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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GEORGECHAOITE
1
NaKZrSi(3)O(9).2H(2)O
Orthorhombic * P2(1)nb Z = 2
R =0.053 NR =1840
29 .1 .1990
Ref.Str.:
1. R.C. Boggs, S. Ghose (1985)
* Canad. Mineral., 23, 1-4
2. S. Ghose, P. Thakur (1985)
* Canad. Mineral., 23, 5-10
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 11.836 alpha = 90.0
b = 12.94 beta = 90.0
c = 6.735 gamma = 90.0
Unit cell volume (cub. angs.) = 1031.52
Molar volume ( cub.cm/mol.) = 310.66
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.9959 0.3891 0.3287 0.0 Na = 1.00
2 0.7515 0.1499 0.4136 0.0 K = 1.00
3 0.2499 0.0521 0.1468 0.0 Zr = 1.00
4 0.282 0.2869 0.3883 0.0 Si = 1.00
5 0.4981 0.4165 0.3911 0.0 Si = 1.00
6 0.7116 0.391 0.1459 0.0 Si = 1.00
7 0.2163 0.3939 0.3627 0.0 O = 1.00
8 0.416 0.315 0.4196 0.0 O = 1.00
9 0.7424 0.2709 0.094 0.0 O = 1.00
10 0.2693 0.2083 0.2052 0.0 O = 1.00
11 0.42 0.0155 0.1542 0.0 O = 1.00
12 0.5761 0.391 0.1953 0.0 O = 1.00
13 0.0756 0.0706 0.0882 0.0 O = 1.00
14 0.2347 0.0378 0.4549 0.0 O = 1.00
15 0.7786 0.4273 0.3411 0.0 O = 1.00
16 0.5265 0.1271 0.4753 0.0 O = 1.00
17 0.9718 0.2061 0.3714 0.0 O = 1.00
18 0.484 0.19 0.425 0.0 H = 1.00
19 0.498 0.063 0.406 0.0 H = 1.00
20 0.016 0.184 0.49 0.0 H = 1.00
21 0.0 0.17 0.255 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.9959 0.3891 0.3287
2 2 0.7515 0.1499 0.4136
3 3 0.2499 0.0521 0.1468
4 4 0.282 0.2869 0.3883
5 5 0.4981 0.4165 0.3911
6 6 0.7116 0.391 0.1459
7 7 0.2163 0.3939 0.3627
8 8 0.416 0.315 0.4196
9 9 0.7424 0.2709 0.094
10 10 0.2693 0.2083 0.2052
11 11 0.42 0.0155 0.1542
12 12 0.5761 0.391 0.1953
13 13 0.0756 0.0706 0.0882
14 14 0.2347 0.0378 0.4549
15 15 0.7786 0.4273 0.3411
16 16 0.5265 0.1271 0.4753
17 17 0.9718 0.2061 0.3714
18 18 0.484 0.19 0.425
19 19 0.498 0.063 0.406
20 20 0.016 0.184 0.49
21 21 0.0 0.17 0.255
22 1 0.9959 0.8891 0.1713
23 2 0.7515 0.6499 0.0864
24 3 0.2499 0.5521 0.3532
25 4 0.282 0.7869 0.1117
26 5 0.4981 0.9165 0.1089
27 6 0.7116 0.891 0.3541
28 7 0.2163 0.8939 0.1373
29 8 0.416 0.815 0.0804
30 9 0.7424 0.7709 0.406
31 10 0.2693 0.7083 0.2948
32 11 0.42 0.5155 0.3458
33 12 0.5761 0.891 0.3047
34 13 0.0756 0.5706 0.4118
35 14 0.2347 0.5378 0.0451
36 15 0.7786 0.9273 0.1589
37 16 0.5265 0.6271 0.0247
38 17 0.9718 0.7061 0.1286
39 18 0.484 0.69 0.075
40 19 0.498 0.563 0.094
41 20 0.016 0.684 0.01
42 21 0.0 0.67 0.245
43 1 0.4959 0.1109 0.8287
44 2 0.2515 0.3501 0.9136
45 3 0.7499 0.4479 0.6468
46 4 0.782 0.2131 0.8883
47 5 0.9981 0.0835 0.8911
48 6 0.2116 0.109 0.6459
49 7 0.7163 0.1061 0.8627
50 8 0.916 0.185 0.9196
51 9 0.2424 0.2291 0.594
52 10 0.7693 0.2917 0.7052
53 11 0.92 0.4845 0.6542
54 12 0.0761 0.109 0.6953
55 13 0.5756 0.4294 0.5882
56 14 0.7347 0.4622 0.9549
57 15 0.2786 0.0727 0.8411
58 16 0.0265 0.3729 0.9753
59 17 0.4718 0.2939 0.8714
60 18 0.984 0.31 0.925
61 19 0.998 0.437 0.906
62 20 0.516 0.316 0.99
63 21 0.5 0.33 0.755
64 1 0.4959 0.6109 0.6713
65 2 0.2515 0.8501 0.5864
66 3 0.7499 0.9479 0.8532
67 4 0.782 0.7131 0.6117
68 5 0.9981 0.5835 0.6089
69 6 0.2116 0.609 0.8541
70 7 0.7163 0.6061 0.6373
71 8 0.916 0.685 0.5804
72 9 0.2424 0.7291 0.906
73 10 0.7693 0.7917 0.7948
74 11 0.92 0.9845 0.8458
75 12 0.0761 0.609 0.8047
76 13 0.5756 0.9294 0.9118
77 14 0.7347 0.9622 0.5451
78 15 0.2786 0.5727 0.6589
79 16 0.0265 0.8729 0.5247
80 17 0.4718 0.7939 0.6286
81 18 0.984 0.81 0.575
82 19 0.998 0.937 0.594
83 20 0.516 0.816 0.51
84 21 0.5 0.83 0.745
X-ray density (g/cm cub.) = 2.69
MU (1/cm) = 170.32 Mass attenuation coefficient (cm**2/g) = 63.362
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Na 2.808 6
2.6194 7
2.6204 15
2.4024 17
2.5921 13
2.6715 11
2.4167 16
2 K 3.228 6
2.6639 9
2.7114 16
2.7219 17
3.1054 7
2.696 10
2.5929 14
3 Zr 2.616 6
2.0719 10
2.0689 11
2.114 13
2.091 14
2.0864 7
2.1037 15
4 Si 2.1 4
1.5973 7
1.6408 8
1.6055 10
1.6427 9
5 Si 2.1 4
1.645 8
1.6432 12
1.6089 11
1.6222 13
6 Si 2.1 4
1.6341 9
1.6379 12
1.6056 15
1.6057 14
7 O 3.264 7
2.6031 8
2.6994 10
2.8813 11
2.8479 13
2.8443 14
2.6589 9
3.1427 15
8 O 3.264 8
2.6031 7
2.6469 10
2.6154 12
2.7862 16
2.6421 11
2.6148 9
2.655 13
3.1257 17
9 O 3.264 6
2.599 12
2.655 15
2.6589 7
2.6148 8
2.6515 10
2.6483 14
10 O 3.264 7
2.6994 7
2.6469 8
3.086 11
3.0087 13
2.8042 14
2.6515 9
3.0173 15
11 O 3.264 8
3.086 10
2.9992 14
2.8899 16
2.8813 7
2.6421 8
2.6526 12
2.7921 15
2.7015 13
12 O 3.264 7
2.6154 8
2.599 9
2.6324 15
2.6526 11
2.6924 13
2.6446 14
2.8038 17
13 O 3.264 8
3.0087 10
3.1346 14
2.8674 17
2.8479 7
2.655 8
2.6924 12
2.9229 15
2.7015 11
14 O 3.264 7
2.8042 10
2.9992 11
3.1346 13
2.8443 7
2.6483 9
2.6446 12
2.6906 15
15 O 3.264 7
2.655 9
2.6324 12
3.0173 10
2.7921 11
2.9229 13
2.6906 14
3.1427 7
16 O 3.264 2
2.7862 8
2.8899 11
17 O 3.264 3
2.8674 13
3.1257 8
2.8038 12
18 H 1.632 1
1.015 16
19 H 1.632 1
1.0098 16
20 H 1.632 1
0.9967 17
21 H 1.632 1
0.9717 17
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 2 0 6.838 13.675 0.077 138.14 2 93.6 227.5
2 0 1 1 7.408 14.816 0.084 117.35 4 94.8 396.3
3 2 0 0 7.479 14.958 0.084 115.1 2 226.5 1110.1
4 1 0 1 7.561 15.123 0.085 112.55 4 106.4 478.6
5 1 2 0 7.798 15.596 0.088 105.69 4 106.4 450.2
6 1 1 1 8.304 16.608 0.094 92.94 8 29.9 62.4
7 0 2 1 9.502 19.005 0.107 70.46 4 36.8 35.8
8 2 2 0 10.16 20.32 0.115 61.36 4 57.5 76.1
9 1 2 1 10.221 20.443 0.115 60.6 8 70.6 226.9
10 2 1 1 10.557 21.113 0.119 56.68 8 34.3 50.1
11 2 2 1 12.136 24.271 0.136 42.38 8 84.1 225.3
12 0 3 1 12.243 24.487 0.138 41.6 4 98.6 152.2
13 1 3 1 12.816 25.633 0.144 37.78 8 103.9 306.5
14 3 0 1 13.078 26.155 0.147 36.21 4 83.8 95.5
15 3 2 0 13.219 26.438 0.148 35.39 4 54.4 39.3
16 0 0 2 13.223 26.446 0.148 35.37 2 4.9 0.2
17 3 1 1 13.531 27.062 0.152 33.69 8 19.3 9.4
18 0 1 2 13.672 27.343 0.153 32.96 4 83.5 86.4
19 0 4 0 13.775 27.55 0.155 32.44 2 87.4 46.6
20 1 1 2 14.191 28.382 0.159 30.45 8 218.2 1090.0
21 1 4 0 14.291 28.581 0.16 30.0 4 249.2 700.5
22 2 3 1 14.408 28.816 0.162 29.48 8 46.2 47.3
23 3 2 1 14.814 29.628 0.166 27.78 8 64.4 86.7
24 0 2 2 14.944 29.887 0.167 27.27 4 38.9 15.5
25 4 0 0 15.089 30.178 0.169 26.71 2 434.7 948.4
26 2 0 2 15.259 30.518 0.171 26.07 4 23.6 5.5
27 0 4 1 15.317 30.633 0.171 25.86 4 24.8 6.0
28 1 2 2 15.424 30.847 0.173 25.48 8 78.5 118.1
29 2 1 2 15.654 31.308 0.175 24.68 8 85.7 136.1
30 2 4 0 15.745 31.491 0.176 24.37 4 105.5 102.1
31 1 4 1 15.786 31.573 0.177 24.23 8 106.6 207.1
32 4 2 0 16.634 33.267 0.186 21.64 4 58.7 28.0
33 3 3 1 16.753 33.507 0.187 21.31 8 103.5 171.6
34 2 2 2 16.789 33.579 0.187 21.21 8 24.9 9.9
35 0 3 2 16.87 33.739 0.188 20.99 4 63.3 31.6
36 4 1 1 16.888 33.776 0.189 20.94 8 40.3 25.5
37 2 4 1 17.126 34.252 0.191 20.31 8 93.4 133.1
38 1 3 2 17.302 34.603 0.193 19.86 8 67.2 67.4
39 3 1 2 17.852 35.705 0.199 18.55 8 109.2 166.4
40 3 4 0 17.934 35.868 0.2 18.37 4 120.2 99.7
41 4 2 1 17.954 35.908 0.2 18.32 8 25.4 8.9
42 2 3 2 18.545 37.09 0.206 17.06 8 98.8 125.3
43 0 5 1 18.594 37.187 0.207 16.96 4 10.6 0.7
44 3 2 2 18.871 37.742 0.21 16.42 8 27.1 9.1
45 1 5 1 18.991 37.983 0.211 16.19 8 14.6 2.6
46 3 4 1 19.176 38.352 0.213 15.85 8 44.6 23.7
47 0 4 2 19.28 38.559 0.214 15.66 4 3.9 0.1
48 4 3 1 19.619 39.238 0.218 15.07 8 81.6 75.4
49 1 4 2 19.666 39.331 0.218 14.99 8 12.9 1.9
50 2 5 1 20.145 40.29 0.224 14.21 8 45.6 22.2
51 5 0 1 20.176 40.353 0.224 14.16 4 71.8 27.5
52 5 2 0 20.273 40.546 0.225 14.01 4 53.7 15.2
53 4 0 2 20.276 40.551 0.225 14.0 4 2.5 0.0
54 0 1 3 20.379 40.759 0.226 13.84 4 187.4 182.7
55 1 0 3 20.44 40.88 0.227 13.75 4 42.2 9.2
56 3 3 2 20.473 40.945 0.227 13.7 8 38.6 15.3
57 5 1 1 20.488 40.976 0.227 13.68 8 43.5 19.5
58 4 1 2 20.586 41.172 0.228 13.54 8 56.8 32.8
59 4 4 0 20.658 41.316 0.229 13.43 4 53.5 14.4
60 1 1 3 20.748 41.497 0.23 13.3 8 57.8 33.4
61 2 4 2 20.788 41.575 0.23 13.24 8 18.1 3.2
62 0 6 0 20.926 41.852 0.232 13.05 2 118.9 34.7
63 1 6 0 21.287 42.574 0.236 12.56 4 159.1 119.5
64 0 2 3 21.295 42.591 0.236 12.55 4 33.5 5.3
65 5 2 1 21.4 42.8 0.237 12.41 8 88.1 72.4
66 4 2 2 21.495 42.99 0.238 12.29 8 19.4 3.5
67 1 2 3 21.652 43.303 0.239 12.09 8 67.9 41.9
68 4 4 1 21.769 43.538 0.241 11.94 8 11.2 1.1
69 2 1 3 21.824 43.649 0.241 11.87 8 83.3 62.0
70 3 5 1 21.955 43.91 0.243 11.72 8 20.8 3.8
71 0 6 1 22.026 44.052 0.243 11.63 4 152.5 101.6
72 0 5 2 22.048 44.095 0.244 11.61 4 148.3 95.9
73 2 6 0 22.342 44.685 0.247 11.26 4 59.8 15.1
74 1 6 1 22.373 44.746 0.247 11.23 8 20.6 3.6
75 1 5 2 22.394 44.788 0.247 11.21 8 85.1 61.1
76 3 4 2 22.556 45.111 0.249 11.02 8 18.8 2.9
77 2 2 3 22.693 45.386 0.25 10.87 8 46.0 17.3
78 0 3 3 22.756 45.511 0.251 10.81 4 72.1 21.1
79 5 3 1 22.855 45.71 0.252 10.7 8 94.7 72.2
80 4 3 2 22.945 45.89 0.253 10.61 8 8.1 0.5
81 6 0 0 22.984 45.968 0.253 10.57 2 228.9 104.0
82 1 3 3 23.094 46.188 0.255 10.45 8 84.6 56.2
83 3 0 3 23.252 46.503 0.256 10.29 4 51.2 10.1
84 2 6 1 23.389 46.778 0.258 10.16 8 50.0 19.1
85 2 5 2 23.41 46.819 0.258 10.14 8 125.3 119.7
86 3 1 3 23.53 47.06 0.259 10.02 8 25.7 5.0
87 5 1 2 23.715 47.429 0.261 9.84 8 174.9 226.3
88 5 4 0 23.779 47.558 0.262 9.78 4 199.9 147.0
89 3 6 0 24.019 48.038 0.264 9.56 4 166.0 99.0
90 2 3 3 24.086 48.173 0.265 9.5 8 66.8 31.9
91 6 2 0 24.093 48.186 0.265 9.5 4 86.2 26.6
92 6 1 1 24.281 48.562 0.267 9.33 8 52.1 19.0
93 4 5 1 24.307 48.614 0.267 9.31 8 48.8 16.7
94 3 2 3 24.351 48.703 0.268 9.27 8 65.8 30.1
95 5 2 2 24.531 49.062 0.27 9.11 8 70.8 34.3
96 0 4 3 24.685 49.371 0.271 8.99 4 58.8 11.7
97 5 4 1 24.779 49.558 0.272 8.91 8 76.2 38.9
98 4 4 2 24.863 49.727 0.273 8.84 8 14.1 1.3
99 1 4 3 25.004 50.007 0.274 8.73 8 56.7 21.1
100 3 6 1 25.012 50.023 0.274 8.72 8 53.8 19.0
101 3 5 2 25.031 50.063 0.275 8.71 8 44.7 13.0
102 6 2 1 25.084 50.167 0.275 8.66 8 96.0 60.0
103 0 6 2 25.096 50.191 0.275 8.65 4 44.8 6.5
104 1 6 2 25.41 50.82 0.279 8.41 8 30.3 5.8
105 0 7 1 25.601 51.202 0.28 8.27 4 145.6 65.9
106 3 3 3 25.676 51.352 0.281 8.22 8 100.3 62.1
107 4 1 3 25.771 51.542 0.282 8.15 8 155.3 147.7
108 5 3 2 25.849 51.698 0.283 8.09 8 30.9 5.8
109 1 7 1 25.911 51.822 0.284 8.05 8 82.5 41.1
110 2 4 3 25.941 51.882 0.284 8.03 8 65.0 25.5
111 4 6 0 26.229 52.458 0.287 7.83 4 103.3 31.4
112 2 6 2 26.337 52.674 0.288 7.75 8 34.5 6.9
113 6 3 1 26.382 52.763 0.288 7.72 8 59.6 20.7
114 4 2 3 26.541 53.082 0.29 7.62 8 45.1 11.6
115 2 7 1 26.826 53.651 0.293 7.44 8 80.3 36.1
116 6 0 2 26.907 53.814 0.294 7.38 4 24.2 1.6
117 0 5 3 27.014 54.029 0.295 7.32 4 5.8 0.1
118 5 5 1 27.102 54.204 0.296 7.26 8 16.0 1.4
119 6 1 2 27.158 54.315 0.296 7.23 8 81.4 36.0
120 4 6 1 27.163 54.326 0.296 7.23 8 107.4 62.7
121 4 5 2 27.181 54.363 0.297 7.22 8 111.7 67.7
122 6 4 0 27.216 54.432 0.297 7.19 4 98.8 26.4
123 0 0 4 27.225 54.449 0.297 7.19 2 275.1 102.3
124 1 5 3 27.313 54.626 0.298 7.14 8 135.1 97.9
125 3 4 3 27.453 54.906 0.299 7.05 8 69.2 25.4
126 0 1 4 27.473 54.947 0.299 7.04 4 84.6 18.9
127 5 4 2 27.618 55.236 0.301 6.96 8 12.9 0.9
128 1 1 4 27.769 55.537 0.302 6.87 8 58.1 17.5
129 4 3 3 27.791 55.581 0.303 6.86 8 51.7 13.8
130 3 6 2 27.834 55.668 0.303 6.84 8 31.1 5.0
131 6 2 2 27.901 55.801 0.304 6.8 8 30.6 4.8
132 7 0 1 28.014 56.029 0.305 6.74 4 113.7 32.7
133 7 2 0 28.09 56.18 0.306 6.7 4 79.5 15.9
134 6 4 1 28.127 56.255 0.306 6.68 8 110.9 61.7
135 2 5 3 28.196 56.393 0.307 6.64 8 70.0 24.5
136 0 2 4 28.211 56.422 0.307 6.63 4 58.8 8.6
137 5 0 3 28.221 56.442 0.307 6.63 4 52.2 6.8
138 7 1 1 28.258 56.517 0.307 6.61 8 11.9 0.7
139 3 7 1 28.305 56.609 0.308 6.58 8 87.4 37.8
140 0 7 2 28.382 56.763 0.309 6.54 4 53.9 7.1
141 2 0 4 28.401 56.801 0.309 6.53 4 136.8 46.0
142 0 8 0 28.439 56.877 0.309 6.51 2 75.7 7.0
143 5 1 3 28.464 56.928 0.309 6.5 8 46.8 10.7
144 1 2 4 28.501 57.002 0.31 6.48 8 58.5 16.7
145 2 1 4 28.643 57.285 0.311 6.41 8 58.7 16.6
146 1 7 2 28.671 57.342 0.311 6.39 8 77.8 29.1
147 1 8 0 28.727 57.455 0.312 6.36 4 54.0 7.0
148 5 6 0 28.892 57.785 0.314 6.28 4 147.2 51.2
149 7 2 1 28.983 57.966 0.315 6.24 8 78.1 28.6
150 6 3 2 29.111 58.222 0.316 6.18 8 131.1 79.8
151 5 2 3 29.185 58.37 0.317 6.14 8 73.6 25.0
152 0 8 1 29.325 58.649 0.318 6.08 4 158.7 57.5
153 2 2 4 29.361 58.722 0.318 6.06 8 30.0 4.1
154 0 3 4 29.413 58.826 0.319 6.04 4 55.0 6.9
155 4 4 3 29.48 58.96 0.319 6.0 8 29.9 4.0
156 2 7 2 29.528 59.055 0.32 5.98 8 14.7 1.0
157 2 8 0 29.583 59.166 0.32 5.96 4 82.9 15.4
158 1 8 1 29.608 59.216 0.321 5.95 8 105.1 49.4
159 3 5 3 29.63 59.26 0.321 5.94 8 101.5 46.0
160 0 6 3 29.687 59.375 0.321 5.91 4 16.6 0.6
161 1 3 4 29.696 59.391 0.322 5.91 8 79.9 28.4
162 5 6 1 29.77 59.54 0.322 5.87 8 38.5 6.5
163 5 5 2 29.787 59.575 0.322 5.87 8 52.8 12.3
164 4 6 2 29.844 59.689 0.323 5.84 8 32.2 4.6
165 1 6 3 29.969 59.937 0.324 5.79 8 39.9 6.9
166 3 1 4 30.063 60.125 0.325 5.75 8 45.7 9.0
167 7 3 1 30.165 60.331 0.326 5.7 8 104.1 46.5
168 6 5 1 30.273 60.546 0.327 5.66 8 43.7 8.1
169 4 7 1 30.295 60.59 0.327 5.65 8 123.2 64.5
170 5 3 3 30.362 60.725 0.328 5.62 8 82.6 28.8
171 2 8 1 30.448 60.896 0.329 5.59 8 76.8 24.8
172 2 3 4 30.534 61.069 0.33 5.55 8 61.3 15.7
173 6 4 2 30.754 61.509 0.332 5.46 8 13.8 0.8
174 3 2 4 30.76 61.521 0.332 5.46 8 33.1 4.5
175 2 6 3 30.803 61.605 0.332 5.44 8 26.0 2.8
176 7 1 2 30.879 61.757 0.333 5.41 8 122.3 60.9
177 3 7 2 30.922 61.845 0.334 5.4 8 56.4 12.9
178 7 4 0 30.933 61.865 0.334 5.39 4 130.3 34.4
179 3 8 0 30.976 61.953 0.334 5.38 4 17.4 0.6
180 0 4 4 31.047 62.093 0.335 5.35 4 11.9 0.3
181 1 4 4 31.32 62.641 0.337 5.25 8 141.3 78.8
182 8 0 0 31.375 62.75 0.338 5.23 2 191.3 36.0
183 6 1 3 31.547 63.094 0.34 5.16 8 77.9 23.6
184 7 2 2 31.566 63.131 0.34 5.16 8 24.5 2.3
185 4 5 3 31.569 63.138 0.34 5.16 8 43.5 7.3
186 4 0 4 31.76 63.519 0.342 5.09 4 196.3 73.7
187 7 4 1 31.776 63.552 0.342 5.08 8 43.1 7.1
188 3 8 1 31.819 63.638 0.342 5.07 8 81.6 25.4
189 0 8 2 31.891 63.782 0.343 5.04 4 5.2 0.1
190 3 3 4 31.903 63.806 0.343 5.04 8 48.2 8.8
191 6 6 0 31.95 63.901 0.344 5.02 4 25.0 1.2
192 5 4 3 31.967 63.935 0.344 5.02 8 45.0 7.7
193 4 1 4 31.986 63.972 0.344 5.01 8 44.9 7.6
194 2 4 4 32.134 64.269 0.345 4.96 8 29.5 3.3
195 1 8 2 32.161 64.321 0.346 4.95 8 8.4 0.3
196 3 6 3 32.165 64.33 0.346 4.95 8 38.8 5.6
197 6 2 3 32.226 64.452 0.346 4.93 8 73.9 20.2
198 8 2 0 32.281 64.562 0.347 4.91 4 72.0 9.6
199 5 6 2 32.315 64.63 0.347 4.9 8 7.1 0.2
200 8 1 1 32.436 64.873 0.348 4.86 8 50.1 9.2
201 4 2 4 32.66 65.32 0.35 4.79 8 47.7 8.2
202 0 7 3 32.668 65.336 0.35 4.79 4 86.0 13.3
203 7 3 2 32.693 65.385 0.351 4.78 8 14.6 0.8
204 5 7 1 32.746 65.492 0.351 4.76 8 57.5 11.8
205 6 6 1 32.779 65.558 0.351 4.75 8 65.7 15.4
206 6 5 2 32.796 65.592 0.352 4.75 8 156.5 87.4
207 4 7 2 32.817 65.634 0.352 4.74 8 79.4 22.5
208 4 8 0 32.869 65.738 0.352 4.72 4 71.8 9.1
209 1 7 3 32.935 65.869 0.353 4.7 8 138.5 67.8
210 2 8 2 32.963 65.926 0.353 4.7 8 46.4 7.6
211 0 5 4 33.078 66.156 0.354 4.66 4 11.4 0.2
212 8 2 1 33.106 66.211 0.355 4.65 8 57.4 11.5
213 0 9 1 33.217 66.435 0.356 4.62 4 47.3 3.9
214 6 3 3 33.341 66.683 0.357 4.58 8 86.7 25.9
215 1 5 4 33.343 66.685 0.357 4.58 8 40.6 5.7
216 3 4 4 33.467 66.934 0.358 4.55 8 103.1 36.3
217 1 9 1 33.481 66.963 0.358 4.54 8 47.6 7.7
218 4 8 1 33.686 67.372 0.36 4.48 8 113.7 43.6
219 2 7 3 33.727 67.455 0.36 4.47 8 114.6 44.2
220 4 3 4 33.768 67.535 0.361 4.46 8 57.1 10.9
221 7 5 1 33.783 67.567 0.361 4.46 8 23.3 1.8
222 5 5 3 33.969 67.938 0.363 4.41 8 120.2 47.8
223 4 6 3 34.022 68.044 0.363 4.39 8 42.4 5.9
224 2 5 4 34.131 68.262 0.364 4.36 8 20.2 1.3
225 8 3 1 34.206 68.412 0.365 4.34 8 56.7 10.5
226 7 4 2 34.238 68.475 0.365 4.34 8 17.8 1.0
227 2 9 1 34.268 68.536 0.365 4.33 8 33.9 3.7
228 3 8 2 34.279 68.558 0.366 4.32 8 14.4 0.7
229 5 1 4 34.371 68.742 0.366 4.3 8 64.4 13.4
230 8 0 2 34.657 69.315 0.369 4.23 4 12.5 0.2
231 7 0 3 34.772 69.544 0.37 4.2 4 23.3 0.9
232 6 4 3 34.872 69.744 0.371 4.18 8 91.1 26.1
233 8 1 2 34.874 69.748 0.371 4.18 8 51.5 8.3
234 8 4 0 34.925 69.85 0.372 4.16 4 53.7 4.5
235 7 1 3 34.988 69.977 0.372 4.15 8 36.4 4.1
236 5 2 4 35.022 70.043 0.373 4.14 8 52.4 8.5
237 3 7 3 35.029 70.059 0.373 4.14 8 85.9 23.0
238 0 1 5 35.095 70.191 0.373 4.12 4 31.1 1.5
239 1 0 5 35.137 70.275 0.374 4.11 4 80.1 9.9
240 5 7 2 35.173 70.347 0.374 4.1 8 93.9 27.2
241 6 6 2 35.205 70.41 0.374 4.1 8 27.4 2.3
242 5 8 0 35.224 70.448 0.374 4.09 4 24.4 0.9
243 4 4 4 35.29 70.579 0.375 4.08 8 39.4 4.7
244 1 1 5 35.353 70.706 0.376 4.06 8 45.7 6.4
245 7 6 0 35.371 70.743 0.376 4.06 4 142.6 31.0
246 3 5 4 35.426 70.852 0.376 4.05 8 16.9 0.9
247 0 6 4 35.478 70.956 0.377 4.03 4 84.9 10.9
248 8 2 2 35.521 71.041 0.377 4.02 8 18.5 1.0
249 3 9 1 35.561 71.122 0.378 4.01 8 20.8 1.3
250 6 7 1 35.619 71.238 0.378 4.0 8 66.9 13.5
251 0 9 2 35.629 71.258 0.378 4.0 4 55.9 4.7
252 7 2 3 35.634 71.268 0.378 4.0 8 75.7 17.2
253 8 4 1 35.719 71.438 0.379 3.98 8 39.0 4.6
254 1 6 4 35.734 71.469 0.379 3.98 8 49.0 7.2
255 0 2 5 35.74 71.48 0.379 3.98 4 48.1 3.5
256 1 9 2 35.885 71.769 0.38 3.94 8 21.9 1.4
257 0 8 3 35.941 71.881 0.381 3.93 4 128.2 24.3
258 1 2 5 35.996 71.991 0.382 3.92 8 54.0 8.6
259 5 8 1 36.015 72.031 0.382 3.92 8 93.1 25.5
260 4 8 2 36.083 72.166 0.382 3.9 8 39.4 4.6
261 5 3 4 36.095 72.189 0.382 3.9 8 71.4 14.9
262 2 1 5 36.121 72.241 0.383 3.89 8 45.3 6.0
263 7 6 1 36.162 72.323 0.383 3.89 8 37.6 4.1
264 7 5 2 36.177 72.355 0.383 3.88 8 114.8 38.5
265 1 8 3 36.196 72.391 0.383 3.88 8 66.3 12.8
266 5 6 3 36.342 72.683 0.385 3.85 8 72.1 15.0
267 2 6 4 36.499 72.997 0.386 3.82 8 30.6 2.7
268 0 10 0 36.532 73.064 0.386 3.81 2 12.3 0.1
269 8 3 2 36.587 73.175 0.387 3.8 8 26.4 2.0
270 9 0 1 36.639 73.279 0.387 3.79 4 45.5 2.9
271 2 9 2 36.648 73.296 0.387 3.79 8 50.8 7.3
272 7 3 3 36.699 73.399 0.388 3.78 8 108.2 33.3
273 9 2 0 36.705 73.41 0.388 3.78 4 16.9 0.4
274 2 2 5 36.758 73.516 0.388 3.77 8 32.0 2.9
275 1 10 0 36.785 73.57 0.389 3.76 4 61.4 5.3
276 6 5 3 36.797 73.594 0.389 3.76 8 65.8 12.2
277 0 3 5 36.804 73.609 0.389 3.76 4 25.9 0.9
278 4 7 3 36.817 73.635 0.389 3.75 8 92.9 24.4
279 9 1 1 36.851 73.702 0.389 3.75 8 73.0 15.0
280 2 8 3 36.956 73.912 0.39 3.73 8 106.3 31.7
281 6 0 4 36.975 73.95 0.39 3.72 4 107.7 16.2
282 1 3 5 37.057 74.114 0.391 3.71 8 79.0 17.4
283 3 0 5 37.176 74.351 0.392 3.69 4 95.4 12.6
284 6 1 4 37.186 74.372 0.392 3.69 8 64.1 11.4
285 4 5 4 37.206 74.412 0.393 3.68 8 35.3 3.5
286 0 10 1 37.312 74.624 0.393 3.66 4 19.8 0.5
287 4 9 1 37.338 74.677 0.394 3.66 8 27.4 2.1
288 3 1 5 37.386 74.772 0.394 3.65 8 22.2 1.4
289 9 2 1 37.484 74.967 0.395 3.63 8 81.3 18.1
290 2 10 0 37.541 75.083 0.396 3.62 4 136.5 25.4
291 1 10 1 37.564 75.127 0.396 3.62 8 45.6 5.7
292 5 4 4 37.576 75.151 0.396 3.62 8 120.5 39.5
293 8 5 1 37.627 75.253 0.396 3.61 8 74.2 14.9
294 3 6 4 37.759 75.519 0.397 3.58 8 58.4 9.2
295 2 3 5 37.811 75.622 0.398 3.58 8 37.6 3.8
296 6 2 4 37.816 75.633 0.398 3.57 8 49.6 6.6
297 3 9 2 37.907 75.814 0.399 3.56 8 38.5 4.0
298 6 7 2 37.964 75.927 0.399 3.55 8 23.4 1.5
299 6 8 0 38.013 76.025 0.4 3.54 4 102.7 14.0
300 3 2 5 38.016 76.031 0.4 3.54 8 26.8 1.9
301 8 4 2 38.061 76.123 0.4 3.53 8 39.8 4.2
302 7 4 3 38.172 76.344 0.401 3.52 8 49.2 6.4
303 3 8 3 38.211 76.423 0.402 3.51 8 36.6 3.5
304 0 7 4 38.229 76.458 0.402 3.51 4 68.5 6.2
305 0 4 5 38.275 76.551 0.402 3.5 4 42.5 2.4
306 2 10 1 38.314 76.629 0.402 3.49 8 43.6 5.0
307 5 8 2 38.351 76.701 0.403 3.49 8 25.9 1.8
308 1 7 4 38.478 76.956 0.404 3.47 8 39.8 4.1
309 7 6 2 38.494 76.987 0.404 3.47 8 54.1 7.6
310 1 4 5 38.525 77.049 0.404 3.46 8 42.0 4.6
311 9 3 1 38.53 77.06 0.404 3.46 8 65.1 11.0
312 8 1 3 38.782 77.564 0.407 3.42 8 129.0 42.8
313 6 8 1 38.783 77.565 0.407 3.42 8 56.9 8.3
314 3 10 0 38.79 77.58 0.407 3.42 4 77.3 7.7
315 6 3 4 38.86 77.719 0.407 3.41 8 67.1 11.5
316 7 7 1 38.894 77.789 0.408 3.4 8 61.3 9.6
317 3 3 5 39.057 78.114 0.409 3.38 8 66.3 11.2
318 5 7 3 39.07 78.14 0.409 3.38 8 119.6 36.3
319 6 6 3 39.101 78.201 0.409 3.38 8 36.6 3.4
320 4 1 5 39.133 78.266 0.41 3.37 8 21.1 1.1
321 8 6 0 39.151 78.302 0.41 3.37 4 60.5 4.6
322 9 1 2 39.169 78.338 0.41 3.37 8 61.3 9.5
323 9 4 0 39.217 78.435 0.41 3.36 4 74.4 7.0
324 2 7 4 39.223 78.446 0.41 3.36 8 52.6 7.0
325 2 4 5 39.269 78.539 0.411 3.35 8 94.6 22.6
326 8 2 3 39.404 78.809 0.412 3.33 8 34.3 2.9
327 5 5 4 39.451 78.902 0.412 3.33 8 43.8 4.8
328 4 6 4 39.501 79.003 0.413 3.32 8 77.6 15.0
329 0 9 3 39.509 79.017 0.413 3.32 4 73.9 6.8
330 3 10 1 39.555 79.111 0.413 3.31 8 46.2 5.3
331 5 9 1 39.581 79.162 0.414 3.31 8 33.2 2.7
332 0 10 2 39.621 79.242 0.414 3.3 4 29.1 1.0
333 4 9 2 39.647 79.293 0.414 3.3 8 36.7 3.3
334 4 2 5 39.754 79.508 0.415 3.29 8 27.5 1.9
335 1 9 3 39.756 79.511 0.415 3.29 8 29.8 2.2
336 9 2 2 39.789 79.579 0.415 3.28 8 40.3 4.0
337 1 10 2 39.868 79.736 0.416 3.27 8 17.8 0.8
338 8 6 1 39.914 79.829 0.417 3.27 8 84.2 17.4
339 8 5 2 39.93 79.86 0.417 3.26 8 108.2 28.7
340 4 8 3 39.947 79.895 0.417 3.26 8 119.7 35.1
341 9 4 1 39.98 79.961 0.417 3.26 8 21.2 1.1
342 7 5 3 40.039 80.077 0.418 3.25 8 85.0 17.7
343 0 5 5 40.141 80.282 0.418 3.24 4 26.1 0.8
344 6 4 4 40.307 80.614 0.42 3.22 8 46.6 5.2
345 1 5 5 40.387 80.774 0.421 3.21 8 44.7 4.8
346 7 1 4 40.418 80.835 0.421 3.2 8 40.3 3.9
347 8 3 3 40.436 80.872 0.421 3.2 8 39.2 3.7
348 3 7 4 40.457 80.913 0.421 3.2 8 64.0 9.9
349 2 9 3 40.494 80.989 0.422 3.19 8 114.1 31.3
350 3 4 5 40.502 81.005 0.422 3.19 8 27.2 1.8
351 4 10 0 40.519 81.038 0.422 3.19 4 69.2 5.8
352 10 0 0 40.602 81.203 0.422 3.18 2 50.0 1.5
353 2 10 2 40.606 81.212 0.422 3.18 8 12.6 0.4
354 4 3 5 40.783 81.566 0.424 3.16 8 49.1 5.7
355 9 3 2 40.818 81.637 0.424 3.16 8 13.7 0.4
356 7 2 4 41.033 82.067 0.426 3.13 8 20.7 1.0
357 6 8 2 41.067 82.134 0.426 3.13 8 17.9 0.8
358 2 5 5 41.123 82.246 0.427 3.12 8 45.6 4.9
359 5 0 5 41.143 82.287 0.427 3.12 4 85.6 8.6
360 7 7 2 41.178 82.355 0.427 3.12 8 39.6 3.7
361 7 8 0 41.226 82.451 0.428 3.11 4 24.4 0.7
362 4 10 1 41.276 82.553 0.428 3.11 8 18.2 0.8
363 0 8 4 41.327 82.654 0.429 3.1 4 71.5 6.0
364 5 1 5 41.348 82.697 0.429 3.1 8 20.5 1.0
365 10 2 0 41.422 82.843 0.429 3.09 4 53.0 3.3
366 10 1 1 41.563 83.126 0.431 3.08 8 28.1 1.8
367 1 8 4 41.572 83.143 0.431 3.08 8 48.8 5.5
368 0 11 1 41.66 83.32 0.431 3.07 4 18.6 0.4
369 5 6 4 41.712 83.423 0.432 3.07 8 54.4 6.8
370 3 9 3 41.719 83.438 0.432 3.06 8 29.8 2.0
371 6 7 3 41.775 83.549 0.432 3.06 8 70.1 11.3
372 9 5 1 41.827 83.653 0.433 3.05 8 18.8 0.8
373 3 10 2 41.83 83.66 0.433 3.05 8 23.0 1.2
374 5 9 2 41.855 83.711 0.433 3.05 8 55.5 7.1
375 8 4 3 41.87 83.74 0.433 3.05 8 34.9 2.8
376 1 11 1 41.904 83.809 0.434 3.05 8 104.2 24.9
377 5 2 5 41.962 83.923 0.434 3.04 8 60.3 8.3
378 7 8 1 41.98 83.961 0.434 3.04 8 86.0 16.9
379 7 3 4 42.056 84.112 0.435 3.03 8 63.0 9.0
380 6 5 4 42.15 84.301 0.436 3.02 8 6.7 0.1
381 5 8 3 42.153 84.306 0.436 3.02 8 57.8 7.6
382 4 7 4 42.17 84.339 0.436 3.02 8 65.2 9.6
383 10 2 1 42.176 84.351 0.436 3.02 8 123.2 34.5
384 8 6 2 42.185 84.37 0.436 3.02 8 19.5 0.9
385 4 4 5 42.215 84.43 0.436 3.02 8 64.0 9.3
386 9 4 2 42.25 84.5 0.436 3.02 8 14.2 0.5
387 6 9 1 42.279 84.557 0.437 3.01 8 57.5 7.5
388 7 6 3 42.293 84.586 0.437 3.01 8 47.1 5.0
389 2 8 4 42.304 84.607 0.437 3.01 8 20.8 1.0
390 3 5 5 42.344 84.689 0.437 3.01 8 54.8 6.8
391 0 6 5 42.394 84.788 0.438 3.0 4 135.3 20.7
392 8 7 1 42.578 85.155 0.439 2.99 8 80.6 14.6
393 2 11 1 42.636 85.271 0.44 2.98 8 59.2 7.9
394 1 6 5 42.637 85.275 0.44 2.98 8 4.3 0.0
395 5 10 0 42.719 85.438 0.44 2.98 4 17.3 0.3
396 9 0 3 42.751 85.502 0.441 2.97 4 69.9 5.5
397 9 1 3 42.954 85.909 0.442 2.96 8 56.3 7.0
398 5 3 5 42.981 85.961 0.443 2.96 8 44.4 4.4
399 10 3 1 43.194 86.389 0.444 2.94 8 66.6 9.8
400 9 6 0 43.316 86.632 0.445 2.93 4 142.8 22.5
401 0 0 6 43.331 86.663 0.445 2.93 2 44.8 1.1
402 2 6 5 43.367 86.734 0.446 2.93 8 60.6 8.1
403 0 10 3 43.399 86.798 0.446 2.92 4 3.1 0.0
404 4 9 3 43.424 86.848 0.446 2.92 8 64.6 9.2
405 5 10 1 43.47 86.94 0.447 2.92 8 49.2 5.3
406 7 4 4 43.482 86.963 0.447 2.92 8 94.5 19.6
407 3 8 4 43.52 87.041 0.447 2.92 8 14.1 0.4
408 4 10 2 43.535 87.069 0.447 2.92 8 13.5 0.4
409 0 1 6 43.535 87.07 0.447 2.92 4 23.1 0.6
410 9 2 3 43.565 87.129 0.447 2.91 8 64.9 9.2
411 10 0 2 43.616 87.232 0.448 2.91 4 28.8 0.9
412 1 10 3 43.642 87.284 0.448 2.91 8 19.5 0.8
413 8 5 3 43.703 87.406 0.448 2.9 8 53.6 6.3
414 1 1 6 43.778 87.556 0.449 2.9 8 97.5 20.7
415 10 1 2 43.819 87.639 0.449 2.9 8 52.5 6.0
416 3 11 1 43.851 87.703 0.45 2.89 8 86.4 16.2
417 10 4 0 43.867 87.734 0.45 2.89 4 58.8 3.8
418 8 0 4 43.874 87.747 0.45 2.89 4 109.2 13.0
419 0 11 2 43.916 87.832 0.45 2.89 4 19.5 0.4
420 6 1 5 44.027 88.055 0.451 2.88 8 14.1 0.4
421 4 5 5 44.047 88.093 0.451 2.88 8 17.0 0.6
422 9 6 1 44.066 88.133 0.451 2.88 8 56.4 6.9
423 8 1 4 44.077 88.154 0.452 2.88 8 32.4 2.3
424 9 5 2 44.081 88.163 0.452 2.88 8 53.7 6.2
425 0 2 6 44.144 88.289 0.452 2.88 4 97.0 10.2
426 1 11 2 44.159 88.317 0.452 2.87 8 99.5 21.4
427 7 8 2 44.234 88.468 0.453 2.87 8 25.0 1.3
428 2 0 6 44.303 88.606 0.453 2.87 4 33.0 1.2
429 5 7 4 44.358 88.716 0.454 2.86 8 45.4 4.4
430 2 10 3 44.37 88.741 0.454 2.86 8 64.6 9.0
431 1 2 6 44.387 88.774 0.454 2.86 8 111.3 26.7
432 6 6 4 44.388 88.776 0.454 2.86 8 16.9 0.6
433 5 4 5 44.403 88.807 0.454 2.86 8 16.5 0.6
434 10 2 2 44.429 88.857 0.454 2.86 8 15.2 0.5
435 2 1 6 44.506 89.012 0.455 2.85 8 19.3 0.8
436 6 9 2 44.531 89.062 0.455 2.85 8 41.4 3.7
437 9 3 3 44.58 89.161 0.456 2.85 8 86.1 15.9
438 3 6 5 44.581 89.163 0.456 2.85 8 19.6 0.8
439 10 4 1 44.617 89.233 0.456 2.85 8 79.1 13.4
440 6 2 5 44.637 89.273 0.456 2.85 8 60.2 7.8
441 8 2 4 44.686 89.372 0.456 2.84 8 52.7 5.9
442 0 9 4 44.788 89.577 0.457 2.84 4 28.5 0.9
443 6 8 3 44.827 89.654 0.458 2.84 8 55.0 6.5
444 8 7 2 44.829 89.658 0.458 2.84 8 89.5 17.1
445 8 8 0 44.876 89.753 0.458 2.83 4 76.7 6.3
446 2 11 2 44.887 89.773 0.458 2.83 8 7.6 0.1
447 7 7 3 44.936 89.872 0.458 2.83 8 70.9 10.7
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 2 0 6.838 13.675 6.47 227.5 20.5 20.5 5.6
2 0 1 1 7.408 14.816 5.97423 396.3 35.7 35.7 5.6
3 2 0 0 7.479 14.958 5.918 1110.1 100.0 100.0 5.6
4 1 0 1 7.561 15.123 5.85366 478.6 43.1 43.1 5.6
5 1 2 0 7.798 15.596 5.67716 450.2 40.6 40.5 5.6
6 1 1 1 8.304 16.608 5.33334 62.4 5.6 5.6 5.6
7 0 2 1 9.502 19.005 4.66585 35.8 3.2 3.2 5.6
8 2 2 0 10.16 20.32 4.36679 76.1 6.9 6.8 5.6
9 1 2 1 10.221 20.443 4.34075 226.9 20.4 20.4 5.6
10 2 1 1 10.557 21.113 4.2044 50.1 4.5 4.5 5.6
11 2 2 1 12.136 24.271 3.66403 225.3 20.3 20.2 5.6
12 0 3 1 12.243 24.487 3.63228 152.2 13.7 13.6 5.6
13 1 3 1 12.816 25.633 3.47244 306.5 27.6 27.4 5.6
14 3 0 1 13.078 26.155 3.40424 95.5 8.6 8.5 5.6
15 3 2 0 13.219 26.438 3.36846 39.5 3.6 3.5 5.6
16 0 1 2 13.672 27.343 3.25895 86.4 7.8 7.7 5.6
17 0 4 0 13.775 27.55 3.235 46.6 4.2 4.2 5.6
18 1 1 2 14.191 28.382 3.14202 1090.0 98.2 97.3 5.6
19 1 4 0 14.291 28.581 3.12054 700.5 63.1 62.5 5.6
20 2 3 1 14.408 28.816 3.09569 47.3 4.3 4.2 5.6
21 3 2 1 14.814 29.628 3.01267 86.7 7.8 7.7 5.6
22 0 2 2 14.944 29.887 2.98712 15.5 1.4 1.4 5.6
23 4 0 0 15.089 30.178 2.959 948.4 85.4 84.5 5.6
24 1 2 2 15.424 30.847 2.8963 118.1 10.6 10.5 5.6
25 2 1 2 15.654 31.308 2.85472 136.1 12.3 12.1 5.6
26 2 4 0 15.745 31.491 2.83858 102.1 9.2 9.1 5.6
27 1 4 1 15.786 31.573 2.83139 207.1 18.7 18.4 5.6
28 4 2 0 16.634 33.267 2.69093 28.0 2.5 2.5 5.6
29 3 3 1 16.753 33.507 2.67224 171.6 15.5 15.2 5.7
30 0 3 2 16.87 33.739 2.65436 57.1 5.1 5.1 5.7
31 2 4 1 17.126 34.252 2.61575 133.1 12.0 11.8 5.7
32 1 3 2 17.302 34.603 2.59002 67.4 6.1 6.0 5.7
33 3 1 2 17.852 35.705 2.5126 166.4 15.0 14.8 5.7
34 3 4 0 17.934 35.868 2.50158 108.6 9.8 9.6 5.7
35 2 3 2 18.545 37.09 2.4219 125.3 11.3 11.1 5.7
36 3 4 1 19.176 38.352 2.34504 23.7 2.1 2.1 5.7
37 4 3 1 19.619 39.238 2.29412 75.4 6.8 6.7 5.7
38 2 5 1 20.145 40.29 2.23661 22.2 2.0 2.0 5.7
39 5 0 1 20.176 40.353 2.23327 27.5 2.5 2.4 5.7
40 5 2 0 20.273 40.546 2.22308 15.2 1.4 1.3 5.7
41 0 1 3 20.379 40.759 2.21196 182.7 16.5 16.1 5.7
42 5 1 1 20.488 40.976 2.20074 34.8 3.1 3.1 5.7
43 4 1 2 20.586 41.172 2.19071 32.8 3.0 2.9 5.7
44 4 4 0 20.658 41.316 2.1834 14.4 1.3 1.3 5.7
45 1 1 3 20.748 41.497 2.17431 33.4 3.0 2.9 5.7
46 0 6 0 20.926 41.852 2.15667 34.7 3.1 3.1 5.7
47 1 6 0 21.287 42.574 2.12173 124.8 11.2 11.0 5.7
48 5 2 1 21.4 42.8 2.11105 72.4 6.5 6.4 5.7
49 1 2 3 21.652 43.303 2.08769 41.9 3.8 3.7 5.7
50 2 1 3 21.824 43.649 2.07196 62.0 5.6 5.5 5.7
51 0 6 1 22.026 44.052 2.05393 197.6 17.8 17.4 5.7
52 2 6 0 22.342 44.685 2.02631 15.1 1.4 1.3 5.7
53 1 5 2 22.394 44.788 2.02185 64.7 5.8 5.7 5.7
54 2 2 3 22.693 45.386 1.9966 17.3 1.6 1.5 5.7
55 0 3 3 22.756 45.511 1.99141 21.1 1.9 1.9 5.7
56 5 3 1 22.855 45.71 1.98321 72.2 6.5 6.3 5.7
57 6 0 0 22.984 45.968 1.97267 104.0 9.4 9.1 5.7
58 1 3 3 23.094 46.188 1.96381 56.2 5.1 4.9 5.7
59 2 5 2 23.41 46.819 1.93877 138.8 12.5 12.2 5.7
60 5 1 2 23.715 47.429 1.91526 226.3 20.4 19.8 5.7
61 5 4 0 23.779 47.558 1.91037 147.0 13.2 12.9 5.7
62 3 6 0 24.019 48.038 1.89239 99.0 8.9 8.7 5.7
63 2 3 3 24.086 48.173 1.88742 58.4 5.3 5.1 5.7
64 6 1 1 24.281 48.562 1.87319 35.7 3.2 3.1 5.7
65 3 2 3 24.351 48.703 1.86812 30.1 2.7 2.6 5.7
66 5 2 2 24.531 49.062 1.85527 34.3 3.1 3.0 5.7
67 0 4 3 24.685 49.371 1.84438 11.7 1.1 1.0 5.7
68 5 4 1 24.779 49.558 1.83786 38.9 3.5 3.4 5.7
69 1 4 3 25.004 50.007 1.82239 53.1 4.8 4.6 5.7
70 6 2 1 25.084 50.167 1.81695 66.5 6.0 5.8 5.7
71 0 7 1 25.601 51.202 1.78264 65.9 5.9 5.8 5.8
72 3 3 3 25.676 51.352 1.77778 62.1 5.6 5.4 5.8
73 4 1 3 25.771 51.542 1.77166 147.7 13.3 12.9 5.8
74 1 7 1 25.911 51.822 1.76276 41.1 3.7 3.6 5.8
75 2 4 3 25.941 51.882 1.76085 25.5 2.3 2.2 5.8
76 4 6 0 26.229 52.458 1.74287 31.4 2.8 2.7 5.8
77 6 3 1 26.382 52.763 1.73351 20.7 1.9 1.8 5.8
78 4 2 3 26.541 53.082 1.72385 11.6 1.0 1.0 5.8
79 2 7 1 26.826 53.651 1.70689 36.1 3.3 3.1 5.8
80 4 5 2 27.181 54.363 1.68622 166.4 15.0 14.5 5.8
81 0 0 4 27.225 54.449 1.68375 128.7 11.6 11.2 5.8
82 1 5 3 27.313 54.626 1.67871 97.9 8.8 8.5 5.8
83 3 4 3 27.453 54.906 1.67083 44.3 4.0 3.8 5.8
84 1 1 4 27.769 55.537 1.65331 31.3 2.8 2.7 5.8
85 7 0 1 28.014 56.029 1.63996 32.7 2.9 2.8 5.8
86 7 2 0 28.09 56.18 1.63592 15.9 1.4 1.4 5.8
87 6 4 1 28.127 56.255 1.63392 61.7 5.6 5.3 5.8
88 2 5 3 28.196 56.393 1.63024 39.9 3.6 3.5 5.8
89 3 7 1 28.305 56.609 1.62451 37.8 3.4 3.3 5.8
90 2 0 4 28.401 56.801 1.61948 53.1 4.8 4.6 5.8
91 5 1 3 28.464 56.928 1.61619 17.7 1.6 1.5 5.8
92 1 2 4 28.501 57.002 1.61425 16.7 1.5 1.4 5.8
93 1 7 2 28.671 57.342 1.60549 45.7 4.1 4.0 5.8
94 5 6 0 28.892 57.785 1.59424 51.2 4.6 4.4 5.8
95 7 2 1 28.983 57.966 1.58969 28.6 2.6 2.5 5.8
96 6 3 2 29.111 58.222 1.5833 79.8 7.2 6.9 5.8
97 5 2 3 29.185 58.37 1.57965 25.0 2.3 2.2 5.8
98 0 8 1 29.325 58.649 1.57278 57.5 5.2 5.0 5.8
99 1 8 1 29.608 59.216 1.55907 110.8 10.0 9.6 5.8
100 1 3 4 29.696 59.391 1.55489 28.4 2.6 2.4 5.8
101 5 5 2 29.787 59.575 1.55054 18.8 1.7 1.6 5.8
102 7 3 1 30.165 60.331 1.53291 46.5 4.2 4.0 5.8
103 4 7 1 30.295 60.59 1.52695 72.6 6.5 6.3 5.8
104 5 3 3 30.362 60.725 1.52389 28.8 2.6 2.5 5.8
105 2 8 1 30.448 60.896 1.52002 24.8 2.2 2.1 5.8
106 2 3 4 30.534 61.069 1.51614 15.7 1.4 1.3 5.8
107 7 1 2 30.879 61.757 1.50087 60.9 5.5 5.2 5.8
108 7 4 0 30.933 61.865 1.49851 47.3 4.3 4.1 5.8
109 1 4 4 31.32 62.641 1.48181 78.8 7.1 6.8 5.8
110 8 0 0 31.375 62.75 1.4795 36.0 3.2 3.1 5.9
111 6 1 3 31.547 63.094 1.47224 33.2 3.0 2.8 5.9
112 4 0 4 31.76 63.519 1.46342 80.8 7.3 6.9 5.9
113 3 8 1 31.819 63.638 1.46097 25.4 2.3 2.2 5.9
114 5 4 3 31.967 63.935 1.45491 16.4 1.5 1.4 5.9
115 6 2 3 32.226 64.452 1.44446 20.2 1.8 1.7 5.9
116 0 7 3 32.668 65.336 1.42705 21.5 1.9 1.8 5.9
117 5 7 1 32.746 65.492 1.42402 11.8 1.1 1.0 5.9
118 6 5 2 32.796 65.592 1.42211 125.3 11.3 10.7 5.9
119 1 7 3 32.935 65.869 1.41679 75.4 6.8 6.4 5.9
120 8 2 1 33.106 66.211 1.4103 11.5 1.0 1.0 5.9
121 6 3 3 33.341 66.683 1.40147 31.6 2.8 2.7 5.9
122 3 4 4 33.467 66.934 1.39682 44.1 4.0 3.8 5.9
123 4 8 1 33.686 67.372 1.38879 43.6 3.9 3.7 5.9
124 2 7 3 33.727 67.455 1.38728 44.2 4.0 3.8 5.9
125 4 3 4 33.768 67.535 1.38583 12.7 1.1 1.1 5.9
126 5 5 3 33.969 67.938 1.37859 47.8 4.3 4.1 5.9
127 5 1 4 34.371 68.742 1.36442 13.4 1.2 1.1 5.9
128 6 4 3 34.872 69.744 1.34725 34.4 3.1 2.9 5.9
129 3 7 3 35.029 70.059 1.34196 31.5 2.8 2.7 5.9
130 5 7 2 35.173 70.347 1.33717 27.2 2.5 2.3 5.9
131 7 6 0 35.371 70.743 1.33065 37.4 3.4 3.2 5.9
132 7 2 3 35.634 71.268 1.32213 35.4 3.2 3.0 5.9
133 1 6 4 35.734 71.469 1.31891 15.2 1.4 1.3 5.9
134 0 8 3 35.941 71.881 1.31235 24.3 2.2 2.1 5.9
135 5 8 1 36.015 72.031 1.31 34.1 3.1 2.9 5.9
136 5 3 4 36.095 72.189 1.30751 25.5 2.3 2.2 5.9
137 7 5 2 36.177 72.355 1.30492 55.4 5.0 4.7 5.9
138 5 6 3 36.342 72.683 1.29984 15.0 1.4 1.3 6.0
139 7 3 3 36.699 73.399 1.28892 33.7 3.0 2.8 6.0
140 4 7 3 36.817 73.635 1.28537 37.6 3.4 3.2 6.0
141 9 1 1 36.851 73.702 1.28436 15.0 1.4 1.3 6.0
142 2 8 3 36.956 73.912 1.28123 47.9 4.3 4.0 6.0
143 1 3 5 37.057 74.114 1.27824 17.4 1.6 1.5 6.0
144 3 0 5 37.176 74.351 1.27475 24.0 2.2 2.0 6.0
145 9 2 1 37.484 74.967 1.26579 18.1 1.6 1.5 6.0
146 2 10 0 37.541 75.083 1.26413 31.0 2.8 2.6 6.0
147 5 4 4 37.576 75.151 1.26315 39.5 3.6 3.3 6.0
148 8 5 1 37.627 75.253 1.26169 14.9 1.3 1.3 6.0
149 6 8 0 38.013 76.025 1.25079 15.9 1.4 1.3 6.0
150 7 6 2 38.494 76.987 1.23754 11.8 1.1 1.0 6.0
151 9 3 1 38.53 77.06 1.23656 15.6 1.4 1.3 6.0
152 8 1 3 38.782 77.564 1.22977 58.8 5.3 4.9 6.0
153 6 3 4 38.86 77.719 1.2277 11.5 1.0 1.0 6.0
154 5 7 3 39.07 78.14 1.22215 47.5 4.3 4.0 6.0
155 9 1 2 39.169 78.338 1.21956 15.3 1.4 1.3 6.0
156 2 7 4 39.223 78.446 1.21814 14.0 1.3 1.2 6.0
157 2 4 5 39.269 78.539 1.21693 22.6 2.0 1.9 6.0
158 4 6 4 39.501 79.003 1.21095 21.9 2.0 1.8 6.0
159 8 5 2 39.93 79.86 1.2001 81.2 7.3 6.8 6.0
160 7 5 3 40.039 80.077 1.19738 17.7 1.6 1.5 6.0
161 2 9 3 40.494 80.989 1.18619 38.8 3.5 3.2 6.1
162 5 0 5 41.143 82.287 1.17073 13.5 1.2 1.1 6.1
163 6 7 3 41.775 83.549 1.15623 11.3 1.0 0.9 6.1
164 1 11 1 41.904 83.809 1.15331 24.9 2.2 2.0 6.1
165 7 8 1 41.98 83.961 1.15161 25.2 2.3 2.1 6.1
166 10 2 1 42.176 84.351 1.14726 51.7 4.7 4.3 6.1
167 6 9 1 42.279 84.557 1.145 13.5 1.2 1.1 6.1
168 0 6 5 42.394 84.788 1.14247 20.7 1.9 1.7 6.1
169 8 7 1 42.578 85.155 1.13848 14.6 1.3 1.2 6.1
170 9 1 3 42.954 85.909 1.13041 11.4 1.0 0.9 6.1
171 9 6 0 43.316 86.632 1.12282 23.6 2.1 1.9 6.1
172 7 4 4 43.482 86.963 1.11939 24.9 2.2 2.0 6.1
173 1 1 6 43.778 87.556 1.11334 20.7 1.9 1.7 6.2
174 3 11 1 43.851 87.703 1.11185 33.0 3.0 2.7 6.2
175 9 6 1 44.066 88.133 1.10753 15.4 1.4 1.3 6.2
176 1 11 2 44.159 88.317 1.1057 31.6 2.8 2.6 6.2
177 1 2 6 44.387 88.774 1.10118 40.7 3.7 3.3 6.2
178 9 3 3 44.58 89.161 1.09741 16.7 1.5 1.4 6.2
179 10 4 1 44.617 89.233 1.0967 21.1 1.9 1.7 6.2
180 8 7 2 44.829 89.658 1.09261 23.6 2.1 1.9 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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