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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CHLORITE
1, f-chlorite
Al(2.0)[Si(3.3)Al(0.7)]O(10)(OH)(2)[Mg(2.3)Al(0.7)](OH)(6)
Monoclinic C 2/m Z = 2
C2/m
23 .3 .1988
Ref.Str.:
Eggleton R.A., Bailey S.W. (1967)
* Amer. Mineral., 52, 673-689
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.237 alpha = 90.0
b = 9.07 beta = 97.03
c = 14.29 gamma = 90.0
Unit cell volume (cub. angs.) = 673.67
Molar volume ( cub.cm/mol.) = 202.89
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.231 0.1667 0.19 0.0 Si = 0.83, Al = 0.1
2 0.0 0.3333 0.0 0.0 Al = 1.00
3 0.0 0.1667 0.5 0.0 Mg = 0.77, Al = 0.23
4 0.0 0.5 0.5 0.0 Mg = 0.77, Al = 0.23
5 0.19 0.1667 0.072 0.0 O = 1.00
6 0.19 0.5 0.072 0.0 O = 1.00
7 0.194 0.0 0.236 0.0 O = 1.00
8 0.506 0.233 0.233 0.0 O = 1.00
9 0.142 0.0 0.424 0.0 O = 1.00
10 0.142 0.3333 0.424 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.231 0.1667 0.19
2 2 0.0 0.3333 0.0
3 3 0.0 0.1667 0.5
4 4 0.0 0.5 0.5
5 5 0.19 0.1667 0.072
6 6 0.19 0.5 0.072
7 7 0.194 0.0 0.236
8 8 0.506 0.233 0.233
9 9 0.142 0.0 0.424
10 10 0.142 0.3333 0.424
11 1 0.769 0.8333 0.81
12 2 0.0 0.6667 0.0
13 3 0.0 0.8333 0.5
14 5 0.81 0.8333 0.928
15 6 0.81 0.5 0.928
16 7 0.806 0.0 0.764
17 8 0.494 0.767 0.767
18 9 0.858 0.0 0.576
19 10 0.858 0.6667 0.576
20 1 0.231 0.8333 0.19
21 5 0.19 0.8333 0.072
22 8 0.506 0.767 0.233
23 10 0.142 0.6667 0.424
24 1 0.769 0.1667 0.81
25 5 0.81 0.1667 0.928
26 8 0.494 0.233 0.767
27 10 0.858 0.3333 0.576
28 1 0.731 0.3333 0.19
29 2 0.5 0.1667 0.0
30 3 0.5 0.3333 0.5
31 4 0.5 0.0 0.5
32 5 0.69 0.3333 0.072
33 6 0.69 0.0 0.072
34 7 0.694 0.5 0.236
35 8 0.006 0.267 0.233
36 9 0.642 0.5 0.424
37 10 0.642 0.1667 0.424
38 1 0.269 0.6667 0.81
39 2 0.5 0.8333 0.0
40 3 0.5 0.6667 0.5
41 5 0.31 0.6667 0.928
42 6 0.31 0.0 0.928
43 7 0.306 0.5 0.764
44 8 0.994 0.733 0.767
45 9 0.358 0.5 0.576
46 10 0.358 0.8333 0.576
47 1 0.731 0.6667 0.19
48 5 0.69 0.6667 0.072
49 8 0.006 0.733 0.233
50 10 0.642 0.8333 0.424
51 1 0.269 0.3333 0.81
52 5 0.31 0.3333 0.928
53 8 0.994 0.267 0.767
54 10 0.358 0.1667 0.576
X-ray density (g/cm cub.) = 2.57
MU (1/cm) = 74.818 Mass attenuation coefficient (cm**2/g) = 29.154
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Si ,Al 2.316 4
1.6736 5
1.6691 7
1.6115 8
1.6647 8
2 Al 2.316 6
2.0207 5
2.0207 6
2.0207 6
2.0207 5
2.0256 5
2.0256 5
3 Mg ,Al 2.52 6
2.0531 9
2.0531 10
2.0531 9
2.0531 10
2.0484 10
2.0484 10
4 Mg ,Al 2.52 6
2.0531 10
2.0531 10
2.0531 10
2.0531 10
2.0484 9
2.0484 9
5 O 3.264 12
3.0233 6
2.7867 7
2.7316 8
3.0234 5
2.6819 5
3.0235 5
3.0235 5
3.0235 6
3.0235 6
2.7554 8
2.6891 6
2.689 5
6 O 3.264 9
3.0233 5
2.6819 6
3.0233 5
3.0235 5
3.0235 5
2.6891 5
3.0235 5
3.0235 5
2.6891 5
7 O 3.264 7
2.7867 5
2.6749 8
2.7332 9
2.7867 5
2.6749 8
2.6126 8
2.6126 8
8 O 3.264 7
2.7316 5
2.6749 7
2.7554 5
2.6126 7
2.6366 8
2.6366 8
2.8005 10
9 O 3.264 10
2.7332 7
3.0233 10
2.7786 9
3.0233 10
3.0235 10
3.0235 10
2.7715 10
3.0235 10
3.0235 10
2.7715 10
10 O 3.264 10
3.0233 9
3.0234 10
2.7786 10
2.8005 8
3.0235 9
3.0235 9
3.0235 10
3.0235 10
2.7715 9
2.7715 10
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 3.113 6.227 0.035 675.03 2 27.4 223.3
2 0 0 2 6.236 12.472 0.071 166.54 2 66.6 325.2
3 0 0 3 9.377 18.755 0.106 72.41 2 120.0 459.2
4 0 2 0 9.779 19.558 0.11 66.4 2 94.3 260.3
5 1 1 0 9.835 19.67 0.111 65.63 4 13.3 10.2
6 1 1 -1 10.0 20.0 0.113 63.41 4 47.3 124.9
7 0 2 1 10.272 20.544 0.116 59.98 4 41.7 92.1
8 1 1 1 10.641 21.281 0.12 55.75 4 86.0 363.8
9 1 1 -2 11.095 22.191 0.125 51.11 4 4.8 1.0
10 0 2 2 11.631 23.263 0.131 46.32 4 34.9 49.8
11 1 1 2 12.236 24.471 0.138 41.65 4 61.1 136.9
12 0 0 4 12.547 25.095 0.141 39.51 2 134.9 316.9
13 1 1 -3 12.896 25.793 0.145 37.29 4 67.0 147.3
14 0 2 3 13.613 27.227 0.153 33.26 4 25.4 18.9
15 1 1 3 14.375 28.749 0.161 29.62 4 14.6 5.6
16 1 1 -4 15.171 30.343 0.17 26.39 4 62.8 91.8
17 0 0 5 15.757 31.514 0.176 24.33 2 97.9 102.7
18 0 2 4 16.008 32.015 0.179 23.52 4 42.1 36.8
19 1 1 4 16.874 33.747 0.188 20.98 4 28.9 15.5
20 2 0 -1 17.141 34.282 0.191 20.27 2 14.5 1.9
21 1 3 0 17.142 34.285 0.191 20.27 4 15.2 4.1
22 2 0 0 17.241 34.483 0.192 20.02 2 16.6 2.4
23 1 3 -1 17.242 34.483 0.192 20.02 4 20.1 7.1
24 2 0 -2 17.634 35.268 0.197 19.06 2 75.1 47.3
25 1 3 1 17.636 35.273 0.197 19.05 4 79.6 106.4
26 1 1 -5 17.762 35.525 0.198 18.76 4 5.9 0.6
27 1 3 -2 17.926 35.852 0.2 18.38 4 161.9 424.4
28 2 0 1 17.927 35.853 0.2 18.38 2 156.6 198.5
29 2 0 -3 18.68 37.359 0.208 16.79 2 113.9 96.1
30 0 2 5 18.681 37.362 0.208 16.79 4 65.6 63.6
31 1 3 2 18.683 37.366 0.208 16.79 4 114.0 192.4
32 0 0 6 19.018 38.037 0.212 16.14 2 41.3 12.1
33 1 3 -3 19.141 38.282 0.213 15.91 4 81.5 93.2
34 2 0 2 19.143 38.285 0.213 15.91 2 79.2 43.9
35 1 1 5 19.622 39.244 0.218 15.06 4 20.6 5.6
36 0 4 0 19.859 39.718 0.221 14.66 2 6.6 0.3
37 2 2 -1 19.887 39.773 0.221 14.62 4 8.5 0.9
38 2 2 0 19.975 39.951 0.222 14.48 4 41.4 21.8
39 0 4 1 20.122 40.244 0.223 14.24 4 25.1 7.9
40 2 0 -4 20.205 40.41 0.224 14.11 2 83.6 43.5
41 1 3 3 20.209 40.418 0.224 14.11 4 77.9 75.4
42 2 2 -2 20.322 40.645 0.225 13.93 4 8.9 1.0
43 1 1 -6 20.579 41.157 0.228 13.55 4 18.6 4.1
44 2 2 1 20.582 41.165 0.228 13.54 4 13.8 2.3
45 1 3 -4 20.808 41.615 0.231 13.22 4 44.8 23.4
46 2 0 3 20.81 41.621 0.231 13.21 2 49.9 14.5
47 0 4 2 20.895 41.789 0.232 13.09 4 49.4 28.2
48 2 2 -3 21.256 42.511 0.235 12.6 4 38.0 16.0
49 0 2 6 21.56 43.121 0.239 12.2 4 25.4 7.0
50 2 2 2 21.672 43.345 0.24 12.06 4 15.3 2.5
51 2 0 -5 22.129 44.257 0.245 11.51 2 33.7 5.8
52 0 4 3 22.133 44.266 0.245 11.51 4 3.2 0.1
53 1 3 4 22.133 44.267 0.245 11.5 4 30.7 9.5
54 0 0 7 22.345 44.69 0.247 11.26 2 87.4 37.9
55 1 1 6 22.56 45.12 0.249 11.02 4 52.3 26.6
56 2 2 -4 22.637 45.273 0.25 10.94 4 58.9 33.4
57 1 3 -5 22.848 45.696 0.252 10.71 4 153.0 220.8
58 2 0 4 22.851 45.703 0.252 10.71 2 152.1 109.1
59 2 2 3 23.19 46.381 0.256 10.35 4 25.3 5.8
60 1 1 -7 23.572 47.144 0.26 9.98 4 5.4 0.3
61 0 4 4 23.78 47.561 0.262 9.78 4 29.4 7.5
62 2 0 -6 24.381 48.761 0.268 9.24 2 93.0 35.2
63 1 3 5 24.386 48.772 0.268 9.24 4 95.9 74.8
64 2 2 -5 24.407 48.813 0.268 9.22 4 0.1 0.0
65 0 2 7 24.607 49.215 0.27 9.05 4 12.6 1.3
66 2 2 4 25.079 50.157 0.275 8.67 4 64.2 31.5
67 1 3 -6 25.197 50.394 0.276 8.58 4 121.4 111.4
68 2 0 5 25.201 50.401 0.276 8.57 2 117.9 52.5
69 1 1 7 25.659 51.319 0.281 8.23 4 34.1 8.4
70 0 0 8 25.753 51.506 0.282 8.16 2 34.3 4.2
71 0 4 5 25.779 51.559 0.282 8.14 4 23.5 4.0
72 2 2 -6 26.511 53.023 0.29 7.64 4 39.6 10.6
73 3 1 -1 26.702 53.404 0.292 7.51 4 58.6 22.7
74 1 1 -8 26.722 53.444 0.292 7.5 4 32.2 6.9
75 2 4 -1 26.727 53.453 0.292 7.5 4 3.4 0.1
76 1 5 0 26.728 53.455 0.292 7.5 4 24.0 3.8
77 2 4 0 26.797 53.594 0.293 7.45 4 32.3 6.9
78 1 5 -1 26.797 53.595 0.293 7.45 4 28.2 5.2
79 2 0 -7 26.908 53.816 0.294 7.38 2 18.0 1.0
80 3 1 -2 26.911 53.822 0.294 7.38 4 12.1 1.0
81 3 1 0 26.913 53.826 0.294 7.38 4 45.7 13.6
82 1 3 6 26.914 53.827 0.294 7.38 4 24.3 3.9
83 2 4 -2 27.075 54.15 0.295 7.28 4 58.6 22.0
84 1 5 1 27.077 54.154 0.295 7.28 4 60.5 23.5
85 1 5 -2 27.284 54.568 0.298 7.15 4 16.0 1.6
86 2 4 1 27.285 54.569 0.298 7.15 4 8.9 0.5
87 2 2 5 27.285 54.57 0.298 7.15 4 19.0 2.3
88 3 1 -3 27.534 55.067 0.3 7.01 4 19.4 2.3
89 3 1 1 27.537 55.074 0.3 7.01 4 14.0 1.2
90 1 3 -7 27.807 55.615 0.303 6.85 4 46.3 12.9
91 0 2 8 27.808 55.616 0.303 6.85 4 6.4 0.2
92 2 0 6 27.812 55.623 0.303 6.85 2 47.9 6.9
93 2 4 -3 27.832 55.664 0.303 6.84 4 59.0 21.0
94 1 5 2 27.834 55.669 0.303 6.84 4 31.9 6.1
95 0 4 6 28.082 56.164 0.306 6.7 4 73.7 32.1
96 1 5 -3 28.173 56.346 0.306 6.65 4 42.9 10.8
97 2 4 2 28.174 56.348 0.306 6.65 4 52.0 15.8
98 3 1 -4 28.551 57.102 0.31 6.45 4 1.0 0.0
99 3 1 2 28.556 57.112 0.31 6.45 4 30.4 5.2
100 2 2 -7 28.906 57.813 0.314 6.28 4 15.4 1.3
101 1 1 8 28.911 57.822 0.314 6.27 4 4.2 0.1
102 2 4 -4 28.976 57.952 0.314 6.24 4 3.7 0.1
103 1 5 3 28.979 57.958 0.314 6.24 4 11.3 0.7
104 0 0 9 29.262 58.524 0.317 6.11 2 1.2 0.0
105 1 5 -4 29.44 58.881 0.319 6.02 4 60.1 19.2
106 2 4 3 29.442 58.885 0.319 6.02 4 39.8 8.4
107 2 0 -8 29.676 59.351 0.321 5.92 2 187.9 92.1
108 1 3 7 29.682 59.363 0.321 5.91 4 187.1 182.4
109 2 2 6 29.77 59.54 0.322 5.87 4 39.4 8.0
110 3 1 -5 29.938 59.877 0.324 5.8 4 31.5 5.1
111 3 1 3 29.944 59.888 0.324 5.8 4 21.3 2.3
112 1 1 -9 30.025 60.05 0.325 5.76 4 34.7 6.1
113 2 4 -5 30.48 60.96 0.329 5.57 4 34.3 5.8
114 1 5 4 30.484 60.968 0.329 5.57 4 10.2 0.5
115 3 3 -1 30.632 61.264 0.331 5.51 4 219.2 233.3
116 0 6 0 30.634 61.269 0.331 5.51 2 216.6 113.9
117 1 3 -8 30.651 61.301 0.331 5.5 4 36.2 6.4
118 0 4 7 30.653 61.306 0.331 5.5 4 28.2 3.9
119 2 0 7 30.655 61.311 0.331 5.5 2 31.5 2.4
120 3 3 -2 30.824 61.648 0.333 5.44 4 13.2 0.8
121 3 3 0 30.825 61.651 0.333 5.43 4 4.8 0.1
122 0 6 1 30.827 61.653 0.333 5.43 4 8.3 0.3
123 1 5 -5 31.059 62.117 0.335 5.35 4 14.6 1.0
124 2 4 4 31.061 62.122 0.335 5.34 4 2.6 0.0
125 0 2 9 31.163 62.326 0.336 5.31 4 21.1 2.1
126 3 3 -3 31.396 62.793 0.338 5.22 4 89.6 37.0
127 3 3 1 31.399 62.798 0.338 5.22 4 89.5 36.8
128 0 6 2 31.4 62.8 0.338 5.22 4 91.9 38.8
129 2 2 -8 31.562 63.123 0.34 5.16 4 74.9 25.5
130 3 1 -6 31.667 63.334 0.341 5.12 4 33.8 5.2
131 3 1 4 31.674 63.348 0.341 5.12 4 61.1 16.8
132 2 4 -6 32.317 64.634 0.347 4.9 4 7.8 0.3
133 1 1 9 32.319 64.639 0.347 4.9 4 4.1 0.1
134 1 5 5 32.321 64.643 0.347 4.9 4 19.7 1.7
135 3 3 -4 32.338 64.676 0.347 4.89 4 65.0 18.2
136 0 6 3 32.342 64.684 0.347 4.89 4 59.5 15.3
137 3 3 2 32.342 64.684 0.347 4.89 4 58.0 14.5
138 2 2 7 32.508 65.017 0.349 4.84 4 8.3 0.3
139 2 0 -9 32.666 65.332 0.35 4.79 2 35.1 2.6
140 1 3 8 32.672 65.345 0.35 4.79 4 40.3 6.8
141 0 0 10 32.896 65.792 0.353 4.72 2 92.3 17.7
142 1 5 -6 33.001 66.002 0.354 4.68 4 23.2 2.2
143 2 4 5 33.004 66.008 0.354 4.68 4 8.5 0.3
144 0 4 8 33.472 66.944 0.358 4.55 4 41.1 6.8
145 1 1 -10 33.488 66.977 0.358 4.54 4 20.8 1.7
146 3 3 -5 33.633 67.265 0.36 4.5 4 43.8 7.6
147 0 6 4 33.637 67.275 0.36 4.5 4 44.7 7.9
148 3 3 3 33.638 67.276 0.36 4.5 4 48.7 9.4
149 3 1 -7 33.712 67.423 0.36 4.48 4 19.1 1.4
150 1 3 -9 33.714 67.427 0.36 4.48 4 169.7 113.7
151 2 0 8 33.719 67.438 0.36 4.48 2 167.8 55.5
152 3 1 5 33.72 67.44 0.36 4.48 4 33.1 4.3
153 2 2 -9 34.46 68.92 0.367 4.28 4 38.8 5.7
154 2 4 -7 34.463 68.925 0.367 4.28 4 53.2 10.7
155 1 5 6 34.468 68.935 0.367 4.28 4 33.6 4.3
156 0 2 10 34.685 69.369 0.369 4.22 4 33.8 4.3
157 1 5 -7 35.245 70.491 0.375 4.09 4 5.4 0.1
158 2 4 6 35.249 70.498 0.375 4.09 4 7.5 0.2
159 3 3 -6 35.263 70.525 0.375 4.08 4 46.2 7.7
160 0 6 5 35.268 70.536 0.375 4.08 4 40.8 6.0
161 3 3 4 35.269 70.539 0.375 4.08 4 41.2 6.1
162 2 2 8 35.487 70.975 0.377 4.03 4 63.0 14.1
163 2 0 -10 35.875 71.751 0.38 3.95 2 35.5 2.2
164 1 3 9 35.882 71.764 0.38 3.94 4 34.7 4.2
165 1 1 10 35.901 71.803 0.381 3.94 4 5.9 0.1
166 3 1 -8 36.053 72.107 0.382 3.91 4 7.2 0.2
167 4 0 -1 36.059 72.118 0.382 3.91 2 14.0 0.3
168 2 6 -1 36.061 72.122 0.382 3.91 4 4.9 0.1
169 3 1 6 36.063 72.125 0.382 3.91 4 15.0 0.8
170 4 0 -2 36.117 72.235 0.383 3.89 2 49.6 4.2
171 2 6 0 36.121 72.242 0.383 3.89 4 52.5 9.4
172 4 0 0 36.355 72.711 0.385 3.85 2 113.6 21.9
173 2 6 -2 36.356 72.713 0.385 3.85 4 116.5 46.0
174 4 0 -3 36.53 73.059 0.386 3.81 2 93.2 14.6
175 0 4 9 36.531 73.062 0.386 3.81 4 20.7 1.4
176 2 6 1 36.534 73.069 0.386 3.81 4 100.0 33.6
177 0 0 11 36.686 73.372 0.388 3.78 2 7.6 0.1
178 2 4 -8 36.9 73.801 0.39 3.74 4 39.2 5.1
179 1 5 7 36.906 73.812 0.39 3.74 4 24.6 2.0
180 1 3 -10 36.998 73.996 0.391 3.72 4 86.4 24.5
181 2 6 -3 37.003 74.005 0.391 3.72 4 91.5 27.4
182 4 0 1 37.003 74.006 0.391 3.72 2 98.3 15.9
183 2 0 9 37.004 74.008 0.391 3.72 2 89.4 13.1
184 1 1 -11 37.134 74.267 0.392 3.7 4 4.2 0.1
185 3 3 -7 37.212 74.424 0.393 3.68 4 39.0 4.9
186 0 6 6 37.218 74.436 0.393 3.68 4 38.5 4.8
187 3 3 5 37.22 74.44 0.393 3.68 4 36.9 4.4
188 4 0 -4 37.291 74.583 0.393 3.67 2 112.5 20.5
189 2 6 2 37.297 74.595 0.393 3.67 4 114.2 42.1
190 2 2 -10 37.6 75.2 0.396 3.61 4 33.8 3.6
191 3 5 -1 37.762 75.524 0.398 3.58 4 51.4 8.4
192 1 5 -8 37.779 75.558 0.398 3.58 4 32.8 3.4
193 4 2 -1 37.78 75.561 0.398 3.58 4 29.3 2.7
194 2 4 7 37.783 75.566 0.398 3.58 4 23.3 1.7
195 1 7 0 37.783 75.567 0.398 3.58 4 10.3 0.3
196 4 2 -2 37.838 75.675 0.398 3.57 4 31.0 3.0
197 1 7 -1 37.841 75.682 0.398 3.57 4 27.0 2.3
198 3 5 -2 37.936 75.872 0.399 3.55 4 3.4 0.0
199 3 5 0 37.937 75.874 0.399 3.55 4 46.7 6.8
200 2 6 -4 37.994 75.988 0.4 3.54 4 21.4 1.4
201 4 0 2 37.996 75.991 0.4 3.54 2 22.9 0.8
202 4 2 0 38.072 76.143 0.4 3.53 4 60.1 11.2
203 1 7 1 38.074 76.148 0.4 3.53 4 48.1 7.2
204 4 2 -3 38.243 76.486 0.402 3.5 4 24.7 1.9
205 1 7 -2 38.247 76.495 0.402 3.5 4 15.8 0.8
206 4 0 -5 38.395 76.791 0.403 3.48 2 15.4 0.4
207 0 2 11 38.397 76.794 0.403 3.48 4 25.2 1.9
208 2 6 3 38.403 76.805 0.403 3.48 4 6.6 0.1
209 3 5 -3 38.457 76.914 0.404 3.47 4 19.5 1.2
210 3 5 1 38.46 76.919 0.404 3.47 4 11.6 0.4
211 3 1 -9 38.681 77.363 0.406 3.44 4 0.5 0.0
212 3 1 7 38.692 77.384 0.406 3.43 4 16.0 0.8
213 4 2 1 38.709 77.418 0.406 3.43 4 21.4 1.4
214 2 2 9 38.71 77.42 0.406 3.43 4 56.9 9.8
215 1 7 2 38.711 77.422 0.406 3.43 4 57.0 9.8
216 4 2 -4 38.993 77.986 0.408 3.39 4 41.5 5.1
217 1 7 -3 38.998 77.996 0.408 3.39 4 45.8 6.3
218 2 0 -11 39.315 78.63 0.411 3.34 2 124.1 22.7
219 3 5 -4 39.321 78.642 0.411 3.34 4 6.9 0.1
220 2 6 -5 39.322 78.643 0.411 3.34 4 19.2 1.1
221 1 3 10 39.322 78.645 0.411 3.34 4 119.1 41.8
222 4 0 3 39.325 78.649 0.411 3.34 2 26.7 1.0
223 3 5 2 39.325 78.65 0.411 3.34 4 33.8 3.4
224 3 3 -8 39.47 78.939 0.413 3.32 4 36.6 3.9
225 0 6 7 39.476 78.952 0.413 3.32 4 31.6 2.9
226 3 3 6 39.479 78.958 0.413 3.32 4 33.0 3.2
227 2 4 -9 39.624 79.248 0.414 3.3 4 3.4 0.0
228 1 5 8 39.63 79.26 0.414 3.3 4 11.5 0.4
229 1 1 11 39.685 79.37 0.415 3.3 4 20.1 1.2
230 4 2 2 39.688 79.376 0.415 3.29 4 18.4 1.0
231 1 7 3 39.689 79.377 0.415 3.29 4 0.0 0.0
232 4 0 -6 39.833 79.666 0.416 3.28 2 70.9 7.3
233 0 4 10 39.837 79.674 0.416 3.28 4 53.2 8.2
234 2 6 4 39.842 79.683 0.416 3.27 4 68.8 13.7
235 4 2 -5 40.082 80.165 0.418 3.24 4 64.1 11.8
236 1 7 -4 40.088 80.176 0.418 3.24 4 25.9 1.9
237 1 3 -11 40.52 81.04 0.422 3.19 4 7.9 0.2
238 3 5 -5 40.522 81.045 0.422 3.19 4 31.2 2.7
239 2 0 10 40.526 81.052 0.422 3.19 2 10.9 0.2
240 3 5 3 40.527 81.055 0.422 3.19 4 16.1 0.7
241 1 5 -9 40.598 81.196 0.422 3.18 4 39.5 4.4
242 2 4 8 40.603 81.206 0.422 3.18 4 27.0 2.1
243 0 0 12 40.673 81.346 0.423 3.17 2 118.5 19.6
244 2 6 -6 40.979 81.958 0.426 3.14 4 96.1 25.5
245 4 0 4 40.983 81.966 0.426 3.14 2 92.1 11.7
246 2 2 -11 40.992 81.984 0.426 3.14 4 29.2 2.4
247 1 1 -12 40.993 81.987 0.426 3.14 4 4.0 0.0
248 4 2 3 41.002 82.004 0.426 3.14 4 5.6 0.1
249 1 7 4 41.002 82.004 0.426 3.14 4 34.9 3.4
250 4 2 -6 41.505 83.011 0.43 3.09 4 10.6 0.3
251 1 7 -5 41.512 83.023 0.43 3.08 4 1.1 0.0
252 3 1 -10 41.597 83.194 0.431 3.08 4 3.4 0.0
253 4 0 -7 41.599 83.198 0.431 3.08 2 92.4 11.6
254 2 6 5 41.608 83.217 0.431 3.08 4 103.4 29.0
255 3 1 8 41.609 83.217 0.431 3.08 4 20.0 1.1
256 3 3 -9 42.033 84.066 0.435 3.04 4 49.2 6.5
257 0 6 8 42.04 84.08 0.435 3.03 4 48.2 6.2
258 3 3 7 42.043 84.087 0.435 3.03 4 48.3 6.2
259 3 5 -6 42.056 84.112 0.435 3.03 4 24.2 1.6
260 3 5 4 42.062 84.124 0.435 3.03 4 60.2 9.7
261 2 2 10 42.193 84.385 0.436 3.02 4 15.5 0.6
262 0 2 12 42.339 84.677 0.437 3.01 4 9.0 0.2
263 2 4 -10 42.638 85.276 0.44 2.98 4 13.6 0.5
264 1 5 9 42.645 85.289 0.44 2.98 4 2.2 0.0
265 1 7 5 42.646 85.293 0.44 2.98 4 2.7 0.0
266 4 2 4 42.647 85.293 0.44 2.98 4 25.3 1.7
267 0 8 0 42.797 85.595 0.441 2.97 2 13.8 0.3
268 4 4 -1 42.813 85.627 0.441 2.97 4 16.0 0.7
269 4 4 -2 42.869 85.738 0.442 2.96 4 10.3 0.3
270 2 6 -7 42.962 85.923 0.442 2.96 4 47.2 5.8
271 0 8 1 42.967 85.934 0.442 2.96 4 20.2 1.1
272 4 0 5 42.967 85.935 0.442 2.96 2 56.8 4.2
273 2 0 -12 43.012 86.024 0.443 2.95 2 56.4 4.1
274 1 3 11 43.02 86.04 0.443 2.95 4 59.8 9.3
275 4 4 0 43.097 86.193 0.443 2.95 4 14.7 0.6
276 4 2 -7 43.259 86.517 0.445 2.93 4 32.9 2.8
277 4 4 -3 43.263 86.527 0.445 2.93 4 3.7 0.0
278 1 7 -6 43.265 86.531 0.445 2.93 4 0.8 0.0
279 0 4 11 43.413 86.827 0.446 2.92 4 62.0 9.9
280 0 8 2 43.475 86.95 0.447 2.92 4 18.6 0.9
281 4 0 -8 43.69 87.38 0.448 2.9 2 66.2 5.6
282 2 6 6 43.701 87.402 0.448 2.9 4 65.7 11.1
283 1 5 -10 43.713 87.426 0.449 2.9 4 15.2 0.6
284 1 1 12 43.715 87.43 0.449 2.9 4 28.8 2.1
285 4 4 1 43.718 87.436 0.449 2.9 4 22.5 1.3
286 2 4 9 43.719 87.437 0.449 2.9 4 20.6 1.1
287 3 5 -7 43.919 87.838 0.45 2.89 4 11.7 0.3
288 3 5 5 43.927 87.854 0.45 2.89 4 32.6 2.7
289 4 4 -4 43.996 87.992 0.451 2.88 4 4.5 0.1
290 1 3 -12 44.312 88.625 0.453 2.87 4 19.0 0.9
291 2 0 11 44.319 88.638 0.454 2.87 2 21.4 0.6
292 0 8 3 44.321 88.641 0.454 2.86 4 3.2 0.0
293 1 7 6 44.621 89.242 0.456 2.85 4 50.4 6.4
294 4 2 5 44.622 89.244 0.456 2.85 4 28.3 2.0
295 2 2 -12 44.667 89.333 0.456 2.85 4 37.6 3.6
296 4 4 2 44.677 89.354 0.456 2.85 4 23.3 1.4
297 3 1 -11 44.816 89.631 0.458 2.84 4 20.4 1.0
298 3 1 9 44.828 89.657 0.458 2.84 4 38.2 3.6
299 3 3 -10 44.911 89.822 0.458 2.83 4 30.0 2.3
300 0 0 13 44.915 89.829 0.458 2.83 2 31.8 1.3
301 0 6 9 44.919 89.837 0.458 2.83 4 34.7 3.0
302 3 3 8 44.922 89.845 0.458 2.83 4 32.8 2.7
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 3.113 6.227 14.18257 223.3 35.8 36.6 5.5
2 0 0 2 6.236 12.472 7.09129 325.2 52.2 53.1 5.6
3 0 0 3 9.377 18.755 4.72752 459.2 73.7 74.7 5.6
4 0 2 0 9.779 19.558 4.535 260.3 41.8 42.3 5.6
5 1 1 0 9.835 19.67 4.50964 10.2 1.6 1.7 5.6
6 1 1 -1 10.0 20.0 4.43579 124.9 20.0 20.3 5.6
7 0 2 1 10.272 20.544 4.31955 92.1 14.8 15.0 5.6
8 1 1 1 10.641 21.281 4.1716 363.8 58.4 59.1 5.6
9 0 2 2 11.631 23.263 3.82054 49.8 8.0 8.1 5.6
10 1 1 2 12.236 24.471 3.63458 136.9 22.0 22.2 5.6
11 0 0 4 12.547 25.095 3.54564 316.9 50.9 51.3 5.6
12 1 1 -3 12.896 25.793 3.45127 147.3 23.6 23.8 5.6
13 0 2 3 13.613 27.227 3.27268 18.9 3.0 3.1 5.6
14 1 1 -4 15.171 30.343 2.94329 91.8 14.7 14.8 5.6
15 0 0 5 15.757 31.514 2.83651 102.7 16.5 16.5 5.6
16 0 2 4 16.008 32.015 2.79325 36.8 5.9 5.9 5.6
17 1 1 4 16.874 33.747 2.65374 15.5 2.5 2.5 5.7
18 1 3 -1 17.242 34.483 2.59876 9.6 1.5 1.5 5.7
19 1 3 1 17.636 35.273 2.54238 153.7 24.7 24.7 5.7
20 1 3 -2 17.926 35.852 2.50263 623.0 100.0 100.0 5.7
21 1 3 2 18.683 37.366 2.40461 352.1 56.5 56.4 5.7
22 0 0 6 19.018 38.037 2.36376 12.1 1.9 1.9 5.7
23 1 3 -3 19.141 38.282 2.3492 137.1 22.0 22.0 5.7
24 2 2 0 19.975 39.951 2.25482 21.8 3.5 3.5 5.7
25 0 4 1 20.122 40.244 2.23906 7.9 1.3 1.3 5.7
26 1 3 3 20.209 40.418 2.22981 118.9 19.1 19.0 5.7
27 1 1 -6 20.579 41.157 2.19147 6.4 1.0 1.0 5.7
28 1 3 -4 20.808 41.615 2.16838 37.9 6.1 6.0 5.7
29 0 4 2 20.895 41.789 2.15977 28.2 4.5 4.5 5.7
30 2 2 -3 21.256 42.511 2.12474 16.0 2.6 2.6 5.7
31 0 2 6 21.56 43.121 2.09612 7.0 1.1 1.1 5.7
32 1 3 4 22.133 44.267 2.04446 15.4 2.5 2.5 5.7
33 0 0 7 22.345 44.69 2.02608 37.9 6.1 6.0 5.7
34 1 1 6 22.56 45.12 2.00776 26.6 4.3 4.2 5.7
35 2 2 -4 22.637 45.273 2.00133 33.4 5.4 5.3 5.7
36 1 3 -5 22.848 45.696 1.98378 330.0 53.0 52.4 5.7
37 0 4 4 23.78 47.561 1.91027 7.5 1.2 1.2 5.7
38 1 3 5 24.386 48.772 1.86563 110.1 17.7 17.4 5.7
39 2 2 4 25.079 50.157 1.81729 31.5 5.1 5.0 5.7
40 1 3 -6 25.197 50.394 1.80932 164.0 26.3 25.9 5.8
41 1 1 7 25.659 51.319 1.77886 8.4 1.4 1.3 5.8
42 0 0 8 25.753 51.506 1.77282 8.2 1.3 1.3 5.8
43 2 2 -6 26.511 53.023 1.72564 10.6 1.7 1.7 5.8
44 3 1 -1 26.702 53.404 1.71421 33.5 5.4 5.3 5.8
45 2 4 0 26.797 53.594 1.70857 12.1 1.9 1.9 5.8
46 1 3 6 26.914 53.827 1.70173 19.5 3.1 3.1 5.8
47 1 5 1 27.077 54.154 1.69223 45.5 7.3 7.2 5.8
48 2 4 -3 27.832 55.664 1.64985 47.2 7.6 7.4 5.8
49 0 4 6 28.082 56.164 1.63634 32.1 5.2 5.0 5.8
50 2 4 2 28.174 56.348 1.63141 26.6 4.3 4.2 5.8
51 1 5 -4 29.44 58.881 1.56715 27.6 4.4 4.3 5.8
52 1 3 7 29.682 59.363 1.55555 274.5 44.1 42.9 5.8
53 2 2 6 29.77 59.54 1.55135 8.0 1.3 1.3 5.8
54 3 1 -5 29.938 59.877 1.54344 7.4 1.2 1.2 5.8
55 2 4 -5 30.48 60.96 1.51857 6.3 1.0 1.0 5.8
56 3 3 -1 30.632 61.264 1.51176 359.9 57.8 56.0 5.8
57 0 6 2 31.4 62.8 1.47845 112.6 18.1 17.5 5.9
58 2 2 -8 31.562 63.123 1.47164 25.5 4.1 4.0 5.9
59 3 1 4 31.674 63.348 1.46696 22.0 3.5 3.4 5.9
60 3 3 2 32.342 64.684 1.43985 49.6 8.0 7.7 5.9
61 1 3 8 32.672 65.345 1.42688 9.4 1.5 1.5 5.9
62 0 0 10 32.896 65.792 1.41826 17.7 2.8 2.7 5.9
63 0 4 8 33.472 66.944 1.39663 8.5 1.4 1.3 5.9
64 3 3 3 33.638 67.276 1.39053 24.9 4.0 3.8 5.9
65 3 1 5 33.72 67.44 1.38756 175.0 28.1 27.0 5.9
66 2 4 -7 34.463 68.925 1.36124 20.6 3.3 3.2 5.9
67 3 3 -6 35.263 70.525 1.33422 19.8 3.2 3.0 5.9
68 2 2 8 35.487 70.975 1.32687 14.1 2.3 2.2 5.9
69 1 3 9 35.882 71.764 1.3142 6.5 1.0 1.0 5.9
70 2 6 0 36.121 72.242 1.30669 13.7 2.2 2.1 5.9
71 2 6 -2 36.356 72.713 1.29938 67.9 10.9 10.4 6.0
72 2 6 1 36.534 73.069 1.29392 49.6 8.0 7.6 6.0
73 2 4 -8 36.9 73.801 1.28289 7.1 1.1 1.1 6.0
74 2 6 -3 37.003 74.005 1.27985 80.8 13.0 12.3 6.0
75 3 3 -7 37.212 74.424 1.27368 14.1 2.3 2.2 6.0
76 2 6 2 37.297 74.595 1.27119 62.6 10.0 9.5 6.0
77 3 5 -1 37.762 75.524 1.25784 16.5 2.6 2.5 6.0
78 3 5 0 37.937 75.874 1.2529 6.8 1.1 1.0 6.0
79 4 2 0 38.072 76.143 1.24914 18.4 3.0 2.8 6.0
80 1 7 2 38.711 77.422 1.23168 21.0 3.4 3.2 6.0
81 1 7 -3 38.998 77.996 1.22404 11.4 1.8 1.7 6.0
82 1 3 10 39.322 78.645 1.21556 70.2 11.3 10.6 6.0
83 3 3 -8 39.47 78.939 1.21176 10.0 1.6 1.5 6.0
84 2 6 4 39.842 79.683 1.20231 29.1 4.7 4.4 6.0
85 4 2 -5 40.082 80.165 1.19629 13.7 2.2 2.1 6.0
86 1 5 -9 40.598 81.196 1.18368 6.4 1.0 1.0 6.1
87 0 0 12 40.673 81.346 1.18188 19.6 3.2 2.9 6.1
88 2 6 -6 40.979 81.958 1.1746 43.1 6.9 6.5 6.1
89 2 6 5 41.608 83.217 1.16 41.7 6.7 6.2 6.1
90 3 5 4 42.062 84.124 1.14978 30.2 4.8 4.5 6.1
91 2 6 -7 42.962 85.923 1.13026 11.1 1.8 1.6 6.1
92 1 3 11 43.02 86.04 1.12902 13.4 2.2 2.0 6.1
93 0 4 11 43.413 86.827 1.12081 9.9 1.6 1.5 6.1
94 2 6 6 43.701 87.402 1.11491 21.8 3.5 3.2 6.2
95 1 7 6 44.621 89.242 1.09662 8.4 1.3 1.2 6.2
96 3 3 8 44.922 89.845 1.09082 9.2 1.5 1.4 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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