 0.163 20.84 2 164.9 2729.9
16 1 -1 1 17.977 35.954 0.173 18.27 2 118.6 1237.8
17 -1 1 1 18.041 36.083 0.173 18.13 2 118.8 1232.0
18 1 2 1 18.826 37.653 0.18 16.51 2 116.0 1069.8
19 2 1 1 18.839 37.678 0.181 16.48 2 116.0 1068.2
20 2 0 1 20.101 40.203 0.192 14.27 2 38.3 100.9
21 0 2 1 20.105 40.21 0.192 14.27 2 36.5 91.4
22 2 1 2 20.259 40.518 0.194 14.03 2 93.0 584.3
23 0 -1 2 20.27 40.541 0.194 14.01 2 103.9 729.1
24 1 2 2 20.276 40.553 0.194 14.0 2 94.5 602.2
25 -1 0 2 20.342 40.684 0.194 13.9 2 104.7 734.6
26 1 2 0 20.398 40.796 0.195 13.82 2 59.9 238.4
27 2 1 0 20.438 40.877 0.195 13.75 2 59.9 237.4
28 0 2 0 20.614 41.227 0.197 13.5 2 99.0 637.2
29 2 0 0 20.667 41.335 0.197 13.42 2 97.9 618.9
30 1 1 3 20.865 41.731 0.199 13.13 2 97.5 601.2
31 1 -1 2 22.372 44.745 0.213 11.23 2 1.9 0.2
32 2 0 2 22.38 44.759 0.213 11.22 2 91.4 451.6
33 0 2 2 22.437 44.874 0.213 11.16 2 90.3 438.2
34 -1 1 2 22.48 44.96 0.214 11.11 2 1.2 0.1
35 1 0 3 22.491 44.983 0.214 11.1 2 51.1 139.8
36 0 1 3 22.559 45.118 0.214 11.02 2 51.7 141.8
37 0 0 3 22.775 45.549 0.216 10.79 2 16.1 13.4
38 2 2 1 22.978 45.956 0.218 10.57 2 6.1 1.9
39 2 2 2 23.328 46.655 0.221 10.22 2 77.7 296.8
40 -1 -1 2 23.379 46.759 0.222 10.17 2 31.8 49.6
41 0 -2 1 23.815 47.63 0.226 9.75 2 75.5 267.7
42 -2 0 1 23.914 47.828 0.227 9.66 2 75.1 262.6
43 2 1 3 24.26 48.521 0.23 9.35 2 31.2 43.8
44 1 2 3 24.301 48.602 0.23 9.31 2 32.2 46.5
45 -1 -2 1 24.511 49.023 0.232 9.13 2 25.1 27.6
46 -2 -1 1 24.571 49.143 0.232 9.08 2 24.8 26.8
47 2 2 0 25.2 50.4 0.238 8.57 2 92.1 350.4
48 -1 2 0 25.747 51.495 0.243 8.16 2 25.4 25.4
49 -2 1 0 25.781 51.562 0.243 8.14 2 27.2 28.9
50 2 -1 1 26.128 52.257 0.246 7.9 2 71.4 193.7
51 -1 2 1 26.167 52.333 0.247 7.87 2 68.8 179.4
52 2 2 3 26.17 52.34 0.247 7.87 2 59.7 135.2
53 2 0 3 26.93 53.859 0.253 7.37 2 17.3 10.6
54 0 2 3 27.026 54.053 0.254 7.31 2 16.7 9.8
55 0 -1 3 27.59 55.18 0.259 6.98 2 90.5 275.1
56 -1 0 3 27.67 55.34 0.26 6.93 2 90.6 273.9
57 1 -2 1 27.712 55.423 0.26 6.91 2 19.6 12.8
58 -2 1 1 27.813 55.626 0.261 6.85 2 19.9 13.0
59 1 1 4 28.016 56.033 0.263 6.74 2 73.5 175.3
60 1 -1 3 28.508 57.016 0.267 6.48 2 83.8 219.2
61 -1 1 3 28.643 57.286 0.268 6.41 2 82.4 209.7
62 1 3 1 28.729 57.459 0.269 6.36 2 56.8 98.8
63 3 1 1 28.768 57.537 0.269 6.34 2 57.9 102.5
64 2 -1 2 28.795 57.589 0.269 6.33 2 85.2 221.6
65 -1 2 2 28.898 57.795 0.27 6.28 2 83.7 212.0
66 0 -2 2 29.026 58.053 0.271 6.22 2 75.3 169.7
67 3 1 2 29.044 58.089 0.271 6.21 2 16.8 8.5
68 1 3 2 29.05 58.101 0.271 6.21 2 14.7 6.5
69 -2 0 2 29.157 58.314 0.272 6.16 2 75.5 169.2
70 -2 -2 1 29.567 59.134 0.276 5.96 2 36.7 38.7
71 2 1 4 30.07 60.139 0.28 5.74 2 22.5 14.0
72 1 0 4 30.089 60.177 0.28 5.74 2 14.2 5.6
73 1 2 4 30.126 60.253 0.281 5.72 2 21.5 12.8
74 0 1 4 30.166 60.331 0.281 5.7 2 12.9 4.6
75 2 3 2 30.375 60.75 0.283 5.62 2 25.8 17.9
76 3 2 2 30.382 60.765 0.283 5.61 2 25.6 17.7
77 -1 -2 2 30.399 60.799 0.283 5.61 2 37.2 37.3
78 -2 -1 2 30.473 60.946 0.283 5.58 2 36.9 36.6
79 1 3 0 30.632 61.263 0.285 5.51 2 10.0 2.6
80 3 1 0 30.712 61.425 0.285 5.48 2 11.1 3.2
81 0 3 1 30.78 61.559 0.286 5.45 2 95.5 239.7
82 3 0 1 30.806 61.611 0.286 5.44 2 94.9 235.9
83 2 3 1 30.82 61.641 0.286 5.44 2 78.1 159.8
84 3 2 1 30.849 61.698 0.287 5.43 2 77.8 158.0
85 -1 -1 3 30.884 61.769 0.287 5.41 2 51.0 67.7
86 2 2 4 31.017 62.033 0.288 5.36 2 116.8 352.1
87 0 0 4 31.074 62.147 0.289 5.34 2 125.3 404.1
88 3 1 3 31.505 63.009 0.292 5.18 2 141.4 498.6
89 1 3 3 31.553 63.105 0.293 5.16 2 141.0 494.6
90 1 -2 2 31.762 63.524 0.294 5.09 2 71.6 125.8
91 3 0 2 31.793 63.586 0.295 5.08 2 61.4 92.1
92 0 3 2 31.831 63.662 0.295 5.06 2 63.7 98.8
93 0 3 0 31.877 63.754 0.295 5.05 2 53.7 70.0
94 -2 1 2 31.918 63.836 0.296 5.03 2 70.6 120.9
95 3 0 0 31.966 63.932 0.296 5.02 2 55.1 73.3
96 3 2 3 32.073 64.146 0.297 4.98 2 8.4 1.7
97 2 3 3 32.087 64.174 0.297 4.98 2 8.6 1.8
98 2 0 4 33.121 66.242 0.305 4.65 2 109.4 267.9
99 0 2 4 33.248 66.495 0.306 4.61 2 110.4 270.9
100 2 3 0 33.374 66.748 0.308 4.57 2 65.9 95.8
101 2 -1 3 33.422 66.843 0.308 4.56 2 41.3 37.5
102 3 2 0 33.422 66.844 0.308 4.56 2 66.1 96.0
103 -1 2 3 33.578 67.156 0.309 4.52 2 41.9 38.1
104 -2 2 0 34.188 68.376 0.314 4.35 2 143.1 429.2
105 -1 -3 1 34.54 69.08 0.317 4.26 2 119.1 290.9
106 -3 -1 1 34.656 69.313 0.318 4.23 2 118.6 286.7
107 3 0 3 34.828 69.656 0.319 4.19 2 18.0 6.5
108 0 3 3 34.925 69.849 0.32 4.16 2 18.8 7.1
109 0 -3 1 35.013 70.025 0.321 4.14 2 11.1 2.4
110 -3 0 1 35.158 70.316 0.322 4.11 2 10.1 2.0
111 2 -2 1 35.167 70.334 0.322 4.11 2 13.7 3.7
112 -2 2 1 35.248 70.495 0.323 4.09 2 15.2 4.5
113 3 3 2 35.54 71.08 0.325 4.02 2 40.8 32.2
114 -2 -2 2 35.606 71.213 0.325 4.0 2 106.8 220.0
115 0 -2 3 35.736 71.473 0.326 3.98 2 33.2 21.1
116 3 2 4 35.754 71.508 0.327 3.97 2 44.9 38.5
117 2 3 4 35.787 71.574 0.327 3.97 2 44.0 37.0
118 0 -1 4 35.806 71.611 0.327 3.96 2 22.0 9.2
119 -2 0 3 35.893 71.787 0.328 3.94 2 32.6 20.2
120 -1 0 4 35.895 71.79 0.328 3.94 2 22.0 9.2
121 3 1 4 35.895 71.791 0.328 3.94 2 20.0 7.6
122 1 -1 4 35.911 71.822 0.328 3.94 2 25.6 12.5
123 1 3 4 35.98 71.96 0.328 3.92 2 20.4 7.9
124 -1 1 4 36.07 72.141 0.329 3.9 2 25.0 11.8
125 1 1 5 36.134 72.268 0.33 3.89 2 72.2 97.6
126 3 3 3 36.44 72.88 0.332 3.83 2 94.7 165.4
127 3 -1 1 36.565 73.131 0.333 3.8 2 45.9 38.5
128 -1 3 1 36.57 73.141 0.333 3.8 2 48.6 43.3
129 3 3 1 36.645 73.29 0.334 3.79 2 63.1 72.7
130 -1 3 0 36.897 73.793 0.336 3.74 2 29.2 15.4
131 -3 1 0 36.97 73.941 0.336 3.73 2 27.8 13.9
132 2 1 5 37.262 74.524 0.338 3.67 2 63.1 70.3
133 1 2 5 37.333 74.665 0.339 3.66 2 62.3 68.4
134 2 2 5 37.455 74.91 0.34 3.64 2 20.7 7.5
135 1 -2 3 37.538 75.075 0.341 3.62 2 75.3 99.0
136 -1 -2 3 37.661 75.321 0.342 3.6 2 81.0 113.7
137 -2 1 3 37.741 75.483 0.342 3.59 2 76.0 99.7
138 -2 -1 3 37.747 75.494 0.342 3.59 2 80.2 111.1
139 -2 -3 1 37.822 75.644 0.343 3.57 2 24.7 10.5
140 -3 -2 1 37.887 75.774 0.343 3.56 2 25.5 11.2
141 2 -2 2 38.117 76.234 0.345 3.52 2 36.5 22.6
142 3 -1 2 38.141 76.281 0.345 3.52 2 17.9 5.4
143 -1 3 2 38.224 76.447 0.346 3.51 2 18.7 5.9
144 -2 2 2 38.273 76.546 0.346 3.5 2 37.9 24.2
145 1 0 5 38.624 77.249 0.349 3.45 2 24.8 10.2
146 0 1 5 38.712 77.425 0.35 3.43 2 24.0 9.5
147 1 -3 1 39.185 78.371 0.353 3.36 2 104.7 177.4
148 3 3 4 39.293 78.586 0.354 3.35 2 15.0 3.6
149 -3 1 1 39.335 78.67 0.354 3.34 2 105.0 177.5
150 -1 -1 4 39.396 78.791 0.355 3.33 2 15.6 3.9
151 3 3 0 39.693 79.386 0.357 3.29 2 12.4 2.4
152 2 -1 4 39.701 79.402 0.357 3.29 2 17.4 4.8
153 3 0 4 39.703 79.405 0.357 3.29 2 23.5 8.8
154 0 3 4 39.853 79.705 0.358 3.27 2 22.9 8.3
155 -1 2 4 39.905 79.81 0.359 3.27 2 17.6 4.9
156 0 -3 2 39.979 79.957 0.359 3.26 2 25.1 9.9
157 1 4 2 40.016 80.032 0.359 3.25 2 17.2 4.6
158 4 1 2 40.035 80.071 0.36 3.25 2 16.2 4.1
159 -3 0 2 40.175 80.35 0.361 3.23 2 22.8 8.1
160 0 0 5 40.179 80.358 0.361 3.23 2 41.1 26.2
161 2 4 2 40.196 80.392 0.361 3.23 2 103.5 166.7
162 -1 -3 2 40.201 80.402 0.361 3.23 2 47.0 34.4
163 4 2 2 40.227 80.454 0.361 3.23 2 103.3 166.0
164 -3 -1 2 40.35 80.699 0.362 3.21 2 47.8 35.3
165 1 4 1 40.393 80.785 0.362 3.21 2 70.6 77.0
166 4 1 1 40.47 80.939 0.363 3.2 2 69.6 74.5
167 2 0 5 40.705 81.409 0.365 3.17 2 4.2 0.3
168 0 2 5 40.86 81.72 0.366 3.15 2 5.0 0.4
169 4 2 3 41.074 82.147 0.367 3.13 2 43.8 28.9
170 2 4 3 41.081 82.162 0.367 3.13 2 44.5 29.8
171 3 2 5 41.217 82.435 0.368 3.12 2 71.3 76.2
172 2 4 1 41.241 82.482 0.369 3.11 2 18.3 5.0
173 2 3 5 41.268 82.536 0.369 3.11 2 70.6 74.6
174 4 2 1 41.31 82.62 0.369 3.11 2 17.6 4.6
175 4 1 3 41.532 83.063 0.371 3.08 2 1.3 0.0
176 1 4 3 41.569 83.139 0.371 3.08 2 0.2 0.0
177 3 -1 3 41.626 83.251 0.371 3.07 2 69.6 71.6
178 -1 3 3 41.783 83.566 0.372 3.06 2 67.9 67.9
179 3 1 5 42.0 84.0 0.374 3.04 2 28.0 11.5
180 1 3 5 42.119 84.238 0.375 3.03 2 28.1 11.5
181 1 4 0 42.689 85.378 0.379 2.98 2 57.7 47.8
182 4 1 0 42.822 85.645 0.38 2.97 2 58.9 49.6
183 2 -2 3 42.913 85.827 0.381 2.96 2 5.1 0.4
184 0 4 1 43.14 86.281 0.382 2.94 2 7.1 0.7
185 -2 2 3 43.141 86.282 0.382 2.94 2 2.9 0.1
186 -2 -2 3 43.152 86.304 0.382 2.94 2 3.9 0.2
187 4 0 1 43.207 86.413 0.383 2.94 2 6.0 0.5
188 1 -3 2 43.353 86.706 0.384 2.93 2 12.2 2.1
189 4 0 2 43.422 86.843 0.384 2.92 2 56.2 44.5
190 0 4 2 43.431 86.863 0.384 2.92 2 53.9 40.9
191 -3 1 2 43.576 87.151 0.385 2.91 2 10.8 1.6
192 4 2 4 43.83 87.661 0.387 2.9 2 31.7 14.0
193 0 -2 4 43.86 87.721 0.387 2.89 2 55.5 43.0
194 2 4 4 43.876 87.751 0.387 2.89 2 32.9 15.1
195 3 4 2 43.964 87.928 0.388 2.89 2 7.9 0.9
196 4 3 2 43.988 87.977 0.388 2.89 2 7.9 0.9
197 3 3 5 44.002 88.004 0.388 2.88 2 50.9 36.0
198 -2 -3 2 44.011 88.022 0.388 2.88 2 9.7 1.3
199 -2 0 4 44.047 88.095 0.389 2.88 2 54.4 41.1
200 -3 -2 2 44.093 88.186 0.389 2.88 2 10.0 1.4
201 3 4 3 44.177 88.355 0.39 2.87 2 35.7 17.6
202 4 3 3 44.182 88.365 0.39 2.87 2 35.9 17.8
203 2 4 0 44.193 88.385 0.39 2.87 2 37.3 19.2
204 4 2 0 44.299 88.598 0.39 2.87 2 36.8 18.6
205 -3 -3 1 44.591 89.182 0.392 2.85 2 52.0 37.1
206 1 -1 5 44.63 89.259 0.393 2.85 2 94.6 122.7
207 0 4 0 44.759 89.519 0.394 2.84 2 55.2 41.8
208 -1 1 5 44.819 89.638 0.394 2.84 2 94.6 122.4
209 4 0 0 44.901 89.802 0.395 2.83 2 53.4 39.0
210 1 -2 4 44.924 89.847 0.395 2.83 2 22.8 7.1
211 4 1 4 44.928 89.855 0.395 2.83 2 42.0 24.1
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 0 0 1 7.414 14.828 6.93191 323.1 8.0 8.0 5.6
2 1 0 0 10.164 20.329 5.0686 166.3 4.1 4.1 5.6
3 1 0 1 10.974 21.949 4.6985 4045.3 100.0 100.0 5.6
4 1 1 1 11.42 22.839 4.51762 1450.5 35.9 35.8 5.6
5 1 1 0 12.292 24.584 4.2015 501.2 12.4 12.4 5.6
6 0 -1 1 14.04 28.081 3.68688 128.1 3.2 3.2 5.6
7 -1 0 1 14.099 28.199 3.67178 128.5 3.2 3.2 5.6
8 0 0 2 14.956 29.911 3.46596 621.3 15.4 15.3 5.6
9 1 0 2 15.855 31.71 3.27396 1840.6 45.5 45.2 5.6
10 0 1 2 15.91 31.82 3.26291 1825.0 45.1 44.8 5.6
11 -1 1 0 16.317 32.635 3.18363 797.5 19.7 19.5 5.6
12 -1 -1 1 16.924 33.849 3.07261 2729.9 67.5 66.8 5.7
13 1 -1 1 17.977 35.954 2.89811 1237.8 30.6 30.3 5.7
14 -1 1 1 18.041 36.083 2.88811 1232.0 30.5 30.1 5.7
15 1 2 1 18.826 37.653 2.77178 2138.0 52.9 52.2 5.7
16 2 0 1 20.101 40.203 2.60259 192.4 4.8 4.7 5.7
17 1 2 2 20.276 40.553 2.58106 1915.6 47.4 46.6 5.7
18 -1 0 2 20.342 40.684 2.57305 734.6 18.2 17.9 5.7
19 1 2 0 20.398 40.796 2.56633 238.4 5.9 5.8 5.7
20 2 1 0 20.438 40.877 2.56145 237.4 5.9 5.8 5.7
21 0 2 0 20.614 41.227 2.54061 637.2 15.8 15.5 5.7
22 2 0 0 20.667 41.335 2.5343 618.9 15.3 15.0 5.7
23 1 1 3 20.865 41.731 2.5113 601.2 14.9 14.6 5.7
24 2 0 2 22.38 44.759 2.34925 451.6 11.2 10.9 5.7
25 0 2 2 22.437 44.874 2.34357 438.2 10.8 10.6 5.7
26 1 0 3 22.491 44.983 2.33819 139.8 3.5 3.4 5.7
27 0 1 3 22.559 45.118 2.33153 141.8 3.5 3.4 5.7
28 2 2 2 23.328 46.655 2.25881 296.8 7.3 7.2 5.7
29 -1 -1 2 23.379 46.759 2.25408 49.6 1.2 1.2 5.7
30 0 -2 1 23.815 47.63 2.2152 267.7 6.6 6.5 5.7
31 -2 0 1 23.914 47.828 2.20656 262.6 6.5 6.3 5.7
32 2 1 3 24.26 48.521 2.17691 43.8 1.1 1.1 5.7
33 1 2 3 24.301 48.602 2.17352 46.5 1.2 1.1 5.7
34 2 2 0 25.2 50.4 2.10075 350.4 8.7 8.4 5.8
35 2 -1 1 26.128 52.257 2.03109 193.7 4.8 4.7 5.8
36 -1 2 1 26.167 52.333 2.02833 314.6 7.8 7.6 5.8
37 0 -1 3 27.59 55.18 1.93129 275.1 6.8 6.6 5.8
38 -1 0 3 27.67 55.34 1.92616 273.9 6.8 6.6 5.8
39 1 1 4 28.016 56.033 1.90423 175.3 4.3 4.2 5.8
40 1 -1 3 28.508 57.016 1.87408 219.2 5.4 5.2 5.8
41 -1 1 3 28.643 57.286 1.86598 209.7 5.2 5.0 5.8
42 1 3 1 28.729 57.459 1.86085 98.8 2.4 2.4 5.8
43 2 -1 2 28.795 57.589 1.85699 324.2 8.0 7.7 5.8
44 -1 2 2 28.898 57.795 1.85094 212.0 5.2 5.1 5.8
45 0 -2 2 29.026 58.053 1.84344 184.6 4.6 4.4 5.8
46 -2 0 2 29.157 58.314 1.83589 169.2 4.2 4.0 5.8
47 -1 -2 2 30.399 60.799 1.76762 72.9 1.8 1.7 5.8
48 0 3 1 30.78 61.559 1.74789 475.6 11.8 11.3 5.8
49 2 3 1 30.82 61.641 1.74581 317.8 7.9 7.5 5.8
50 -1 -1 3 30.884 61.769 1.74254 67.7 1.7 1.6 5.8
51 2 2 4 31.017 62.033 1.73584 352.1 8.7 8.3 5.8
52 0 0 4 31.074 62.147 1.73298 404.1 10.0 9.6 5.8
53 3 1 3 31.505 63.009 1.71166 498.6 12.3 11.8 5.9
54 1 3 3 31.553 63.105 1.70933 494.6 12.2 11.7 5.9
55 1 -2 2 31.762 63.524 1.69924 125.8 3.1 3.0 5.9
56 3 0 2 31.793 63.586 1.69774 92.1 2.3 2.2 5.9
57 0 3 2 31.831 63.662 1.69594 98.8 2.4 2.3 5.9
58 0 3 0 31.877 63.754 1.69374 70.0 1.7 1.7 5.9
59 -2 1 2 31.918 63.836 1.69179 120.9 3.0 2.9 5.9
60 3 0 0 31.966 63.932 1.68953 73.3 1.8 1.7 5.9
61 2 0 4 33.121 66.242 1.63698 267.9 6.6 6.3 5.9
62 0 2 4 33.248 66.495 1.63145 270.9 6.7 6.4 5.9
63 2 3 0 33.374 66.748 1.62599 95.8 2.4 2.3 5.9
64 3 2 0 33.422 66.844 1.62392 133.5 3.3 3.1 5.9
65 -2 2 0 34.188 68.376 1.59181 429.2 10.6 10.1 5.9
66 -1 -3 1 34.54 69.08 1.57758 290.9 7.2 6.8 5.9
67 -3 -1 1 34.656 69.313 1.57294 286.7 7.1 6.7 5.9
68 -2 -2 2 35.606 71.213 1.53631 220.0 5.4 5.1 5.9
69 3 2 4 35.754 71.508 1.5308 59.6 1.5 1.4 5.9
70 2 3 4 35.787 71.574 1.52957 46.3 1.1 1.1 5.9
71 -2 0 3 35.893 71.787 1.52566 49.4 1.2 1.2 5.9
72 1 1 5 36.134 72.268 1.51687 97.6 2.4 2.3 5.9
73 3 3 3 36.44 72.88 1.50587 165.4 4.1 3.8 6.0
74 -1 3 1 36.57 73.141 1.50125 81.8 2.0 1.9 6.0
75 3 3 1 36.645 73.29 1.49862 72.7 1.8 1.7 6.0
76 2 1 5 37.262 74.524 1.47732 70.3 1.7 1.6 6.0
77 1 2 5 37.333 74.665 1.47493 68.4 1.7 1.6 6.0
78 1 -2 3 37.538 75.075 1.46805 99.0 2.4 2.3 6.0
79 -1 -2 3 37.661 75.321 1.46396 113.7 2.8 2.6 6.0
80 -2 -1 3 37.747 75.494 1.46112 210.8 5.2 4.9 6.0
81 1 -3 1 39.185 78.371 1.41566 177.4 4.4 4.1 6.0
82 -3 1 1 39.335 78.67 1.41115 177.5 4.4 4.1 6.0
83 -1 -3 2 40.201 80.402 1.38575 401.4 9.9 9.2 6.0
84 1 4 1 40.393 80.785 1.38029 77.0 1.9 1.8 6.1
85 4 1 1 40.47 80.939 1.37812 74.5 1.8 1.7 6.1
86 2 4 3 41.081 82.162 1.36117 58.8 1.5 1.3 6.1
87 3 2 5 41.217 82.435 1.35747 81.2 2.0 1.8 6.1
88 2 3 5 41.268 82.536 1.3561 74.6 1.8 1.7 6.1
89 3 -1 3 41.626 83.251 1.34655 71.6 1.8 1.6 6.1
90 -1 3 3 41.783 83.566 1.34241 67.9 1.7 1.5 6.1
91 1 4 0 42.689 85.378 1.31922 47.8 1.2 1.1 6.1
92 4 1 0 42.822 85.645 1.31591 49.6 1.2 1.1 6.1
93 4 0 2 43.422 86.843 1.3013 85.4 2.1 1.9 6.1
94 0 -2 4 43.86 87.721 1.29089 72.0 1.8 1.6 6.2
95 -2 0 4 44.047 88.095 1.28653 41.1 1.0 0.9 6.2
96 2 4 0 44.193 88.385 1.28316 54.7 1.4 1.2 6.2
97 1 -1 5 44.63 89.259 1.27322 122.7 3.0 2.7 6.2
98 0 4 0 44.759 89.519 1.27031 41.8 1.0 0.9 6.2
99 -1 1 5 44.819 89.638 1.26897 122.4 3.0 2.7 6.2
100 4 0 0 44.901 89.802 1.26715 70.2 1.7 1.6 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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