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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SCHOONERITE
1
ZnMnFe(3)(OH)(2)[H(2)O](7)[PO(4)](3).2H(2)O
Orthorhombic P mab Z = 4
R =0.085 NR =895
18 .3 .1991
Ref.Str.:
Kampf A.R. (1977)
* Amer. Mineral., 62, 250-255
Reserv:
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 11.119 alpha = 90.0
b = 25.546 beta = 90.0
c = 6.437 gamma = 90.0
Unit cell volume (cub. angs.) = 1828.4
Molar volume ( cub.cm/mol.) = 275.33
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.25 0.1034 0.8538 1.8 Zn = 1.00
2 0.25 0.4149 0.2255 1.41 Mn = 1.00
3 0.0 0.25 0.0879 1.08 Fe = 1.00
4 0.0 0.25 0.577 1.57 Fe = 1.00
5 0.25 0.1871 0.3272 0.67 Fe = 1.00
6 0.0303 0.1199 0.1427 0.69 P = 1.00
7 0.024 0.3282 0.06 1.4 O = 1.00
8 0.067 0.4153 0.228 1.1 O = 1.00
9 0.091 0.0917 0.957 1.6 O = 1.00
10 0.122 0.132 0.32 1.2 O = 1.00
11 0.25 0.2169 0.8248 0.53 P = 1.00
12 0.25 0.182 0.022 0.6 O = 1.00
13 0.25 0.1788 0.636 0.7 O = 1.00
14 0.136 0.2505 0.825 1.2 O = 1.00
15 0.124 0.243 0.329 1.5 OH = 1.00
16 0.026 0.3329 0.618 1.1 H(2)O = 1.00
17 0.25 0.3451 0.437 1.1 H(2)O = 1.00
18 0.25 0.3623 0.952 2.0 H(2)O = 1.00
19 0.25 0.4614 0.517 1.4 H(2)O = 1.00
20 0.25 0.4882 0.038 2.0 H(2)O = 1.00
21 0.25 0.0659 0.584 2.9 H(2)O = 1.00
22 0.054 0.4815 0.763 2.0 H(2)O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.25 0.1034 0.8538
2 2 0.25 0.4149 0.2255
3 3 0.0 0.25 0.0879
4 4 0.0 0.25 0.577
5 5 0.25 0.1871 0.3272
6 6 0.0303 0.1199 0.1427
7 7 0.024 0.3282 0.06
8 8 0.067 0.4153 0.228
9 9 0.091 0.0917 0.957
10 10 0.122 0.132 0.32
11 11 0.25 0.2169 0.8248
12 12 0.25 0.182 0.022
13 13 0.25 0.1788 0.636
14 14 0.136 0.2505 0.825
15 15 0.124 0.243 0.329
16 16 0.026 0.3329 0.618
17 17 0.25 0.3451 0.437
18 18 0.25 0.3623 0.952
19 19 0.25 0.4614 0.517
20 20 0.25 0.4882 0.038
21 21 0.25 0.0659 0.584
22 22 0.054 0.4815 0.763
23 1 0.75 0.8966 0.1462
24 2 0.75 0.5851 0.7745
25 3 0.0 0.75 0.9121
26 4 0.0 0.75 0.423
27 5 0.75 0.8129 0.6728
28 6 0.9697 0.8801 0.8573
29 7 0.976 0.6718 0.94
30 8 0.933 0.5847 0.772
31 9 0.909 0.9083 0.043
32 10 0.878 0.868 0.68
33 11 0.75 0.7831 0.1752
34 12 0.75 0.818 0.978
35 13 0.75 0.8212 0.364
36 14 0.864 0.7495 0.175
37 15 0.876 0.757 0.671
38 16 0.974 0.6671 0.382
39 17 0.75 0.6549 0.563
40 18 0.75 0.6377 0.048
41 19 0.75 0.5386 0.483
42 20 0.75 0.5118 0.962
43 21 0.75 0.9341 0.416
44 22 0.946 0.5185 0.237
45 3 0.5 0.25 0.0879
46 4 0.5 0.25 0.577
47 6 0.4697 0.1199 0.1427
48 7 0.476 0.3282 0.06
49 8 0.433 0.4153 0.228
50 9 0.409 0.0917 0.957
51 10 0.378 0.132 0.32
52 14 0.364 0.2505 0.825
53 15 0.376 0.243 0.329
54 16 0.474 0.3329 0.618
55 22 0.446 0.4815 0.763
56 3 0.5 0.75 0.9121
57 4 0.5 0.75 0.423
58 6 0.5303 0.8801 0.8573
59 7 0.524 0.6718 0.94
60 8 0.567 0.5847 0.772
61 9 0.591 0.9083 0.043
62 10 0.622 0.868 0.68
63 14 0.636 0.7495 0.175
64 15 0.624 0.757 0.671
65 16 0.526 0.6671 0.382
66 22 0.554 0.5185 0.237
67 1 0.75 0.3966 0.8538
68 2 0.75 0.0851 0.2255
69 5 0.75 0.3129 0.3272
70 6 0.5303 0.3801 0.1427
71 7 0.524 0.1718 0.06
72 8 0.567 0.0847 0.228
73 9 0.591 0.4083 0.957
74 10 0.622 0.368 0.32
75 11 0.75 0.2831 0.8248
76 12 0.75 0.318 0.022
77 13 0.75 0.3212 0.636
78 14 0.636 0.2495 0.825
79 15 0.624 0.257 0.329
80 16 0.526 0.1671 0.618
81 17 0.75 0.1549 0.437
82 18 0.75 0.1377 0.952
83 19 0.75 0.0386 0.517
84 20 0.75 0.0118 0.038
85 21 0.75 0.4341 0.584
86 22 0.554 0.0185 0.763
87 1 0.25 0.6034 0.1462
88 2 0.25 0.9149 0.7745
89 5 0.25 0.6871 0.6728
90 6 0.4697 0.6199 0.8573
91 7 0.476 0.8282 0.94
92 8 0.433 0.9153 0.772
93 9 0.409 0.5917 0.043
94 10 0.378 0.632 0.68
95 11 0.25 0.7169 0.1752
96 12 0.25 0.682 0.978
97 13 0.25 0.6788 0.364
98 14 0.364 0.7505 0.175
99 15 0.376 0.743 0.671
100 16 0.474 0.8329 0.382
101 17 0.25 0.8451 0.563
102 18 0.25 0.8623 0.048
103 19 0.25 0.9614 0.483
104 20 0.25 0.9882 0.962
105 21 0.25 0.5659 0.416
106 22 0.446 0.9815 0.237
107 6 0.9697 0.3801 0.1427
108 7 0.976 0.1718 0.06
109 8 0.933 0.0847 0.228
110 9 0.909 0.4083 0.957
111 10 0.878 0.368 0.32
112 14 0.864 0.2495 0.825
113 15 0.876 0.257 0.329
114 16 0.974 0.1671 0.618
115 22 0.946 0.0185 0.763
116 6 0.0303 0.6199 0.8573
117 7 0.024 0.8282 0.94
118 8 0.067 0.9153 0.772
119 9 0.091 0.5917 0.043
120 10 0.122 0.632 0.68
121 14 0.136 0.7505 0.175
122 15 0.124 0.743 0.671
123 16 0.026 0.8329 0.382
124 22 0.054 0.9815 0.237
X-ray density (g/cm cub.) = 2.79
MU (1/cm) = 299.792 Mass attenuation coefficient (cm**2/g) = 107.361
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Zn 2.796 5
1.9121 9
2.2812 12
2.3824 13
1.9834 21
1.9121 9
2 Mn 2.892 6
2.0349 8
2.2434 17
2.2147 18
2.2208 19
2.2278 20
2.0349 8
3 Fe 2.76 6
2.0234 7
2.2695 14
2.0836 15
2.0234 7
2.2695 14
2.0836 15
4 Fe 2.76 6
2.1989 14
2.1169 15
2.1536 16
2.1989 14
2.1169 15
2.1536 16
5 Fe 2.76 6
2.0023 10
1.9689 12
1.999 13
2.0005 15
2.0023 10
2.0005 15
6 P 2.4 4
1.5503 9
1.5613 10
1.5511 7
1.5101 8
7 O 3.432 10
2.5197 8
2.7891 14
2.9953 15
2.8478 16
2.749 18
3.0675 12
2.5023 9
2.5436 10
3.0814 14
3.0024 15
8 O 3.432 9
2.5197 7
3.3077 16
3.0276 17
3.0216 18
2.998 19
3.0173 20
2.9604 22
2.4822 9
2.4954 10
9 O 3.432 9
2.5765 10
2.9363 12
3.0536 21
3.1808 20
2.5023 7
2.4822 8
3.1881 16
2.7669 22
3.3679 22
10 O 3.432 9
2.5765 9
2.7086 12
2.7554 13
2.8363 15
2.7865 21
2.8465 10
2.5436 7
2.4954 8
2.6817 16
11 P 2.4 4
1.5512 12
1.557 13
1.5308 14
1.5308 14
12 O 3.432 11
2.9363 9
2.7086 10
2.486 13
2.5054 14
2.8803 15
2.9363 9
2.7086 10
2.5054 14
2.8803 15
3.0675 7
3.0675 7
13 O 3.432 10
2.7554 10
2.486 12
2.5381 14
2.9254 15
2.9035 21
2.7554 10
2.5381 14
2.9254 15
3.0855 16
3.0855 16
14 O 3.432 11
2.7891 7
2.5054 12
2.5381 13
3.2526 15
3.2013 15
2.7753 16
3.2299 18
2.5351 14
3.0814 7
3.0245 14
3.0918 16
15 OH 3.48 12
2.9953 7
2.8363 10
2.8803 12
2.9254 13
3.2013 14
3.2526 14
3.15 16
3.0412 17
2.802 15
3.0024 7
2.7806 15
3.1626 16
16 H(2)O 3.6 12
2.8478 7
3.5939 7
3.3077 8
2.7753 14
3.15 15
2.7673 17
3.3749 18
3.0855 13
3.1881 9
2.6817 10
3.0918 14
3.1626 15
17 H(2)O 3.6 11
3.52 7
3.0276 8
3.0412 15
2.7673 16
3.344 18
3.1527 18
3.0153 19
3.52 7
3.0276 8
3.0412 15
2.7673 16
18 H(2)O 3.6 11
2.749 7
3.0216 8
3.2299 14
3.3749 16
3.1527 17
3.344 17
3.2635 20
2.749 7
3.0216 8
3.2299 14
3.3749 16
19 H(2)O 3.6 8
2.998 8
3.0153 17
3.4228 20
3.1584 20
2.7424 22
2.998 8
2.7424 22
2.7476 21
20 H(2)O 3.6 10
3.0173 8
3.2635 18
3.1584 19
3.4228 19
2.8129 22
3.0173 8
2.8129 22
3.1808 9
3.1401 21
3.1808 9
21 H(2)O 3.6 7
3.0536 9
2.7865 10
2.9035 13
3.0536 9
2.7865 10
2.7476 19
3.1401 20
22 H(2)O 3.6 7
3.441 8
2.7424 19
2.8129 20
2.9604 8
3.4125 22
2.7669 9
3.3679 9
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 3.457 6.915 0.039 546.95 2 292.5 2800.1
2 1 2 0 5.27 10.54 0.06 234.11 4 162.4 738.6
3 0 0 1 6.873 13.745 0.078 136.71 2 168.1 231.1
4 0 4 0 6.927 13.855 0.078 134.53 2 58.7 27.7
5 0 1 1 7.089 14.177 0.08 128.37 4 104.4 167.4
6 0 2 1 7.701 15.402 0.087 108.43 4 48.6 30.6
7 2 0 0 7.964 15.928 0.09 101.24 2 46.7 13.2
8 1 4 0 7.995 15.99 0.09 100.43 4 185.1 411.9
9 1 1 1 8.136 16.272 0.092 96.92 8 114.9 306.4
10 0 3 1 8.627 17.255 0.097 85.94 4 119.8 147.5
11 1 2 1 8.676 17.352 0.098 84.95 8 42.1 36.0
12 2 2 0 8.691 17.382 0.098 84.65 4 130.0 171.1
13 1 3 1 9.511 19.021 0.107 70.33 8 27.2 12.5
14 0 4 1 9.782 19.564 0.11 66.36 4 117.5 109.7
15 0 6 0 10.423 20.846 0.117 58.2 2 260.4 236.0
16 2 0 1 10.549 21.098 0.119 56.77 4 50.6 17.4
17 1 4 1 10.573 21.145 0.119 56.5 8 43.9 26.0
18 2 4 0 10.585 21.17 0.119 56.36 4 140.2 132.5
19 2 1 1 10.693 21.385 0.12 55.19 8 59.2 46.4
20 0 5 1 11.098 22.195 0.125 51.09 4 87.7 47.0
21 2 2 1 11.113 22.227 0.125 50.94 8 2.3 0.1
22 1 6 0 11.17 22.341 0.126 50.4 4 18.2 2.0
23 2 3 1 11.783 23.566 0.133 45.08 8 52.7 29.9
24 1 5 1 11.804 23.608 0.133 44.91 8 184.0 363.8
25 3 2 0 12.498 24.995 0.14 39.84 4 47.4 10.7
26 0 6 1 12.528 25.055 0.141 39.64 4 114.2 61.9
27 2 4 1 12.664 25.328 0.142 38.75 8 37.5 13.0
28 1 6 1 13.162 26.324 0.148 35.72 8 36.9 11.6
29 2 6 0 13.172 26.344 0.148 35.66 4 81.3 28.2
30 2 5 1 13.719 27.438 0.154 32.72 8 11.4 1.0
31 0 0 2 13.847 27.694 0.155 32.08 2 96.4 17.8
32 3 4 0 13.904 27.807 0.156 31.8 4 172.7 113.5
33 0 1 2 13.959 27.917 0.157 31.54 4 26.8 2.7
34 0 8 0 13.959 27.917 0.157 31.54 2 220.0 91.3
35 3 1 1 13.987 27.974 0.157 31.4 8 173.6 226.4
36 0 7 1 14.042 28.084 0.157 31.14 4 59.4 13.1
37 0 2 2 14.289 28.578 0.16 30.0 4 55.3 11.0
38 3 2 1 14.317 28.634 0.161 29.88 8 25.2 4.5
39 1 1 2 14.535 29.07 0.163 28.93 8 114.8 91.3
40 1 8 0 14.535 29.07 0.163 28.93 4 153.4 81.5
41 1 7 1 14.615 29.23 0.164 28.59 8 151.2 156.4
42 0 3 2 14.824 29.648 0.166 27.74 4 24.4 2.0
43 3 3 1 14.851 29.702 0.166 27.63 8 19.7 2.6
44 1 2 2 14.853 29.707 0.166 27.62 8 18.9 2.4
45 2 6 1 14.915 29.83 0.167 27.38 8 37.3 9.1
46 1 3 2 15.371 30.742 0.172 25.66 8 78.6 38.0
47 0 4 2 15.545 31.091 0.174 25.05 4 55.2 9.1
48 3 4 1 15.571 31.143 0.174 24.96 8 21.9 2.9
49 0 8 1 15.621 31.242 0.175 24.79 4 123.8 45.4
50 3 6 0 15.994 31.989 0.179 23.56 4 185.9 97.4
51 2 0 2 16.054 32.108 0.18 23.37 4 103.6 30.0
52 1 4 2 16.07 32.14 0.18 23.32 8 142.6 113.5
53 4 0 0 16.087 32.175 0.18 23.26 2 568.8 450.3
54 1 8 1 16.143 32.287 0.18 23.09 8 60.7 20.3
55 2 1 2 16.152 32.303 0.181 23.07 8 369.3 752.8
56 2 8 0 16.152 32.303 0.181 23.06 4 282.0 219.4
57 2 7 1 16.225 32.449 0.181 22.84 8 198.6 215.7
58 0 5 2 16.431 32.862 0.184 22.23 4 28.3 2.1
59 2 2 2 16.442 32.883 0.184 22.19 8 179.7 171.5
60 3 5 1 16.455 32.911 0.184 22.15 8 103.5 56.8
61 4 2 0 16.475 32.949 0.184 22.1 4 116.7 36.0
62 2 3 2 16.915 33.831 0.189 20.87 8 80.3 32.2
63 1 5 2 16.931 33.862 0.189 20.82 8 23.1 2.7
64 0 9 1 17.253 34.505 0.193 19.99 4 81.4 15.8
65 0 6 2 17.458 34.917 0.195 19.48 4 91.5 19.5
66 3 6 1 17.482 34.964 0.195 19.42 8 11.8 0.6
67 0 10 0 17.549 35.099 0.196 19.26 2 7.0 0.1
68 2 4 2 17.56 35.119 0.196 19.23 8 18.8 1.6
69 4 0 1 17.568 35.136 0.196 19.21 4 72.6 12.1
70 4 4 0 17.591 35.181 0.196 19.16 4 54.6 6.8
71 2 8 1 17.627 35.255 0.197 19.07 8 72.9 24.2
72 4 1 1 17.658 35.317 0.197 19.0 8 3.7 0.1
73 1 9 1 17.732 35.465 0.198 18.83 8 76.2 26.2
74 4 2 1 17.927 35.854 0.2 18.38 8 1.2 0.0
75 1 6 2 17.933 35.867 0.2 18.37 8 13.3 0.8
76 1 10 0 18.022 36.044 0.201 18.17 4 19.0 0.8
77 2 5 2 18.359 36.718 0.204 17.45 8 30.6 3.9
78 4 3 1 18.367 36.734 0.205 17.43 8 9.9 0.4
79 3 1 2 18.566 37.133 0.207 17.02 8 58.5 13.9
80 3 8 0 18.566 37.133 0.207 17.02 4 30.3 1.9
81 0 7 2 18.609 37.218 0.207 16.93 4 13.9 0.4
82 3 7 1 18.631 37.262 0.207 16.89 8 20.3 1.7
83 3 2 2 18.824 37.647 0.209 16.51 8 54.5 11.7
84 0 10 1 18.929 37.859 0.211 16.31 4 159.3 49.5
85 4 4 1 18.968 37.936 0.211 16.23 8 66.5 17.2
86 1 7 2 19.059 38.118 0.212 16.06 8 86.3 28.6
87 2 9 1 19.108 38.216 0.212 15.97 8 59.3 13.4
88 3 3 2 19.246 38.492 0.214 15.72 8 11.7 0.5
89 2 6 2 19.297 38.594 0.215 15.63 8 154.2 89.0
90 4 6 0 19.325 38.651 0.215 15.58 4 1.2 0.0
91 1 10 1 19.373 38.746 0.215 15.49 8 32.0 3.8
92 2 10 0 19.38 38.76 0.215 15.48 4 252.3 117.9
93 4 5 1 19.718 39.437 0.219 14.9 8 5.6 0.1
94 3 4 2 19.825 39.649 0.22 14.72 8 3.2 0.0
95 0 8 2 19.865 39.73 0.221 14.65 4 7.6 0.1
96 3 8 1 19.886 39.772 0.221 14.62 8 6.2 0.1
97 1 8 2 20.291 40.583 0.225 13.98 8 90.0 27.1
98 2 7 2 20.358 40.716 0.226 13.88 8 170.5 96.5
99 3 5 2 20.548 41.097 0.228 13.59 8 25.3 2.1
100 5 2 0 20.585 41.169 0.228 13.54 4 40.2 2.6
101 4 6 1 20.604 41.208 0.228 13.51 8 22.4 1.6
102 0 11 1 20.647 41.294 0.229 13.45 4 39.7 2.5
103 2 10 1 20.656 41.312 0.229 13.43 8 44.7 6.4
104 0 0 3 21.038 42.077 0.233 12.89 2 40.4 1.3
105 1 11 1 21.06 42.12 0.233 12.86 8 89.7 24.8
106 0 1 3 21.116 42.232 0.234 12.79 4 58.7 5.3
107 0 9 2 21.213 42.425 0.235 12.66 4 93.3 13.2
108 0 12 0 21.213 42.425 0.235 12.66 2 305.6 70.7
109 3 9 1 21.233 42.465 0.235 12.63 8 150.4 68.4
110 0 2 3 21.347 42.695 0.236 12.48 4 89.2 11.9
111 3 6 2 21.406 42.811 0.237 12.4 8 58.6 10.2
112 4 0 2 21.478 42.957 0.238 12.31 4 65.9 6.4
113 3 10 0 21.482 42.964 0.238 12.3 4 120.6 21.4
114 5 4 0 21.517 43.034 0.238 12.26 4 105.9 16.4
115 1 1 3 21.522 43.044 0.238 12.25 8 10.8 0.3
116 2 8 2 21.529 43.057 0.238 12.24 8 25.9 2.0
117 4 1 2 21.555 43.109 0.238 12.21 8 175.0 89.5
118 4 8 0 21.555 43.109 0.238 12.21 4 42.1 2.6
119 5 1 1 21.574 43.148 0.239 12.19 8 73.2 15.6
120 4 7 1 21.612 43.224 0.239 12.14 8 33.6 3.3
121 1 9 2 21.617 43.234 0.239 12.13 8 117.9 40.4
122 1 12 0 21.617 43.234 0.239 12.13 4 117.1 19.9
123 0 3 3 21.729 43.458 0.24 11.99 4 143.0 29.4
124 1 2 3 21.75 43.5 0.241 11.97 8 45.0 5.8
125 4 2 2 21.782 43.565 0.241 11.93 8 104.7 31.3
126 5 2 1 21.802 43.604 0.241 11.9 8 71.6 14.6
127 1 3 3 22.126 44.251 0.244 11.51 8 0.4 0.0
128 4 3 2 22.158 44.315 0.245 11.48 8 102.4 28.8
129 5 3 1 22.177 44.354 0.245 11.45 8 12.0 0.4
130 0 4 3 22.254 44.508 0.246 11.36 4 25.4 0.9
131 2 11 1 22.262 44.525 0.246 11.36 8 79.1 17.0
132 3 7 2 22.384 44.768 0.247 11.22 8 57.7 8.9
133 0 12 1 22.402 44.804 0.247 11.2 4 10.7 0.2
134 2 0 3 22.631 45.263 0.25 10.94 4 3.9 0.0
135 0 10 2 22.641 45.283 0.25 10.93 4 147.4 28.4
136 1 4 3 22.644 45.287 0.25 10.93 8 63.5 10.5
137 3 10 1 22.66 45.321 0.25 10.91 8 49.1 6.3
138 4 4 2 22.675 45.35 0.25 10.89 8 121.5 38.5
139 5 4 1 22.694 45.387 0.25 10.87 8 23.8 1.5
140 2 1 3 22.705 45.409 0.251 10.86 8 63.1 10.3
141 4 8 1 22.73 45.46 0.251 10.84 8 126.4 41.4
142 1 12 1 22.79 45.58 0.251 10.77 8 38.1 3.7
143 2 9 2 22.796 45.592 0.252 10.76 8 94.6 23.1
144 2 12 0 22.796 45.592 0.252 10.76 4 107.8 15.0
145 0 5 3 22.915 45.83 0.253 10.64 4 43.1 2.4
146 2 2 3 22.923 45.847 0.253 10.63 8 44.4 5.0
147 5 6 0 23.003 46.006 0.254 10.55 4 10.2 0.1
148 1 10 2 23.026 46.052 0.254 10.52 8 118.2 35.2
149 2 3 3 23.284 46.568 0.257 10.26 8 96.5 22.9
150 1 5 3 23.296 46.592 0.257 10.25 8 43.3 4.6
151 4 5 2 23.327 46.653 0.257 10.22 8 120.2 35.4
152 5 5 1 23.345 46.69 0.257 10.2 8 153.7 57.7
153 3 8 2 23.473 46.946 0.259 10.07 8 12.8 0.4
154 0 6 3 23.703 47.407 0.261 9.85 4 224.9 59.7
155 2 4 3 23.782 47.564 0.262 9.78 8 10.4 0.3
156 2 12 1 23.923 47.846 0.263 9.65 8 24.3 1.4
157 4 9 1 23.947 47.894 0.263 9.63 8 78.1 14.0
158 1 6 3 24.075 48.15 0.265 9.51 8 80.1 14.6
159 4 6 2 24.105 48.209 0.265 9.48 8 29.0 1.9
160 5 6 1 24.123 48.245 0.265 9.47 8 70.9 11.4
161 0 11 2 24.143 48.285 0.265 9.45 4 145.4 23.9
162 2 10 2 24.151 48.301 0.266 9.44 8 20.4 0.9
163 3 11 1 24.161 48.321 0.266 9.44 8 43.4 4.2
164 4 10 0 24.175 48.349 0.266 9.42 4 76.4 6.6
165 0 13 1 24.195 48.39 0.266 9.4 4 33.4 1.3
166 2 5 3 24.411 48.822 0.268 9.22 8 16.9 0.6
167 1 11 2 24.509 49.018 0.269 9.13 8 80.1 14.0
168 6 0 0 24.561 49.121 0.27 9.09 2 218.1 25.9
169 1 13 1 24.561 49.121 0.27 9.09 8 101.1 22.2
170 3 1 3 24.576 49.153 0.27 9.08 8 13.6 0.4
171 0 7 3 24.61 49.221 0.27 9.05 4 88.2 8.4
172 3 9 2 24.662 49.325 0.271 9.0 8 147.1 46.6
173 3 12 0 24.662 49.325 0.271 9.0 4 155.6 26.1
174 3 2 3 24.782 49.565 0.272 8.91 8 4.1 0.0
175 6 2 0 24.835 49.67 0.273 8.86 4 168.6 30.1
176 5 1 2 24.967 49.934 0.274 8.76 8 44.4 4.1
177 5 8 0 24.967 49.934 0.274 8.76 4 142.8 21.4
178 0 14 0 24.97 49.939 0.274 8.75 2 293.2 45.0
179 1 7 3 24.972 49.943 0.274 8.75 8 49.2 5.1
180 4 7 2 25.001 50.001 0.274 8.73 8 136.3 38.8
181 5 7 1 25.018 50.036 0.275 8.72 8 134.8 37.9
182 3 3 3 25.123 50.246 0.276 8.63 8 33.7 2.4
183 2 6 3 25.164 50.328 0.276 8.6 8 115.1 27.3
184 5 2 2 25.171 50.341 0.276 8.6 8 4.3 0.0
185 4 10 1 25.255 50.509 0.277 8.53 8 63.9 8.3
186 1 14 0 25.327 50.654 0.278 8.48 4 125.7 16.0
187 5 3 2 25.507 51.015 0.28 8.34 8 38.6 3.0
188 2 11 2 25.584 51.169 0.28 8.28 8 1.8 0.0
189 3 4 3 25.594 51.188 0.28 8.28 8 98.2 19.1
190 0 8 3 25.627 51.254 0.281 8.25 4 149.0 21.9
191 6 0 1 25.629 51.258 0.281 8.25 4 32.2 1.0
192 2 13 1 25.635 51.269 0.281 8.25 8 75.8 11.3
193 6 4 0 25.645 51.291 0.281 8.24 4 185.8 34.0
194 6 1 1 25.695 51.391 0.281 8.2 8 11.4 0.3
195 0 12 2 25.71 51.421 0.282 8.19 4 28.2 0.8
196 3 12 1 25.727 51.455 0.282 8.18 8 17.3 0.6
197 6 2 1 25.895 51.79 0.283 8.06 8 35.5 2.4
198 3 10 2 25.943 51.886 0.284 8.02 8 52.6 5.3
199 5 4 2 25.973 51.947 0.284 8.0 8 125.5 30.2
200 1 8 3 25.978 51.955 0.284 8.0 8 70.5 9.5
201 4 8 2 26.006 52.012 0.285 7.98 8 129.8 32.2
202 5 8 1 26.023 52.046 0.285 7.97 8 46.3 4.1
203 0 14 1 26.025 52.051 0.285 7.97 4 32.1 1.0
204 2 7 3 26.033 52.066 0.285 7.96 8 37.4 2.7
205 1 12 2 26.06 52.121 0.285 7.94 8 7.5 0.1
206 3 5 3 26.191 52.381 0.286 7.85 8 5.9 0.1
207 6 3 1 26.225 52.45 0.287 7.83 8 4.2 0.0
208 1 14 1 26.373 52.745 0.288 7.73 8 39.3 2.9
209 2 14 0 26.378 52.756 0.288 7.73 4 112.8 11.8
210 5 5 2 26.564 53.128 0.29 7.6 8 43.3 3.4
211 4 11 1 26.645 53.29 0.291 7.55 8 34.0 2.1
212 6 4 1 26.682 53.364 0.291 7.53 8 31.3 1.8
213 0 9 3 26.745 53.49 0.292 7.49 4 148.3 19.7
214 3 6 3 26.907 53.815 0.294 7.38 8 66.0 7.7
215 6 6 0 26.957 53.914 0.294 7.35 4 34.7 1.1
216 4 0 3 26.969 53.937 0.294 7.35 4 106.2 9.9
217 2 8 3 27.011 54.022 0.295 7.32 8 1.4 0.0
218 4 1 3 27.033 54.066 0.295 7.31 8 12.1 0.3
219 1 9 3 27.086 54.171 0.296 7.27 8 1.1 0.0
220 2 12 2 27.091 54.183 0.296 7.27 8 116.9 23.8
221 4 9 2 27.113 54.227 0.296 7.26 8 209.1 75.9
222 4 12 0 27.113 54.227 0.296 7.26 4 115.6 11.6
223 5 9 1 27.13 54.26 0.296 7.25 8 61.9 6.6
224 4 2 3 27.225 54.451 0.297 7.19 8 65.1 7.3
225 6 5 1 27.262 54.524 0.297 7.17 8 7.3 0.1
226 5 6 2 27.274 54.548 0.297 7.16 8 13.7 0.3
227 3 11 2 27.309 54.617 0.298 7.14 8 50.4 4.3
228 5 10 0 27.338 54.676 0.298 7.12 4 37.9 1.2
229 0 13 2 27.34 54.68 0.298 7.12 4 66.2 3.7
230 3 13 1 27.357 54.713 0.298 7.11 8 41.7 3.0
231 2 14 1 27.395 54.791 0.299 7.09 8 39.5 2.6
232 4 3 3 27.544 55.089 0.3 7.0 8 51.6 4.5
233 1 13 2 27.676 55.351 0.301 6.93 8 39.2 2.5
234 3 7 3 27.738 55.475 0.302 6.89 8 18.7 0.6
235 0 15 1 27.895 55.79 0.304 6.8 4 52.6 2.3
236 0 10 3 27.958 55.916 0.304 6.77 4 42.5 1.5
237 6 6 1 27.96 55.919 0.304 6.77 8 66.9 7.3
238 4 4 3 27.987 55.973 0.305 6.75 8 89.2 12.9
239 3 14 0 28.068 56.137 0.305 6.71 4 7.3 0.0
240 2 9 3 28.091 56.181 0.306 6.7 8 18.1 0.5
241 5 7 2 28.097 56.194 0.306 6.69 8 101.5 16.5
242 4 12 1 28.112 56.224 0.306 6.68 8 50.0 4.0
243 1 15 1 28.226 56.452 0.307 6.62 8 87.4 12.1
244 1 10 3 28.289 56.577 0.308 6.59 8 119.5 22.5
245 4 10 2 28.315 56.631 0.308 6.58 8 210.0 69.4
246 5 10 1 28.331 56.663 0.308 6.57 8 84.1 11.1
247 4 5 3 28.549 57.097 0.31 6.46 8 37.1 2.1
248 0 0 4 28.598 57.196 0.311 6.43 2 125.9 6.1
249 0 1 4 28.66 57.319 0.311 6.4 4 229.3 40.2
250 6 0 2 28.661 57.323 0.311 6.4 4 124.1 11.8
251 2 13 2 28.667 57.334 0.311 6.4 8 127.8 25.0
252 3 8 3 28.676 57.351 0.311 6.39 8 107.5 17.7
253 6 1 2 28.723 57.447 0.312 6.37 8 222.8 75.6
254 6 8 0 28.723 57.447 0.312 6.37 4 202.5 31.2
255 3 12 2 28.753 57.506 0.312 6.35 8 63.7 6.2
256 6 7 1 28.77 57.539 0.312 6.34 8 61.4 5.7
257 0 2 4 28.845 57.69 0.313 6.31 4 166.1 20.8
258 0 16 0 28.845 57.69 0.313 6.31 2 143.3 7.7
259 6 2 2 28.908 57.817 0.314 6.28 8 69.5 7.3
260 1 1 4 28.985 57.97 0.315 6.24 8 87.6 11.5
261 5 8 2 29.027 58.055 0.315 6.22 8 59.3 5.2
262 0 14 2 29.03 58.059 0.315 6.22 4 58.5 2.5
263 3 14 1 29.045 58.091 0.315 6.21 8 25.8 1.0
264 0 3 4 29.152 58.304 0.316 6.16 4 227.1 38.0
265 1 2 4 29.169 58.338 0.316 6.15 8 140.1 28.9
266 1 16 0 29.169 58.338 0.316 6.15 4 129.7 12.4
267 2 15 1 29.205 58.41 0.317 6.13 8 64.7 6.1
268 6 3 2 29.215 58.43 0.317 6.13 8 56.7 4.7
269 4 6 3 29.226 58.452 0.317 6.12 8 187.3 51.4
270 7 2 0 29.253 58.506 0.317 6.11 4 95.2 6.6
271 0 11 3 29.259 58.518 0.317 6.11 4 62.5 2.9
272 2 10 3 29.266 58.532 0.317 6.1 8 1.7 0.0
273 1 14 2 29.352 58.705 0.318 6.06 8 76.0 8.4
274 1 3 4 29.474 58.948 0.319 6.01 8 127.3 23.3
275 0 4 4 29.579 59.158 0.32 5.96 4 34.7 0.9
276 1 11 3 29.581 59.161 0.32 5.96 8 0.2 0.0
277 4 11 2 29.607 59.213 0.321 5.95 8 194.0 53.6
278 5 11 1 29.622 59.244 0.321 5.94 8 31.0 1.4
279 6 4 2 29.641 59.282 0.321 5.93 8 32.4 1.5
280 4 13 1 29.652 59.304 0.321 5.93 8 52.0 3.8
281 6 8 1 29.687 59.373 0.321 5.91 8 45.2 2.9
282 3 9 3 29.716 59.431 0.322 5.9 8 11.5 0.2
283 0 16 1 29.806 59.612 0.323 5.86 4 28.1 0.6
284 2 0 4 29.888 59.776 0.323 5.82 4 62.9 2.8
285 1 4 4 29.898 59.796 0.324 5.82 8 59.5 4.9
286 2 1 4 29.948 59.897 0.324 5.8 8 15.7 0.3
287 7 4 0 29.981 59.961 0.324 5.78 4 140.2 13.6
288 5 1 3 29.984 59.969 0.324 5.78 8 13.2 0.2
289 4 7 3 30.014 60.028 0.325 5.77 8 20.4 0.6
290 7 1 1 30.026 60.051 0.325 5.76 8 122.1 20.6
291 5 9 2 30.06 60.119 0.325 5.75 8 6.2 0.1
292 5 12 0 30.06 60.119 0.325 5.75 4 117.6 9.5
293 0 5 4 30.122 60.244 0.326 5.72 4 118.4 9.6
294 1 16 1 30.124 60.247 0.326 5.72 8 66.5 6.0
295 2 2 4 30.129 60.257 0.326 5.72 8 41.8 2.4
296 2 16 0 30.129 60.257 0.326 5.72 4 139.5 13.3
297 5 2 3 30.165 60.329 0.326 5.7 8 54.8 4.1
298 6 5 2 30.183 60.367 0.326 5.7 8 7.4 0.1
299 7 2 1 30.206 60.411 0.327 5.69 8 11.7 0.2
300 3 13 2 30.272 60.544 0.327 5.66 8 111.8 16.9
301 2 14 2 30.308 60.617 0.328 5.64 8 75.4 7.7
302 4 14 0 30.329 60.658 0.328 5.63 4 172.9 20.2
303 2 3 4 30.428 60.855 0.329 5.59 8 83.5 9.3
304 1 5 4 30.438 60.875 0.329 5.59 8 2.7 0.0
305 5 3 3 30.463 60.927 0.329 5.58 8 31.9 1.4
306 7 3 1 30.504 61.009 0.329 5.56 8 4.1 0.0
307 2 11 3 30.532 61.064 0.33 5.55 8 40.8 2.2
308 0 12 3 30.644 61.288 0.331 5.51 4 69.6 3.2
309 6 9 1 30.705 61.41 0.331 5.48 8 81.0 8.6
310 0 6 4 30.778 61.555 0.332 5.45 4 33.2 0.7
311 0 15 2 30.778 61.555 0.332 5.45 4 96.1 6.0
312 3 15 1 30.793 61.586 0.332 5.45 8 57.0 4.2
313 6 6 2 30.838 61.677 0.333 5.43 8 95.8 11.9
314 2 4 4 30.844 61.687 0.333 5.43 8 5.4 0.0
315 3 10 3 30.852 61.704 0.333 5.42 8 119.0 18.4
316 5 4 3 30.879 61.758 0.333 5.41 8 26.7 0.9
317 6 10 0 30.898 61.795 0.333 5.41 4 270.1 47.2
318 4 8 3 30.908 61.816 0.333 5.4 8 158.3 32.4
319 7 4 1 30.92 61.839 0.334 5.4 8 24.3 0.8
320 1 12 3 30.957 61.913 0.334 5.38 8 24.8 0.8
321 4 12 2 30.982 61.964 0.334 5.37 8 46.8 2.8
322 5 12 1 30.997 61.994 0.334 5.37 8 8.8 0.1
323 2 16 1 31.065 62.13 0.335 5.34 8 65.5 5.5
324 1 6 4 31.089 62.179 0.335 5.33 8 6.8 0.1
325 1 15 2 31.089 62.179 0.335 5.33 8 55.9 4.0
326 7 6 0 31.17 62.34 0.336 5.3 4 103.4 6.8
327 5 10 2 31.189 62.377 0.336 5.3 8 52.1 3.4
328 4 14 1 31.262 62.523 0.337 5.27 8 1.7 0.0
329 2 5 4 31.373 62.747 0.338 5.23 8 54.4 3.7
330 5 5 3 31.409 62.817 0.338 5.21 8 79.5 7.9
331 7 5 1 31.449 62.898 0.339 5.2 8 115.6 16.6
332 3 1 4 31.514 63.027 0.339 5.18 8 98.8 12.1
333 0 7 4 31.542 63.085 0.34 5.17 4 22.2 0.3
334 6 7 2 31.602 63.205 0.34 5.14 8 112.4 15.6
335 3 2 4 31.689 63.377 0.341 5.11 8 78.2 7.5
336 3 16 0 31.689 63.377 0.341 5.11 4 82.8 4.2
337 0 17 1 31.761 63.522 0.342 5.09 4 154.9 14.6
338 6 10 1 31.821 63.642 0.342 5.07 8 77.8 7.3
339 1 7 4 31.85 63.7 0.343 5.06 8 63.5 4.9
340 3 14 2 31.863 63.726 0.343 5.05 8 28.4 1.0
341 2 12 3 31.884 63.768 0.343 5.05 8 38.9 1.8
342 4 9 3 31.904 63.808 0.343 5.04 8 64.2 5.0
343 3 3 4 31.979 63.958 0.344 5.01 8 112.1 15.1
344 2 6 4 32.014 64.029 0.344 5.0 8 30.4 1.1
345 2 15 2 32.014 64.029 0.344 5.0 8 174.1 36.3
346 5 6 3 32.049 64.098 0.344 4.99 8 120.4 17.3
347 1 17 1 32.067 64.135 0.345 4.98 8 91.2 9.9
348 3 11 3 32.081 64.161 0.345 4.98 8 7.4 0.1
349 7 6 1 32.089 64.178 0.345 4.98 8 24.7 0.7
350 0 13 3 32.109 64.218 0.345 4.97 4 31.8 0.6
351 3 4 4 32.384 64.767 0.348 4.88 8 16.6 0.3
352 5 11 2 32.41 64.82 0.348 4.87 8 128.6 19.3
353 0 8 4 32.412 64.824 0.348 4.87 4 116.0 7.8
354 1 13 3 32.414 64.827 0.348 4.87 8 28.9 1.0
355 4 13 2 32.438 64.877 0.348 4.86 8 107.9 13.5
356 5 13 1 32.453 64.906 0.348 4.86 8 125.5 18.3
357 6 8 2 32.471 64.942 0.348 4.85 8 8.8 0.1
358 0 16 2 32.585 65.169 0.35 4.81 4 30.2 0.5
359 3 16 1 32.599 65.199 0.35 4.81 8 52.6 3.2
360 1 8 4 32.715 65.43 0.351 4.77 8 72.1 5.9
361 2 7 4 32.763 65.526 0.351 4.76 8 59.2 4.0
362 7 1 2 32.794 65.587 0.352 4.75 8 104.3 12.4
363 7 8 0 32.794 65.587 0.352 4.75 4 25.5 0.4
364 5 7 3 32.797 65.595 0.352 4.75 8 43.7 2.2
365 7 7 1 32.837 65.673 0.352 4.73 8 26.7 0.8
366 0 18 0 32.871 65.742 0.352 4.72 2 148.9 6.3
367 1 16 2 32.887 65.774 0.352 4.72 8 48.1 2.6
368 3 5 4 32.9 65.8 0.353 4.72 8 3.9 0.0
369 4 15 1 32.94 65.88 0.353 4.7 8 44.6 2.2
370 7 2 2 32.965 65.93 0.353 4.7 8 4.8 0.0
371 2 17 1 32.977 65.955 0.353 4.69 8 99.3 11.1
372 4 10 3 32.997 65.994 0.354 4.69 8 31.2 1.1
373 6 11 1 33.029 66.059 0.354 4.68 8 93.6 9.8
374 5 14 0 33.097 66.194 0.354 4.66 4 173.1 16.7
375 1 18 0 33.172 66.344 0.355 4.63 4 47.4 1.2
376 7 3 2 33.25 66.499 0.356 4.61 8 54.0 3.2
377 6 0 3 33.314 66.627 0.357 4.59 4 6.7 0.0
378 2 13 3 33.319 66.637 0.357 4.59 8 28.2 0.9
379 6 1 3 33.37 66.741 0.357 4.57 8 68.3 5.1
380 0 9 4 33.383 66.766 0.357 4.57 4 109.0 6.5
381 3 12 3 33.398 66.795 0.357 4.57 8 54.5 3.2
382 6 9 2 33.441 66.883 0.358 4.55 8 48.1 2.5
383 6 12 0 33.441 66.883 0.358 4.55 4 32.5 0.6
384 3 6 4 33.525 67.05 0.359 4.53 8 16.5 0.3
385 3 15 2 33.525 67.05 0.359 4.53 8 12.7 0.2
386 6 2 3 33.54 67.081 0.359 4.53 8 57.7 3.6
387 4 0 4 33.579 67.157 0.359 4.52 4 109.7 6.5
388 2 8 4 33.616 67.232 0.359 4.5 8 71.1 5.4
389 4 1 4 33.635 67.27 0.36 4.5 8 103.0 11.4
390 7 4 2 33.646 67.292 0.36 4.5 8 52.6 3.0
391 5 8 3 33.65 67.3 0.36 4.5 8 61.9 4.1
392 0 14 3 33.652 67.304 0.36 4.49 4 1.0 0.0
393 8 0 0 33.656 67.312 0.36 4.49 2 391.8 41.3
394 1 9 4 33.682 67.363 0.36 4.49 8 20.5 0.5
395 7 8 1 33.688 67.377 0.36 4.48 8 33.0 1.2
396 5 12 2 33.72 67.441 0.36 4.48 8 8.7 0.1
397 0 18 1 33.765 67.529 0.361 4.46 4 35.7 0.7
398 2 16 2 33.785 67.57 0.361 4.46 8 14.9 0.2
399 4 2 4 33.804 67.609 0.361 4.45 8 73.3 5.7
400 4 16 0 33.805 67.609 0.361 4.45 4 54.8 1.6
401 6 3 3 33.823 67.645 0.361 4.45 8 105.4 11.8
402 8 2 0 33.882 67.763 0.362 4.43 4 198.6 20.9
403 1 14 3 33.949 67.898 0.363 4.41 8 28.3 0.8
404 4 14 2 33.973 67.947 0.363 4.41 8 64.4 4.4
405 5 14 1 33.988 67.976 0.363 4.4 8 2.0 0.0
406 1 18 1 34.062 68.123 0.364 4.38 8 99.9 10.5
407 2 18 0 34.066 68.133 0.364 4.38 4 25.2 0.3
408 4 3 4 34.086 68.171 0.364 4.38 8 92.4 8.9
409 7 5 2 34.152 68.305 0.364 4.36 8 81.6 6.9
410 4 11 3 34.184 68.367 0.365 4.35 8 28.9 0.9
411 6 4 3 34.216 68.431 0.365 4.34 8 20.3 0.4
412 3 7 4 34.257 68.513 0.365 4.33 8 65.5 4.4
413 6 12 1 34.328 68.655 0.366 4.31 8 26.0 0.7
414 0 10 4 34.452 68.904 0.367 4.28 4 40.8 0.9
415 0 17 2 34.452 68.904 0.367 4.28 4 74.3 2.8
416 3 17 1 34.466 68.932 0.367 4.28 8 2.8 0.0
417 4 4 4 34.477 68.955 0.367 4.27 8 46.7 2.2
418 6 10 2 34.509 69.018 0.368 4.27 8 32.2 1.1
419 8 0 1 34.54 69.08 0.368 4.26 4 10.8 0.1
420 8 4 0 34.554 69.108 0.368 4.25 4 42.2 0.9
421 2 9 4 34.57 69.14 0.368 4.25 8 131.0 17.4
422 8 1 1 34.596 69.191 0.369 4.24 8 16.8 0.3
423 5 9 3 34.603 69.206 0.369 4.24 8 13.9 0.2
424 7 9 1 34.641 69.283 0.369 4.23 8 104.1 11.0
425 4 16 1 34.686 69.373 0.369 4.22 8 13.4 0.2
426 6 5 3 34.718 69.436 0.37 4.21 8 25.3 0.6
427 1 10 4 34.746 69.492 0.37 4.21 8 2.9 0.0
428 1 17 2 34.746 69.492 0.37 4.21 8 19.4 0.4
429 8 2 1 34.763 69.525 0.37 4.2 8 5.1 0.0
430 7 6 2 34.767 69.533 0.37 4.2 8 39.0 1.5
431 3 13 3 34.8 69.601 0.37 4.19 8 27.6 0.8
432 7 10 0 34.822 69.644 0.371 4.19 4 78.7 3.1
433 2 14 3 34.834 69.668 0.371 4.18 8 39.4 1.6
434 2 18 1 34.945 69.89 0.372 4.16 8 16.1 0.3
435 4 5 4 34.978 69.956 0.372 4.15 8 70.3 4.9
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 3.457 6.915 12.773 2800.1 100.0 100.0 5.5
2 1 2 0 5.27 10.54 8.38654 738.6 26.4 26.3 5.6
3 0 0 1 6.873 13.745 6.437 231.1 8.3 8.2 5.6
4 0 1 1 7.089 14.177 6.24189 167.4 6.0 6.0 5.6
5 0 2 1 7.701 15.402 5.74831 30.6 1.1 1.1 5.6
6 1 4 0 7.995 15.99 5.53799 411.9 14.7 14.6 5.6
7 1 1 1 8.136 16.272 5.4429 306.4 10.9 10.9 5.6
8 0 3 1 8.627 17.255 5.13495 147.5 5.3 5.2 5.6
9 2 2 0 8.691 17.382 5.09757 207.1 7.4 7.4 5.6
10 0 4 1 9.782 19.564 4.53369 109.7 3.9 3.9 5.6
11 0 6 0 10.423 20.846 4.25767 236.0 8.4 8.4 5.6
12 2 4 0 10.585 21.17 4.19327 176.0 6.3 6.2 5.6
13 2 1 1 10.693 21.385 4.15154 46.4 1.7 1.6 5.6
14 0 5 1 11.098 22.195 4.00184 47.1 1.7 1.7 5.6
15 1 5 1 11.804 23.608 3.76539 393.7 14.1 13.9 5.6
16 0 6 1 12.528 25.055 3.55114 61.9 2.2 2.2 5.6
17 2 6 0 13.172 26.344 3.38027 39.8 1.4 1.4 5.6
18 3 4 0 13.904 27.807 3.20562 113.5 4.1 4.0 5.6
19 0 8 0 13.959 27.917 3.19325 94.1 3.4 3.3 5.6
20 3 1 1 13.987 27.974 3.18686 226.4 8.1 8.0 5.6
21 1 1 2 14.535 29.07 3.06919 172.7 6.2 6.1 5.6
22 1 7 1 14.615 29.23 3.05271 156.4 5.6 5.5 5.6
23 1 3 2 15.371 30.742 2.90599 38.0 1.4 1.3 5.6
24 0 8 1 15.621 31.242 2.8606 45.4 1.6 1.6 5.6
25 3 6 0 15.994 31.989 2.79551 97.4 3.5 3.4 5.6
26 4 0 0 16.087 32.175 2.77975 593.7 21.2 20.8 5.6
27 2 8 0 16.152 32.303 2.76899 992.5 35.4 34.8 5.6
28 2 7 1 16.225 32.449 2.75687 215.7 7.7 7.6 5.6
29 3 5 1 16.455 32.911 2.71925 266.4 9.5 9.3 5.6
30 2 3 2 16.915 33.831 2.64738 34.8 1.2 1.2 5.7
31 0 10 1 18.929 37.859 2.37445 49.5 1.8 1.7 5.7
32 1 7 2 19.059 38.118 2.35892 28.6 1.0 1.0 5.7
33 2 6 2 19.297 38.594 2.33091 89.0 3.2 3.1 5.7
34 2 10 0 19.38 38.76 2.32127 121.7 4.3 4.2 5.7
35 2 7 2 20.358 40.716 2.21417 96.5 3.4 3.4 5.7
36 3 9 1 21.233 42.465 2.12694 152.3 5.4 5.3 5.7
37 4 1 2 21.555 43.109 2.09664 107.7 3.8 3.7 5.7
38 1 12 0 21.617 43.234 2.09086 63.6 2.3 2.2 5.7
39 0 3 3 21.729 43.458 2.08063 35.1 1.3 1.2 5.7
40 4 2 2 21.782 43.565 2.07577 45.9 1.6 1.6 5.7
41 4 3 2 22.158 44.315 2.04233 29.2 1.0 1.0 5.7
42 0 10 2 22.641 45.283 2.00092 45.2 1.6 1.6 5.7
43 4 4 2 22.675 45.35 1.99812 40.0 1.4 1.4 5.7
44 4 8 1 22.73 45.46 1.99355 51.8 1.8 1.8 5.7
45 2 12 0 22.796 45.592 1.98807 41.8 1.5 1.4 5.7
46 1 10 2 23.026 46.052 1.96929 35.2 1.3 1.2 5.7
47 5 5 1 23.345 46.69 1.94384 93.0 3.3 3.2 5.7
48 0 6 3 23.703 47.407 1.9161 59.7 2.1 2.1 5.7
49 0 11 2 24.143 48.285 1.88328 42.4 1.5 1.5 5.7
50 6 0 0 24.561 49.121 1.85317 48.5 1.7 1.7 5.7
51 3 9 2 24.662 49.325 1.846 72.7 2.6 2.5 5.7
52 6 2 0 24.835 49.67 1.83397 30.1 1.1 1.0 5.7
53 1 7 3 24.972 49.943 1.82458 75.6 2.7 2.6 5.7
54 4 7 2 25.001 50.001 1.82259 76.7 2.7 2.6 5.7
55 6 4 0 25.645 51.291 1.77975 68.3 2.4 2.4 5.8
56 5 4 2 25.973 51.947 1.75881 39.7 1.4 1.4 5.8
57 4 8 2 26.006 52.012 1.75676 39.9 1.4 1.4 5.8
58 4 9 2 27.113 54.227 1.69013 118.0 4.2 4.0 5.8
59 4 10 2 28.315 56.631 1.62395 103.0 3.7 3.5 5.8
60 0 1 4 28.66 57.319 1.60607 94.7 3.4 3.2 5.8
61 6 1 2 28.723 57.447 1.60281 106.9 3.8 3.6 5.8
62 0 2 4 28.845 57.69 1.59663 28.6 1.0 1.0 5.8
63 0 3 4 29.152 58.304 1.58126 79.3 2.8 2.7 5.8
64 4 6 3 29.226 58.452 1.57762 71.7 2.6 2.4 5.8
65 4 11 2 29.607 59.213 1.55914 54.9 2.0 1.9 5.8
66 2 16 0 30.129 60.257 1.53459 31.4 1.1 1.1 5.8
67 3 10 3 30.852 61.704 1.50204 30.3 1.1 1.0 5.8
68 6 10 0 30.898 61.795 1.50004 80.4 2.9 2.7 5.8
69 2 15 2 32.014 64.029 1.45299 37.4 1.3 1.3 5.9
70 5 11 2 32.41 64.82 1.43716 41.6 1.5 1.4 5.9
71 8 0 0 33.656 67.312 1.38988 65.2 2.3 2.2 5.9
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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