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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CLINOZOISITE
5, t-epidote, f-epidote, s-epidote, ZL
Ca(2)Al(3)[Si(3)O(12)](OH)
Monoclinic P 2(1)/m Z = 2
P2(1)/m
25 .9 .1901
Ref.Str.:
B. Winkler, V. Milman, R.H. Nobes (2001)
* Phys. Chem. Minerals, 28, 471-474
Reserv:
A theoretical investigation. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.7767 alpha = 90.0
b = 5.5734 beta = 115.72
c = 10.1569 gamma = 90.0
Unit cell volume (cub. angs.) = 447.61
Molar volume ( cub.cm/mol.) = 134.81
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.7627 0.75 0.1553 0.0 Ca = 1.00
2 0.6064 0.75 0.4164 0.0 Ca = 1.00
3 0.3341 0.75 0.0417 0.0 Si = 1.00
4 0.6761 0.25 0.2744 0.0 Si = 1.00
5 0.1808 0.75 0.314 0.0 Si = 1.00
6 0.0 0.0 0.0 0.0 Al = 1.00
7 0.0 0.0 0.5 0.0 Al = 1.00
8 0.2875 0.25 0.2308 0.0 Al = 1.00
9 0.2308 0.9904 0.0392 0.0 O = 1.00
10 0.2977 0.9844 0.3491 0.0 O = 1.00
11 0.7854 0.0175 0.3491 0.0 O = 1.00
12 0.0608 0.25 0.1319 0.0 O = 1.00
13 0.0421 0.75 0.1436 0.0 O = 1.00
14 0.0597 0.75 0.3977 0.0 O = 1.00
15 0.5124 0.75 0.1695 0.0 O = 1.00
16 0.5049 0.25 0.2863 0.0 O = 1.00
17 0.6478 0.25 0.1087 0.0 O = 1.00
18 0.0732 0.25 0.4243 0.0 O = 1.00
19 0.0484 0.25 0.3185 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.7627 0.75 0.1553
2 2 0.6064 0.75 0.4164
3 3 0.3341 0.75 0.0417
4 4 0.6761 0.25 0.2744
5 5 0.1808 0.75 0.314
6 6 0.0 0.0 0.0
7 7 0.0 0.0 0.5
8 8 0.2875 0.25 0.2308
9 9 0.2308 0.9904 0.0392
10 10 0.2977 0.9844 0.3491
11 11 0.7854 0.0175 0.3491
12 12 0.0608 0.25 0.1319
13 13 0.0421 0.75 0.1436
14 14 0.0597 0.75 0.3977
15 15 0.5124 0.75 0.1695
16 16 0.5049 0.25 0.2863
17 17 0.6478 0.25 0.1087
18 18 0.0732 0.25 0.4243
19 19 0.0484 0.25 0.3185
20 1 0.2373 0.25 0.8447
21 2 0.3936 0.25 0.5836
22 3 0.6659 0.25 0.9583
23 4 0.3239 0.75 0.7256
24 5 0.8191 0.25 0.686
25 6 0.0 0.5 0.0
26 7 0.0 0.5 0.5
27 8 0.7125 0.75 0.7692
28 9 0.7692 0.4904 0.9608
29 10 0.7023 0.4844 0.6509
30 11 0.2146 0.5175 0.6509
31 12 0.9392 0.75 0.8681
32 13 0.9579 0.25 0.8564
33 14 0.9403 0.25 0.6023
34 15 0.4876 0.25 0.8305
35 16 0.4951 0.75 0.7137
36 17 0.3522 0.75 0.8913
37 18 0.9268 0.75 0.5757
38 19 0.9516 0.75 0.6816
39 9 0.2308 0.5096 0.0392
40 10 0.2977 0.5156 0.3491
41 11 0.7854 0.4825 0.3491
42 9 0.7692 0.0096 0.9608
43 10 0.7023 0.0156 0.6509
44 11 0.2146 0.9825 0.6509
X-ray density (g/cm cub.) = 3.37
MU (1/cm) = 181.112 Mass attenuation coefficient (cm**2/g) = 53.742
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca 2.88 7
2.4077 11
2.5062 13
2.6997 14
2.2633 15
2.4692 9
2.4077 11
2.4692 9
2 Ca 2.88 8
2.8121 10
2.4675 11
2.274 15
2.6138 10
2.5646 18
2.8121 10
2.4675 11
2.6138 10
3 Si 2.1 4
1.6116 9
1.5396 15
1.6032 17
1.6116 9
4 Si 2.1 4
1.5946 11
1.5579 16
1.5916 17
1.5946 11
5 Si 2.1 4
1.6025 10
1.627 13
1.624 14
1.6025 10
6 Al 2.316 6
1.8881 9
1.844 12
1.9336 13
1.844 12
1.9336 13
1.8881 9
7 Al 2.316 6
1.8443 11
1.9414 14
1.8371 18
1.9414 14
1.8371 18
1.8443 11
8 Al 2.316 6
2.2995 9
1.8842 10
1.7984 12
1.7398 16
2.2995 9
1.8842 10
9 O 3.264 10
2.9413 10
2.5351 12
2.681 13
2.6105 15
2.9899 16
2.7393 12
2.7239 13
2.5644 17
2.8937 9
2.6797 9
10 O 3.264 8
2.9413 9
2.7208 12
2.6516 13
2.6844 14
2.6296 16
2.8216 18
2.9607 10
2.6127 10
11 O 3.264 9
2.6894 14
2.7381 15
2.604 16
2.5573 17
2.6399 18
2.6661 14
2.5659 18
2.5916 11
2.9818 11
12 O 3.264 10
2.5351 9
2.7208 10
2.7971 13
2.7971 13
2.9238 18
2.7393 9
2.5405 13
2.5351 9
2.7208 10
2.7393 9
13 O 3.264 10
2.681 9
2.6516 10
2.7971 12
2.7971 12
2.5169 14
2.7239 9
2.5405 12
2.681 9
2.6516 10
2.7239 9
14 O 3.264 10
2.6844 10
2.6894 11
2.5169 13
2.7973 18
2.7973 18
2.6661 11
2.5423 18
2.6844 10
2.6894 11
2.6661 11
15 O 3.264 9
2.6105 9
2.7381 11
3.0403 16
3.0403 16
3.1934 17
3.1934 17
2.5522 17
2.6105 9
2.7381 11
16 O 3.264 9
2.9899 9
2.6296 10
2.604 11
3.0403 15
3.0403 15
2.6055 17
2.9899 9
2.6296 10
2.604 11
17 O 3.264 8
2.5573 11
3.1934 15
3.1934 15
2.6055 16
2.5644 9
2.5522 15
2.5573 11
2.5644 9
18 O 3.264 10
2.8216 10
2.6399 11
2.9238 12
2.7973 14
2.7973 14
2.5659 11
2.5423 14
2.8216 10
2.6399 11
2.5659 11
19 H 1.632 1
0.9997 18
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 4.829 9.658 0.055 279.27 2 5.8 9.3
2 1 0 -1 5.581 11.162 0.063 208.48 2 3.2 2.1
3 1 0 0 5.59 11.181 0.063 207.78 2 23.2 111.9
4 1 0 -2 8.837 17.673 0.1 81.82 2 50.6 209.0
5 1 0 1 8.854 17.709 0.1 81.48 2 1.8 0.3
6 0 1 1 9.313 18.626 0.105 73.45 4 19.6 56.6
7 0 0 2 9.692 19.384 0.109 67.64 2 4.5 1.4
8 1 1 -1 9.729 19.459 0.11 67.11 4 6.3 5.3
9 1 1 0 9.735 19.47 0.11 67.03 4 1.7 0.4
10 2 0 -1 10.109 20.219 0.114 62.0 2 16.4 16.6
11 2 0 -2 11.216 22.432 0.126 49.97 2 43.2 93.0
12 2 0 0 11.235 22.47 0.126 49.79 2 51.3 130.9
13 1 1 -2 11.925 23.851 0.134 43.96 4 3.7 1.2
14 1 1 1 11.939 23.878 0.134 43.86 4 28.3 69.9
15 0 1 2 12.581 25.162 0.141 39.29 4 2.9 0.7
16 2 1 -1 12.909 25.819 0.145 37.21 4 56.1 233.5
17 1 0 -3 13.17 26.34 0.148 35.67 2 11.4 4.7
18 1 0 2 13.19 26.38 0.148 35.56 2 57.8 118.6
19 2 1 -2 13.804 27.609 0.155 32.29 4 2.8 0.5
20 2 1 0 13.82 27.64 0.155 32.21 4 0.2 0.0
21 2 0 -3 14.061 28.122 0.158 31.05 2 30.4 28.6
22 2 0 1 14.092 28.183 0.158 30.91 2 71.5 157.7
23 0 0 3 14.628 29.255 0.164 28.54 2 45.8 59.8
24 1 1 -3 15.455 30.91 0.173 25.37 4 132.2 885.3
25 3 0 -2 15.459 30.918 0.173 25.35 2 88.5 198.2
26 3 0 -1 15.469 30.939 0.173 25.31 2 22.6 12.9
27 1 1 2 15.472 30.945 0.173 25.3 4 6.7 2.3
28 0 2 0 16.046 32.092 0.179 23.39 2 118.2 326.3
29 2 1 -3 16.231 32.463 0.181 22.82 4 21.9 21.8
30 2 1 1 16.258 32.516 0.182 22.74 4 58.5 155.2
31 0 1 3 16.731 33.462 0.187 21.37 4 76.3 248.1
32 0 2 1 16.795 33.59 0.188 21.19 4 13.0 7.1
33 3 0 -3 16.963 33.927 0.189 20.74 2 1.2 0.0
34 3 0 0 16.993 33.985 0.19 20.66 2 81.3 136.3
35 1 2 -1 17.039 34.078 0.19 20.54 4 20.6 17.3
36 1 2 0 17.042 34.084 0.19 20.53 4 61.2 153.6
37 3 1 -2 17.472 34.945 0.195 19.44 4 15.4 9.2
38 3 1 -1 17.482 34.964 0.195 19.42 4 89.0 307.1
39 2 0 -4 17.893 35.786 0.199 18.46 2 6.0 0.7
40 1 0 -4 17.893 35.786 0.199 18.46 2 62.4 71.7
41 1 0 3 17.914 35.829 0.2 18.41 2 11.5 2.4
42 2 0 2 17.93 35.86 0.2 18.37 2 80.4 118.7
43 1 2 -2 18.435 36.87 0.205 17.29 4 62.0 132.9
44 1 2 1 18.444 36.888 0.205 17.27 4 6.6 1.5
45 3 1 -3 18.835 37.67 0.21 16.49 4 82.4 223.8
46 3 1 0 18.861 37.723 0.21 16.44 4 1.5 0.1
47 0 2 2 18.884 37.767 0.21 16.39 4 80.2 210.3
48 2 2 -1 19.113 38.226 0.213 15.96 4 41.9 55.9
49 3 0 -4 19.677 39.353 0.219 14.97 2 10.1 1.5
50 0 0 4 19.677 39.353 0.219 14.97 2 20.8 6.5
51 2 1 -4 19.688 39.375 0.219 14.95 4 10.1 3.1
52 1 1 -4 19.688 39.375 0.219 14.95 4 15.1 6.8
53 1 1 3 19.708 39.415 0.219 14.92 4 26.9 21.5
54 3 0 1 19.719 39.438 0.219 14.9 2 4.1 0.2
55 2 1 2 19.722 39.443 0.219 14.89 4 19.5 11.3
56 2 2 -2 19.754 39.509 0.219 14.84 4 68.6 139.3
57 2 2 0 19.766 39.532 0.22 14.82 4 0.2 0.0
58 4 0 -2 20.552 41.104 0.228 13.59 2 20.9 5.9
59 1 2 -3 20.99 41.981 0.233 12.96 4 39.2 39.7
60 1 2 2 21.004 42.008 0.233 12.94 4 8.6 1.9
61 4 0 -3 21.151 42.303 0.234 12.74 2 49.6 31.2
62 4 0 -1 21.173 42.346 0.234 12.71 2 85.9 93.7
63 3 1 -4 21.344 42.689 0.236 12.48 4 2.9 0.2
64 0 1 4 21.344 42.689 0.236 12.48 4 30.3 22.8
65 3 1 1 21.384 42.768 0.237 12.43 4 3.2 0.3
66 2 2 -3 21.593 43.186 0.239 12.16 4 77.1 144.5
67 2 2 1 21.614 43.228 0.239 12.14 4 92.4 206.9
68 0 2 3 21.987 43.975 0.243 11.68 4 68.0 107.7
69 4 1 -2 22.165 44.331 0.245 11.47 4 38.6 34.1
70 2 0 -5 22.296 44.591 0.246 11.32 2 21.8 5.4
71 2 0 3 22.337 44.673 0.247 11.27 2 79.1 70.3
72 3 2 -2 22.581 45.163 0.249 11.0 4 45.8 46.0
73 3 2 -1 22.589 45.178 0.249 10.99 4 39.0 33.3
74 4 1 -3 22.73 45.461 0.251 10.83 4 4.2 0.4
75 4 1 -1 22.751 45.501 0.251 10.81 4 9.8 2.1
76 1 0 -5 22.871 45.741 0.252 10.68 2 40.2 17.2
77 4 0 -4 22.893 45.787 0.253 10.66 2 19.3 3.9
78 1 0 4 22.893 45.787 0.253 10.66 2 44.0 20.6
79 4 0 0 22.933 45.867 0.253 10.62 2 79.1 66.3
80 3 0 -5 23.248 46.496 0.256 10.3 2 52.4 28.2
81 3 0 2 23.3 46.6 0.257 10.24 2 23.7 5.7
82 3 2 -3 23.697 47.395 0.261 9.86 4 26.8 14.2
83 3 2 0 23.719 47.439 0.261 9.84 4 10.6 2.2
84 2 1 -5 23.814 47.629 0.262 9.75 4 8.2 1.3
85 2 1 3 23.853 47.707 0.263 9.71 4 13.8 3.7
86 1 1 -5 24.362 48.723 0.268 9.26 4 43.4 34.8
87 4 1 -4 24.383 48.766 0.268 9.24 4 5.5 0.6
88 1 1 4 24.383 48.766 0.268 9.24 4 58.9 64.0
89 2 2 -4 24.411 48.822 0.268 9.22 4 86.5 137.6
90 1 2 -4 24.411 48.822 0.268 9.22 4 45.4 37.9
91 4 1 0 24.422 48.843 0.268 9.21 4 25.3 11.8
92 1 2 3 24.428 48.855 0.268 9.2 4 15.4 4.4
93 2 2 2 24.44 48.879 0.269 9.19 4 58.1 62.0
94 3 1 -5 24.721 49.443 0.271 8.96 4 22.3 8.9
95 3 1 2 24.771 49.542 0.272 8.91 4 42.2 31.7
96 0 0 5 24.891 49.782 0.273 8.82 2 13.8 1.7
97 0 3 1 25.029 50.058 0.275 8.71 4 14.7 3.8
98 1 3 -1 25.206 50.412 0.276 8.57 4 3.7 0.2
99 1 3 0 25.208 50.417 0.276 8.57 4 19.5 6.5
100 4 0 -5 25.596 51.191 0.28 8.27 2 29.7 7.3
101 4 0 1 25.651 51.302 0.281 8.23 2 9.3 0.7
102 3 2 -4 25.826 51.652 0.283 8.11 4 15.8 4.0
103 0 2 4 25.826 51.652 0.283 8.11 4 42.6 29.4
104 3 2 1 25.86 51.72 0.283 8.08 4 10.7 1.8
105 5 0 -3 26.152 52.303 0.286 7.88 2 21.5 3.6
106 5 0 -2 26.163 52.326 0.286 7.87 2 61.6 29.9
107 1 3 -2 26.242 52.484 0.287 7.82 4 6.9 0.7
108 1 3 1 26.249 52.498 0.287 7.81 4 26.9 11.3
109 0 1 5 26.295 52.591 0.288 7.78 4 43.4 29.3
110 4 2 -2 26.54 53.079 0.29 7.62 4 32.9 16.4
111 0 3 2 26.583 53.166 0.29 7.59 4 1.3 0.0
112 2 3 -1 26.759 53.519 0.292 7.48 4 43.4 28.1
113 4 1 -5 26.974 53.948 0.294 7.34 4 73.1 78.3
114 4 1 1 27.027 54.055 0.295 7.31 4 21.4 6.7
115 4 2 -3 27.035 54.071 0.295 7.3 4 19.3 5.4
116 4 2 -1 27.053 54.106 0.295 7.29 4 20.0 5.8
117 2 0 -6 27.109 54.217 0.296 7.26 2 63.5 29.3
118 5 0 -4 27.153 54.306 0.296 7.23 2 14.5 1.5
119 2 0 4 27.153 54.306 0.296 7.23 2 43.1 13.4
120 5 0 -1 27.186 54.373 0.297 7.21 2 4.8 0.2
121 2 3 -2 27.257 54.513 0.297 7.17 4 0.3 0.0
122 2 3 0 27.265 54.531 0.297 7.17 4 1.3 0.0
123 3 0 -6 27.442 54.885 0.299 7.06 2 59.6 25.0
124 3 0 3 27.502 55.004 0.3 7.03 2 7.1 0.4
125 5 1 -3 27.51 55.021 0.3 7.02 4 22.0 6.8
126 5 1 -2 27.521 55.043 0.3 7.01 4 49.6 34.4
127 2 2 -5 27.995 55.991 0.305 6.75 4 12.1 2.0
128 2 2 3 28.03 56.06 0.305 6.73 4 7.2 0.7
129 1 0 -6 28.102 56.204 0.306 6.69 2 109.9 80.6
130 1 0 5 28.126 56.251 0.306 6.68 2 47.8 15.2
131 1 3 -3 28.235 56.471 0.307 6.62 4 87.6 101.4
132 1 3 2 28.246 56.493 0.307 6.61 4 3.1 0.1
133 2 1 -6 28.436 56.872 0.309 6.51 4 27.8 10.1
134 5 1 -4 28.479 56.958 0.31 6.49 4 10.2 1.3
135 2 1 4 28.479 56.958 0.31 6.49 4 37.2 17.9
136 1 2 -5 28.485 56.969 0.31 6.49 4 2.1 0.1
137 4 2 -4 28.504 57.008 0.31 6.48 4 91.1 107.4
138 1 2 4 28.504 57.008 0.31 6.48 4 79.2 81.2
139 5 1 -1 28.511 57.022 0.31 6.47 4 94.0 114.2
140 4 2 0 28.538 57.077 0.31 6.46 4 55.3 39.4
141 2 3 -3 28.722 57.444 0.312 6.37 4 16.1 3.3
142 2 3 1 28.739 57.478 0.312 6.36 4 46.2 27.1
143 3 1 -6 28.759 57.519 0.312 6.35 4 6.8 0.6
144 3 2 -5 28.808 57.615 0.313 6.32 4 7.8 0.8
145 3 1 3 28.817 57.634 0.313 6.32 4 10.8 1.5
146 3 2 2 28.852 57.705 0.313 6.3 4 50.2 31.7
147 0 3 3 29.043 58.087 0.315 6.21 4 59.3 43.5
148 4 0 -6 29.072 58.145 0.315 6.2 2 139.0 119.5
149 5 0 -5 29.096 58.191 0.316 6.18 2 41.4 10.6
150 4 0 2 29.14 58.281 0.316 6.16 2 2.4 0.0
151 5 0 0 29.149 58.297 0.316 6.16 2 27.2 4.6
152 1 1 -6 29.4 58.799 0.319 6.04 4 28.8 10.0
153 1 1 5 29.423 58.845 0.319 6.03 4 60.6 44.2
154 3 3 -2 29.532 59.064 0.32 5.98 4 25.1 7.5
155 3 3 -1 29.538 59.076 0.32 5.98 4 76.6 70.1
156 0 2 5 30.234 60.469 0.327 5.67 4 3.5 0.1
157 0 0 6 30.336 60.672 0.328 5.63 2 42.1 10.0
158 4 1 -6 30.344 60.688 0.328 5.63 4 12.2 1.7
159 5 1 -5 30.366 60.733 0.328 5.62 4 1.2 0.0
160 4 1 2 30.41 60.82 0.329 5.6 4 70.3 55.3
161 5 1 0 30.418 60.836 0.329 5.6 4 63.7 45.3
162 3 3 -3 30.463 60.926 0.329 5.58 4 57.0 36.2
163 3 3 0 30.482 60.964 0.329 5.57 4 14.5 2.3
164 4 2 -5 30.856 61.711 0.333 5.42 4 31.9 11.0
165 4 2 1 30.905 61.809 0.333 5.4 4 23.3 5.9
166 2 3 -4 31.067 62.135 0.335 5.34 4 2.3 0.1
167 1 3 -4 31.067 62.135 0.335 5.34 4 3.0 0.1
168 1 3 3 31.082 62.163 0.335 5.34 4 9.1 0.9
169 2 3 2 31.092 62.184 0.335 5.33 4 15.7 2.6
170 5 2 -3 31.349 62.698 0.338 5.24 4 6.1 0.4
171 5 2 -2 31.359 62.719 0.338 5.23 4 43.9 20.1
172 0 1 6 31.576 63.153 0.34 5.15 4 22.3 5.1
173 6 0 -3 31.775 63.55 0.342 5.08 2 35.8 6.5
174 5 0 -6 31.873 63.745 0.343 5.05 2 35.1 6.2
175 5 0 1 31.943 63.886 0.343 5.03 2 20.5 2.1
176 3 0 -7 32.149 64.298 0.345 4.96 2 2.1 0.0
177 2 2 -6 32.206 64.412 0.346 4.94 4 64.1 40.5
178 6 0 -4 32.215 64.43 0.346 4.93 2 89.2 39.2
179 3 0 4 32.215 64.43 0.346 4.93 2 54.4 14.6
180 6 0 -2 32.239 64.478 0.346 4.93 2 27.4 3.7
181 5 2 -4 32.246 64.491 0.346 4.92 4 99.2 96.8
182 2 2 4 32.246 64.491 0.346 4.92 4 57.4 32.4
183 5 2 -1 32.276 64.551 0.347 4.91 4 21.1 4.4
184 3 3 -4 32.284 64.568 0.347 4.91 4 3.4 0.1
185 0 3 4 32.284 64.569 0.347 4.91 4 23.1 5.2
186 2 0 -7 32.3 64.599 0.347 4.91 2 6.0 0.2
187 3 3 1 32.314 64.628 0.347 4.9 4 7.7 0.6
188 2 0 5 32.347 64.695 0.347 4.89 2 2.7 0.0
189 3 2 -6 32.506 65.013 0.349 4.84 4 92.3 82.2
190 3 2 3 32.56 65.12 0.349 4.82 4 19.3 3.6
191 4 3 -2 32.907 65.814 0.353 4.71 4 22.6 4.8
192 6 1 -3 32.985 65.97 0.353 4.69 4 0.3 0.0
193 5 1 -6 33.081 66.161 0.354 4.66 4 19.7 3.6
194 1 2 -6 33.104 66.207 0.355 4.65 4 15.6 2.3
195 1 2 5 33.125 66.25 0.355 4.65 4 18.4 3.1
196 5 1 1 33.15 66.299 0.355 4.64 4 24.0 5.3
197 4 0 -7 33.196 66.392 0.355 4.63 2 19.1 1.7
198 4 0 3 33.275 66.549 0.356 4.6 2 60.5 16.8
199 4 3 -3 33.343 66.685 0.357 4.58 4 1.6 0.0
200 3 1 -7 33.352 66.703 0.357 4.58 4 21.8 4.3
201 4 3 -1 33.358 66.717 0.357 4.58 4 10.5 1.0
202 6 1 -4 33.416 66.833 0.357 4.56 4 12.1 1.3
203 3 1 4 33.416 66.833 0.357 4.56 4 1.2 0.0
204 6 1 -2 33.44 66.88 0.358 4.55 4 21.6 4.3
205 2 1 -7 33.5 66.999 0.358 4.54 4 43.5 17.2
206 6 0 -5 33.539 67.078 0.359 4.53 2 37.4 6.3
207 2 1 5 33.547 67.093 0.359 4.52 4 49.6 22.2
208 0 4 0 33.561 67.122 0.359 4.52 2 222.4 223.2
209 6 0 -1 33.586 67.172 0.359 4.51 2 12.3 0.7
210 1 0 -7 33.64 67.279 0.36 4.5 2 31.9 4.6
211 1 0 6 33.665 67.33 0.36 4.49 2 3.2 0.0
212 4 2 -6 33.989 67.978 0.363 4.4 4 30.5 8.2
213 0 4 1 34.0 68.001 0.363 4.4 4 4.3 0.2
214 5 2 -5 34.01 68.021 0.363 4.4 4 1.0 0.0
215 4 2 2 34.051 68.102 0.363 4.39 4 120.5 127.1
216 5 2 0 34.059 68.118 0.364 4.38 4 45.8 18.4
217 1 4 -1 34.147 68.294 0.364 4.36 4 1.2 0.0
218 1 4 0 34.149 68.297 0.364 4.36 4 11.3 1.1
219 2 3 -5 34.194 68.388 0.365 4.35 4 1.7 0.0
220 2 3 3 34.225 68.45 0.365 4.34 4 12.6 1.4
221 4 1 -7 34.38 68.76 0.367 4.3 4 9.0 0.7
222 4 1 3 34.457 68.915 0.367 4.28 4 3.8 0.1
223 1 3 -5 34.631 69.263 0.369 4.23 4 33.7 9.6
224 4 3 -4 34.649 69.298 0.369 4.23 4 7.1 0.4
225 1 3 4 34.649 69.298 0.369 4.23 4 56.5 26.9
226 4 3 0 34.68 69.359 0.369 4.22 4 21.9 4.0
227 6 1 -5 34.717 69.434 0.37 4.21 4 12.9 1.4
228 6 1 -1 34.763 69.527 0.37 4.2 4 31.6 8.4
229 1 1 -7 34.816 69.632 0.371 4.19 4 0.7 0.0
230 1 1 6 34.841 69.682 0.371 4.18 4 13.4 1.5
231 3 3 -5 34.922 69.843 0.372 4.16 4 25.4 5.4
232 3 3 2 34.962 69.924 0.372 4.15 4 23.8 4.7
233 1 4 -2 35.014 70.027 0.372 4.14 4 27.9 6.4
234 1 4 1 35.019 70.039 0.372 4.14 4 2.8 0.1
235 0 2 6 35.153 70.306 0.374 4.11 4 65.9 35.6
236 0 4 2 35.302 70.605 0.375 4.07 4 4.3 0.2
237 5 0 -7 35.387 70.773 0.376 4.05 2 34.3 4.8
238 2 4 -1 35.452 70.904 0.377 4.04 4 8.1 0.5
239 5 0 2 35.473 70.945 0.377 4.03 2 64.8 16.9
240 6 0 -6 35.699 71.398 0.379 3.98 2 11.6 0.5
241 6 0 0 35.767 71.534 0.379 3.97 2 30.2 3.6
242 2 4 -2 35.877 71.754 0.38 3.95 4 25.6 5.2
243 2 4 0 35.885 71.769 0.38 3.94 4 28.7 6.5
244 0 0 7 36.104 72.207 0.382 3.9 2 42.3 6.9
245 0 3 5 36.215 72.429 0.384 3.87 4 39.1 11.8
246 6 2 -3 36.493 72.986 0.386 3.82 4 51.2 20.0
247 5 1 -7 36.538 73.076 0.386 3.81 4 0.2 0.0
248 5 2 -6 36.584 73.169 0.387 3.8 4 38.5 11.3
249 5 1 2 36.623 73.245 0.387 3.79 4 10.1 0.8
250 5 2 1 36.65 73.3 0.387 3.79 4 36.9 10.3
251 1 4 -3 36.722 73.444 0.388 3.77 4 9.8 0.7
252 1 4 2 36.732 73.463 0.388 3.77 4 35.2 9.3
253 4 3 -5 36.783 73.566 0.389 3.76 4 64.9 31.6
254 4 3 1 36.828 73.656 0.389 3.75 4 19.7 2.9
255 3 2 -7 36.844 73.687 0.389 3.75 4 27.3 5.6
256 6 1 -6 36.846 73.692 0.389 3.75 4 21.3 3.4
257 6 2 -4 36.905 73.811 0.39 3.74 4 53.4 21.3
258 3 2 4 36.905 73.811 0.39 3.74 4 14.4 1.6
259 6 1 0 36.914 73.827 0.39 3.74 4 2.0 0.0
260 6 2 -2 36.928 73.856 0.39 3.73 4 69.1 35.6
261 2 2 -7 36.985 73.97 0.391 3.72 4 37.7 10.6
262 2 2 5 37.03 74.06 0.391 3.71 4 35.7 9.4
263 2 4 -3 37.147 74.293 0.392 3.69 4 13.1 1.3
264 2 4 1 37.162 74.323 0.392 3.69 4 46.5 15.9
265 5 3 -3 37.237 74.475 0.393 3.68 4 11.8 1.0
266 0 1 7 37.246 74.492 0.393 3.67 4 55.9 22.9
267 5 3 -2 37.247 74.493 0.393 3.67 4 51.3 19.3
268 3 0 -8 37.352 74.703 0.394 3.66 2 74.3 20.2
269 3 0 5 37.424 74.849 0.394 3.64 2 65.1 15.4
270 0 4 3 37.429 74.858 0.395 3.64 4 23.3 3.9
271 4 2 -7 37.83 75.66 0.398 3.57 4 5.3 0.2
272 3 4 -2 37.86 75.719 0.398 3.57 4 62.8 28.0
273 3 4 -1 37.865 75.73 0.398 3.57 4 12.6 1.1
274 4 2 3 37.905 75.809 0.399 3.56 4 91.4 59.4
275 4 0 -8 37.914 75.828 0.399 3.56 2 39.3 5.5
276 2 0 -8 37.914 75.828 0.399 3.56 2 66.7 15.8
277 2 0 6 37.966 75.932 0.399 3.55 2 44.8 7.1
278 7 0 -4 38.003 76.006 0.4 3.54 2 38.2 5.2
279 4 0 4 38.003 76.006 0.4 3.54 2 58.4 12.1
280 7 0 -3 38.016 76.032 0.4 3.54 2 40.8 5.9
281 2 3 -6 38.03 76.061 0.4 3.54 4 24.5 4.2
282 5 3 -4 38.067 76.135 0.4 3.53 4 3.8 0.1
283 2 3 4 38.067 76.135 0.4 3.53 4 30.9 6.7
284 5 3 -1 38.095 76.191 0.4 3.53 4 88.5 55.2
285 6 2 -5 38.155 76.31 0.401 3.52 4 91.5 58.8
286 6 2 -1 38.199 76.399 0.401 3.51 4 40.6 11.6
287 1 2 -7 38.25 76.501 0.402 3.5 4 4.2 0.1
288 1 2 6 38.274 76.549 0.402 3.5 4 26.7 5.0
289 3 3 -6 38.31 76.62 0.402 3.49 4 1.6 0.0
290 3 3 3 38.36 76.72 0.403 3.49 4 18.6 2.4
291 3 1 -8 38.48 76.961 0.404 3.47 4 7.4 0.4
292 3 1 5 38.553 77.105 0.405 3.46 4 14.1 1.4
293 6 0 -7 38.64 77.281 0.405 3.44 2 4.7 0.1
294 3 4 -3 38.689 77.378 0.406 3.44 4 1.4 0.0
295 3 4 0 38.706 77.411 0.406 3.43 4 57.7 22.9
296 6 0 1 38.729 77.458 0.406 3.43 2 30.0 3.1
297 7 0 -5 38.824 77.648 0.407 3.42 2 24.7 2.1
298 7 0 -2 38.863 77.725 0.407 3.41 2 1.2 0.0
299 1 3 -6 38.868 77.736 0.407 3.41 4 16.1 1.8
300 1 3 5 38.888 77.776 0.408 3.41 4 56.2 21.5
301 4 1 -8 39.037 78.075 0.409 3.38 4 1.5 0.0
302 2 1 -8 39.037 78.075 0.409 3.38 4 5.9 0.2
303 2 1 6 39.089 78.178 0.409 3.38 4 12.4 1.0
304 7 1 -4 39.126 78.251 0.41 3.37 4 25.6 4.4
305 4 1 4 39.126 78.251 0.41 3.37 4 18.0 2.2
306 7 1 -3 39.138 78.277 0.41 3.37 4 4.7 0.1
307 2 4 -4 39.232 78.464 0.411 3.36 4 0.0 0.0
308 1 4 -4 39.232 78.464 0.411 3.36 4 46.7 14.6
309 1 4 3 39.245 78.49 0.411 3.35 4 4.3 0.1
310 2 4 2 39.254 78.509 0.411 3.35 4 68.8 31.7
311 5 0 -8 39.585 79.17 0.414 3.31 2 2.9 0.0
312 1 0 -8 39.585 79.17 0.414 3.31 2 12.7 0.5
313 1 0 7 39.612 79.225 0.414 3.3 2 32.8 3.6
314 5 0 3 39.686 79.371 0.415 3.3 2 2.4 0.0
315 4 3 -6 39.7 79.4 0.415 3.29 4 11.8 0.9
316 5 3 -5 39.72 79.44 0.415 3.29 4 9.2 0.6
317 6 1 -7 39.758 79.515 0.415 3.29 4 70.3 32.5
318 4 3 2 39.759 79.517 0.415 3.29 4 57.9 22.0
319 5 3 0 39.766 79.532 0.415 3.28 4 60.3 23.8
320 6 1 1 39.846 79.691 0.416 3.27 4 5.4 0.2
321 5 2 -7 39.917 79.834 0.417 3.27 4 47.7 14.9
322 7 1 -5 39.94 79.88 0.417 3.26 4 1.3 0.0
323 7 1 -2 39.978 79.956 0.417 3.26 4 8.3 0.5
324 5 2 2 39.999 79.999 0.417 3.25 4 11.3 0.8
325 6 2 -6 40.217 80.434 0.419 3.23 4 31.7 6.5
326 6 2 0 40.283 80.565 0.42 3.22 4 7.4 0.3
327 3 4 -4 40.338 80.676 0.42 3.21 4 21.5 3.0
328 0 4 4 40.338 80.676 0.42 3.21 4 1.1 0.0
329 3 4 1 40.365 80.731 0.42 3.21 4 3.1 0.1
330 7 0 -6 40.464 80.928 0.421 3.2 2 12.0 0.5
331 7 0 -1 40.528 81.056 0.422 3.19 2 13.6 0.6
332 0 2 7 40.606 81.212 0.422 3.18 4 85.8 46.7
333 5 1 -8 40.695 81.39 0.423 3.17 4 16.8 1.8
334 1 1 -8 40.695 81.391 0.423 3.17 4 0.7 0.0
335 1 1 7 40.723 81.445 0.423 3.17 4 17.5 1.9
336 5 1 3 40.795 81.591 0.424 3.16 4 4.6 0.1
337 0 3 6 40.803 81.605 0.424 3.16 4 15.4 1.5
338 4 4 -2 40.91 81.82 0.425 3.15 4 1.8 0.0
339 4 4 -3 41.312 82.625 0.429 3.11 4 25.6 4.1
340 4 4 -1 41.327 82.654 0.429 3.1 4 48.5 14.6
341 7 1 -6 41.569 83.138 0.431 3.08 4 25.7 4.1
342 7 1 -1 41.633 83.265 0.431 3.07 4 8.5 0.4
343 3 2 -8 41.813 83.626 0.433 3.06 4 34.9 7.4
344 3 2 5 41.884 83.768 0.433 3.05 4 40.2 9.8
345 6 3 -3 42.084 84.169 0.435 3.03 4 2.3 0.0
346 2 4 -5 42.105 84.209 0.435 3.03 4 12.3 0.9
347 2 4 3 42.133 84.267 0.435 3.03 4 42.1 10.7
348 5 3 -6 42.172 84.344 0.436 3.02 4 10.9 0.7
349 5 3 1 42.236 84.471 0.436 3.02 4 27.7 4.6
350 6 0 -8 42.332 84.664 0.437 3.01 2 54.1 8.8
351 0 0 8 42.332 84.664 0.437 3.01 2 15.7 0.7
352 4 2 -8 42.36 84.72 0.437 3.01 4 32.1 6.2
353 2 2 -8 42.36 84.72 0.437 3.01 4 14.7 1.3
354 2 2 6 42.41 84.821 0.438 3.0 4 16.2 1.6
355 3 3 -7 42.422 84.844 0.438 3.0 4 24.4 3.6
356 6 0 2 42.44 84.881 0.438 3.0 2 18.2 1.0
357 7 2 -4 42.447 84.893 0.438 3.0 4 4.7 0.1
358 4 2 4 42.447 84.893 0.438 3.0 4 22.8 3.1
359 7 2 -3 42.459 84.918 0.438 3.0 4 59.9 21.4
360 6 3 -4 42.481 84.963 0.438 3.0 4 12.6 0.9
361 3 3 4 42.482 84.963 0.438 3.0 4 8.5 0.4
362 6 3 -2 42.503 85.006 0.439 2.99 4 23.1 3.2
363 1 4 -5 42.514 85.028 0.439 2.99 4 23.3 3.2
364 4 4 -4 42.53 85.061 0.439 2.99 4 12.4 0.9
365 1 4 4 42.53 85.061 0.439 2.99 4 27.7 4.6
366 2 3 -7 42.558 85.117 0.439 2.99 4 36.5 7.9
367 4 4 0 42.559 85.119 0.439 2.99 4 48.9 14.2
368 2 3 5 42.602 85.203 0.439 2.99 4 46.6 12.9
369 3 4 -5 42.787 85.574 0.441 2.97 4 31.5 5.9
370 3 4 2 42.825 85.65 0.441 2.97 4 14.8 1.3
371 7 0 -7 42.904 85.809 0.442 2.96 2 15.1 0.7
372 7 0 0 42.993 85.986 0.443 2.95 2 22.4 1.5
373 6 2 -7 43.069 86.137 0.443 2.95 4 2.2 0.0
374 3 0 -9 43.119 86.239 0.444 2.94 2 20.0 1.2
375 6 2 1 43.155 86.311 0.444 2.94 4 13.2 1.0
376 3 0 6 43.201 86.401 0.444 2.94 2 10.7 0.3
377 7 2 -5 43.248 86.496 0.445 2.94 4 7.5 0.3
378 4 0 -9 43.256 86.511 0.445 2.93 2 16.5 0.8
379 7 2 -2 43.286 86.572 0.445 2.93 4 19.8 2.3
380 4 0 5 43.357 86.713 0.446 2.93 2 14.5 0.6
381 4 3 -7 43.376 86.752 0.446 2.93 4 10.5 0.6
382 6 1 -8 43.429 86.859 0.446 2.92 4 37.0 8.0
383 0 1 8 43.429 86.859 0.446 2.92 4 51.4 15.4
384 4 3 3 43.448 86.896 0.446 2.92 4 4.8 0.1
385 6 1 2 43.538 87.075 0.447 2.91 4 14.2 1.2
386 6 3 -5 43.691 87.383 0.448 2.9 4 16.6 1.6
387 6 3 -1 43.735 87.469 0.449 2.9 4 27.1 4.3
388 1 3 -7 43.784 87.569 0.449 2.9 4 7.2 0.3
389 1 3 6 43.808 87.615 0.449 2.9 4 18.2 1.9
390 5 2 -8 43.994 87.989 0.451 2.88 4 68.1 26.7
391 1 2 -8 43.995 87.989 0.451 2.88 4 59.0 20.1
392 7 1 -7 44.001 88.001 0.451 2.88 4 61.1 21.5
393 0 4 5 44.012 88.025 0.451 2.88 4 8.8 0.4
394 1 2 7 44.022 88.043 0.451 2.88 4 11.5 0.8
395 2 0 -9 44.072 88.144 0.451 2.88 2 50.5 7.3
396 7 1 0 44.089 88.178 0.452 2.88 4 78.0 34.9
397 5 2 3 44.094 88.187 0.452 2.88 4 1.3 0.0
398 0 5 1 44.118 88.236 0.452 2.88 4 11.7 0.8
399 2 0 7 44.13 88.259 0.452 2.88 2 51.5 7.6
400 3 1 -9 44.215 88.43 0.453 2.87 4 18.8 2.0
401 1 5 -1 44.254 88.508 0.453 2.87 4 4.9 0.1
402 1 5 0 44.256 88.512 0.453 2.87 4 11.0 0.7
403 3 1 6 44.296 88.592 0.453 2.87 4 53.5 16.4
404 4 1 -9 44.351 88.702 0.454 2.86 4 73.3 30.7
405 4 1 5 44.452 88.904 0.455 2.86 4 31.8 5.8
406 5 0 -9 44.48 88.96 0.455 2.86 2 3.8 0.0
407 4 4 -5 44.556 89.112 0.455 2.85 4 13.1 1.0
408 8 0 -4 44.597 89.194 0.456 2.85 2 19.2 1.0
409 5 0 4 44.597 89.194 0.456 2.85 2 2.5 0.0
410 4 4 1 44.599 89.199 0.456 2.85 4 1.0 0.0
411 7 2 -6 44.861 89.721 0.458 2.84 4 27.8 4.4
412 7 2 -1 44.924 89.847 0.458 2.83 4 21.0 2.5
413 8 0 -5 44.989 89.977 0.459 2.83 2 30.9 2.7
414 5 4 -3 44.993 89.986 0.459 2.83 4 8.5 0.4
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 1 0 0 5.59 11.181 7.90715 114.0 10.4 10.5 5.6
2 1 0 -2 8.837 17.673 5.01423 209.3 19.0 19.2 5.6
3 0 1 1 9.313 18.626 4.75999 56.6 5.1 5.2 5.6
4 2 0 -1 10.109 20.219 4.38834 16.6 1.5 1.5 5.6
5 2 0 0 11.235 22.47 3.95358 223.9 20.4 20.5 5.6
6 1 1 1 11.939 23.878 3.72354 71.1 6.5 6.5 5.6
7 2 1 -1 12.909 25.819 3.44785 233.5 21.3 21.3 5.6
8 1 0 2 13.19 26.38 3.37569 123.3 11.2 11.3 5.6
9 2 0 -3 14.061 28.122 3.17043 28.6 2.6 2.6 5.6
10 2 0 1 14.092 28.183 3.1637 157.7 14.4 14.4 5.6
11 0 0 3 14.628 29.255 3.0502 59.8 5.4 5.4 5.6
12 1 1 -3 15.455 30.91 2.89056 1098.7 100.0 100.0 5.6
13 0 2 0 16.046 32.092 2.7867 326.3 29.7 29.7 5.6
14 2 1 1 16.258 32.516 2.75133 177.1 16.1 16.1 5.6
15 0 1 3 16.731 33.462 2.67571 248.1 22.6 22.5 5.7
16 3 0 0 16.993 33.985 2.63572 136.3 12.4 12.4 5.7
17 1 2 0 17.042 34.084 2.62825 170.9 15.6 15.5 5.7
18 3 1 -1 17.482 34.964 2.56414 316.3 28.8 28.7 5.7
19 1 0 -4 17.893 35.786 2.50711 74.1 6.7 6.7 5.7
20 2 0 2 17.93 35.86 2.50212 118.7 10.8 10.8 5.7
21 1 2 -2 18.435 36.87 2.4358 134.4 12.2 12.2 5.7
22 3 1 -3 18.835 37.67 2.38594 223.8 20.4 20.2 5.7
23 0 2 2 18.884 37.767 2.38 210.3 19.1 19.0 5.7
24 2 2 -1 19.113 38.226 2.35246 55.9 5.1 5.1 5.7
25 1 1 3 19.708 39.415 2.28422 51.0 4.6 4.6 5.7
26 2 2 -2 19.754 39.509 2.279 139.3 12.7 12.6 5.7
27 1 2 -3 20.99 41.981 2.15035 41.7 3.8 3.8 5.7
28 4 0 -1 21.173 42.346 2.13266 124.9 11.4 11.2 5.7
29 0 1 4 21.344 42.689 2.11631 22.8 2.1 2.1 5.7
30 2 2 1 21.614 43.228 2.09115 351.4 32.0 31.6 5.7
31 0 2 3 21.987 43.975 2.05736 107.7 9.8 9.7 5.7
32 4 1 -2 22.165 44.331 2.04165 34.1 3.1 3.1 5.7
33 2 0 3 22.337 44.673 2.02679 70.3 6.4 6.3 5.7
34 3 2 -2 22.581 45.163 2.00597 79.4 7.2 7.1 5.7
35 1 0 4 22.893 45.787 1.98007 41.7 3.8 3.7 5.7
36 4 0 0 22.933 45.867 1.97679 66.3 6.0 5.9 5.7
37 3 0 -5 23.248 46.496 1.95151 28.2 2.6 2.5 5.7
38 3 2 -3 23.697 47.395 1.91656 16.4 1.5 1.5 5.7
39 2 2 -4 24.411 48.822 1.86383 291.0 26.5 26.0 5.7
40 2 2 2 24.44 48.879 1.86177 62.0 5.6 5.5 5.7
41 3 1 2 24.771 49.542 1.8384 31.7 2.9 2.8 5.7
42 0 2 4 25.826 51.652 1.76817 33.5 3.0 3.0 5.8
43 5 0 -2 26.163 52.326 1.74696 33.5 3.0 3.0 5.8
44 1 3 1 26.249 52.498 1.74165 11.3 1.0 1.0 5.8
45 0 1 5 26.295 52.591 1.73878 29.3 2.7 2.6 5.8
46 4 2 -2 26.54 53.079 1.72393 16.4 1.5 1.5 5.8
47 2 3 -1 26.759 53.519 1.71081 28.1 2.6 2.5 5.8
48 4 1 -5 26.974 53.948 1.69821 78.3 7.1 7.0 5.8
49 4 1 1 27.027 54.055 1.6951 17.9 1.6 1.6 5.8
50 2 0 -6 27.109 54.217 1.6904 29.3 2.7 2.6 5.8
51 2 0 4 27.153 54.306 1.68784 14.9 1.4 1.3 5.8
52 3 0 -6 27.442 54.885 1.67141 25.0 2.3 2.2 5.8
53 5 1 -2 27.521 55.043 1.66699 41.2 3.8 3.7 5.8
54 1 0 -6 28.102 56.204 1.63527 95.8 8.7 8.5 5.8
55 1 3 -3 28.235 56.471 1.62817 101.5 9.2 9.0 5.8
56 1 2 4 28.504 57.008 1.6141 361.6 32.9 32.0 5.8
57 2 3 1 28.739 57.478 1.60201 30.4 2.8 2.7 5.8
58 3 2 2 28.852 57.705 1.59625 31.7 2.9 2.8 5.8
59 4 0 -6 29.072 58.145 1.58522 173.6 15.8 15.3 5.8
60 1 1 5 29.423 58.845 1.568 54.2 4.9 4.8 5.8
61 3 3 -1 29.538 59.076 1.56243 77.6 7.1 6.8 5.8
62 0 0 6 30.336 60.672 1.5251 11.7 1.1 1.0 5.8
63 4 1 2 30.41 60.82 1.52174 100.6 9.2 8.9 5.8
64 3 3 -3 30.463 60.926 1.51933 38.6 3.5 3.4 5.8
65 4 2 -5 30.856 61.711 1.50188 11.0 1.0 1.0 5.8
66 5 2 -2 31.359 62.719 1.48016 20.1 1.8 1.8 5.8
67 2 2 -6 32.206 64.412 1.44528 94.3 8.6 8.2 5.9
68 2 2 4 32.246 64.491 1.44368 132.8 12.1 11.6 5.9
69 3 2 -6 32.506 65.013 1.43336 82.2 7.5 7.2 5.9
70 4 0 3 33.275 66.549 1.40395 16.8 1.5 1.5 5.9
71 2 1 -7 33.5 66.999 1.39561 17.2 1.6 1.5 5.9
72 0 4 0 33.561 67.122 1.39335 251.7 22.9 21.9 5.9
73 4 2 2 34.051 68.102 1.37567 145.4 13.2 12.6 5.9
74 1 3 4 34.649 69.298 1.35483 37.0 3.4 3.2 5.9
75 0 2 6 35.153 70.306 1.33785 35.6 3.2 3.1 5.9
76 5 0 2 35.473 70.945 1.32735 16.9 1.5 1.5 5.9
77 2 4 0 35.885 71.769 1.31413 11.7 1.1 1.0 5.9
78 0 3 5 36.215 72.429 1.30377 11.8 1.1 1.0 5.9
79 6 2 -3 36.493 72.986 1.29519 20.0 1.8 1.7 6.0
80 5 2 -6 36.584 73.169 1.29241 11.3 1.0 1.0 6.0
81 4 3 -5 36.783 73.566 1.2864 31.6 2.9 2.7 6.0
82 6 1 -6 36.846 73.692 1.28451 11.9 1.1 1.0 6.0
83 6 2 -2 36.928 73.856 1.28207 58.5 5.3 5.0 6.0
84 2 4 1 37.162 74.323 1.27516 17.2 1.6 1.5 6.0
85 5 3 -2 37.247 74.493 1.27267 43.2 3.9 3.7 6.0
86 3 0 -8 37.352 74.703 1.26961 20.2 1.8 1.7 6.0
87 3 0 5 37.424 74.849 1.2675 19.4 1.8 1.7 6.0
88 3 4 -2 37.86 75.719 1.25508 29.2 2.7 2.5 6.0
89 4 2 3 37.905 75.809 1.25382 80.7 7.3 6.9 6.0
90 7 0 -3 38.016 76.032 1.2507 27.4 2.5 2.3 6.0
91 5 3 -1 38.095 76.191 1.24849 61.9 5.6 5.3 6.0
92 6 2 -5 38.155 76.31 1.24683 58.8 5.4 5.0 6.0
93 6 2 -1 38.199 76.399 1.2456 11.6 1.1 1.0 6.0
94 3 4 0 38.706 77.411 1.23182 25.9 2.4 2.2 6.0
95 1 3 5 38.888 77.776 1.22695 23.3 2.1 2.0 6.0
96 2 4 2 39.254 78.509 1.21733 46.4 4.2 4.0 6.0
97 6 1 -7 39.758 79.515 1.20442 78.3 7.1 6.7 6.0
98 5 2 -7 39.917 79.834 1.20041 14.9 1.4 1.3 6.0
99 0 2 7 40.606 81.212 1.18349 46.7 4.3 4.0 6.1
100 4 4 -1 41.327 82.654 1.16646 18.6 1.7 1.6 6.1
101 6 0 -8 42.332 84.664 1.14383 17.0 1.5 1.4 6.1
102 7 2 -3 42.459 84.918 1.14105 24.6 2.2 2.1 6.1
103 4 4 0 42.559 85.119 1.13887 34.1 3.1 2.9 6.1
104 2 3 5 42.602 85.203 1.13796 12.9 1.2 1.1 6.1
105 0 1 8 43.429 86.859 1.12047 23.5 2.1 2.0 6.1
106 5 2 -8 43.994 87.989 1.10897 69.5 6.3 5.8 6.2
107 7 1 0 44.089 88.178 1.10708 42.3 3.8 3.5 6.2
108 3 1 6 44.296 88.592 1.10297 16.4 1.5 1.4 6.2
109 4 1 -9 44.351 88.702 1.10189 30.7 2.8 2.6 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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