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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VUONNEMITE
4, f-murmanite-lomonosovite
[Na,H(2)O](8)(Ti++++,Na)(4)Nb(2)[Si(2)O(7)](2)[PO(4)](2)H+(4)O(3)F
Triclinic P 1 Z = 1
R =0.034 NR =460
21 .10 .11
Ref.Str.:
Rastsvetaeva R.K., Aksenov S.M., Verin I.A., Likova I.S. (2011)
* Kristallogr., 56, 441-444
R: from Lovozero massif, Russia.
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.4712 alpha = 92.62
b = 7.1626 beta = 95.13
c = 14.3702 gamma = 90.44
Unit cell volume (cub. angs.) = 560.26
Molar volume ( cub.cm/mol.) = 337.46
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.1757 0.3751 0.225 0.98 Nb = 1.00
2 0.5686 0.3984 0.6564 1.21 Nb = 0.8 , Tl = 0.2
3 0.8987 0.8862 0.4327 0.64 Ti = 1.00
4 0.3659 0.1334 0.4363 1.55 Na = 0.7 , Mn = 0.3
5 0.869 0.3823 0.4411 1.4 Na = 1.00
6 0.3707 0.648 0.4337 0.87 Na = 1.00
7 0.1696 0.8711 0.1978 1.76 Na = 0.74, Na = 0.0
8 0.6728 0.3736 0.0747 1.75 Na = 1.00
9 0.578 0.8743 0.6762 1.5 Na = 1.00
10 0.0518 0.8675 0.8394 1.47 Na = 1.00
11 0.6894 0.6657 0.2442 0.45 Si = 1.00
12 0.6788 0.0869 0.2518 0.48 Si = 1.00
13 0.0686 0.6806 0.6265 0.82 Si = 1.00
14 0.0585 0.1105 0.6385 0.74 Si = 1.00
15 0.557 0.6215 0.8759 1.48 P = 1.00
16 0.1909 0.1345 0.0044 1.44 P = 1.00
17 0.928 0.5777 0.1963 0.8 O = 1.00
18 0.6723 0.8769 0.2033 0.7 O = 1.00
19 0.7106 0.6785 0.3556 0.8 O = 1.00
20 0.4151 0.1745 0.2191 1.2 O = 1.00
21 0.0298 0.096 0.5237 1.1 O = 1.00
22 0.716 0.084 0.3651 0.7 O = 1.00
23 0.3106 0.2112 0.6816 1.1 O = 1.00
24 0.2007 0.3929 0.3482 1.3 O = 1.00
25 0.074 0.8962 0.6757 1.6 O = 1.00
26 0.8966 0.1987 0.21 1.4 O = 1.00
27 0.0374 0.6909 0.5171 1.4 O = 1.00
28 0.4387 0.5577 0.2002 1.5 O = 1.00
29 0.105 0.9595 0.0466 2.4 O = 1.00
30 0.141 0.889 0.3623 1.1 O = 1.00
31 0.828 0.2 0.6833 2.1 O = 1.00
32 0.5491 0.3745 0.5333 1.5 O = 1.00
33 0.1318 0.315 0.0676 1.2 O = 1.00
34 0.3259 0.5988 0.6641 1.7 O = 1.00
35 0.472 0.133 0.9976 3.5 O = 1.00
36 0.06 0.15 0.907 3.4 O = 1.00
37 0.7 0.607 0.9731 2.4 O = 1.00
38 0.608 0.443 0.814 2.2 O = 1.00
39 0.845 0.5799 0.6702 1.9 O = 1.00
40 0.636 0.8146 0.8335 2.3 O = 1.00
41 0.288 0.628 0.8853 2.5 O = 1.00
42 0.5966 0.8898 0.5148 1.2 F = 1.00
43 0.131 0.6301 0.0259 1.7 H(2)O = 1.00
44 0.622 0.1509 0.8589 2.0 H(2)O = 1.00
45 0.063 0.3959 0.8037 1.8 H(2)O = 1.00
46 0.71 0.9063 0.052 4.9 H(2)O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.1757 0.3751 0.225
2 2 0.5686 0.3984 0.6564
3 3 0.8987 0.8862 0.4327
4 4 0.3659 0.1334 0.4363
5 5 0.869 0.3823 0.4411
6 6 0.3707 0.648 0.4337
7 7 0.1696 0.8711 0.1978
8 8 0.6728 0.3736 0.0747
9 9 0.578 0.8743 0.6762
10 10 0.0518 0.8675 0.8394
11 11 0.6894 0.6657 0.2442
12 12 0.6788 0.0869 0.2518
13 13 0.0686 0.6806 0.6265
14 14 0.0585 0.1105 0.6385
15 15 0.557 0.6215 0.8759
16 16 0.1909 0.1345 0.0044
17 17 0.928 0.5777 0.1963
18 18 0.6723 0.8769 0.2033
19 19 0.7106 0.6785 0.3556
20 20 0.4151 0.1745 0.2191
21 21 0.0298 0.096 0.5237
22 22 0.716 0.084 0.3651
23 23 0.3106 0.2112 0.6816
24 24 0.2007 0.3929 0.3482
25 25 0.074 0.8962 0.6757
26 26 0.8966 0.1987 0.21
27 27 0.0374 0.6909 0.5171
28 28 0.4387 0.5577 0.2002
29 29 0.105 0.9595 0.0466
30 30 0.141 0.889 0.3623
31 31 0.828 0.2 0.6833
32 32 0.5491 0.3745 0.5333
33 33 0.1318 0.315 0.0676
34 34 0.3259 0.5988 0.6641
35 35 0.472 0.133 0.9976
36 36 0.06 0.15 0.907
37 37 0.7 0.607 0.9731
38 38 0.608 0.443 0.814
39 39 0.845 0.5799 0.6702
40 40 0.636 0.8146 0.8335
41 41 0.288 0.628 0.8853
42 42 0.5966 0.8898 0.5148
43 43 0.131 0.6301 0.0259
44 44 0.622 0.1509 0.8589
45 45 0.063 0.3959 0.8037
46 46 0.71 0.9063 0.052
X-ray density (g/cm cub.) = 3.22
MU (1/cm) = 210.36 Mass attenuation coefficient (cm**2/g) = 65.383
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Nb 2.604 6
2.0242 17
1.9557 20
1.7621 24
1.965 26
2.0034 28
2.274 33
2 Nb ,Tl 3.72 9
2.0071 23
2.0411 31
1.763 32
1.969 34
2.2634 38
1.9771 39
3.4675 44
3.2829 45
3.6309 45
3 Ti 2.736 6
2.0301 19
2.0294 21
1.9809 22
2.0026 27
1.7386 30
2.1145 42
4 Na ,Mn 2.976 6
2.3382 21
2.2735 22
2.4312 24
2.296 30
2.3309 32
2.4227 42
5 Na 2.976 6
2.615 19
2.54 21
2.4605 22
2.3499 24
2.5486 27
2.2895 32
6 Na 2.976 6
2.2705 19
2.2972 24
2.2852 27
2.3615 30
2.622 32
2.3259 42
7 Na ,Na 2.976 9
2.4723 17
2.7444 18
2.7296 18
2.5379 20
2.7983 26
2.6938 28
2.2888 29
2.3807 30
2.9389 43
8 Na 2.976 6
2.5374 17
2.5825 26
2.6179 28
2.5595 33
2.2322 35
2.2819 37
9 Na 2.976 8
2.8331 23
2.7177 25
2.7625 25
2.6884 31
2.3897 34
2.577 39
2.3142 40
2.3383 42
10 Na 2.976 4
2.3845 25
2.2025 36
2.2968 40
2.2434 41
11 Si 2.268 4
1.6459 17
1.6481 18
1.593 19
1.632 28
12 Si 2.268 4
1.6273 18
1.6173 20
1.6238 22
1.6061 26
13 Si 2.268 4
1.6677 25
1.5713 27
1.5882 34
1.6052 39
14 Si 2.268 4
1.6415 21
1.6116 23
1.6486 25
1.5924 31
15 P 2.4 4
1.5469 37
1.5651 38
1.6081 40
1.4908 41
16 P 2.4 4
1.5071 29
1.5976 33
1.5498 35
1.5233 36
17 O 3.432 11
2.5713 18
2.7432 19
2.9077 24
2.7359 26
2.7946 28
2.6855 28
3.316 30
2.8787 33
3.3522 37
2.8169 43
3.3629 46
18 O 3.432 8
2.5713 17
2.6571 19
2.5757 20
2.6913 22
2.5967 26
2.6073 28
3.2763 30
2.2216 46
19 O 3.432 8
2.7432 17
2.6571 18
2.9012 22
3.3914 24
2.7977 27
2.6754 28
2.7784 30
2.8047 42
20 O 3.432 10
2.5757 18
2.6562 22
2.7234 24
2.654 26
2.8351 26
2.7736 28
3.202 29
3.3993 30
2.7885 33
3.2263 35
21 O 3.432 8
2.7256 22
2.7157 23
2.6598 25
2.8995 27
2.8106 30
2.7098 31
3.322 32
2.7731 42
22 O 3.432 9
2.6913 18
2.9012 19
2.6562 20
2.7256 21
2.6773 26
2.7241 30
3.4284 30
3.312 32
2.7387 42
23 O 3.432 9
2.7157 21
2.5868 25
2.8305 31
2.6433 31
2.8835 32
2.8003 34
2.853 38
2.986 44
2.6276 45
24 O 3.432 7
2.9077 17
3.3914 19
2.7234 20
2.787 26
3.3449 27
2.8834 28
3.1393 32
25 O 3.432 7
2.6598 21
2.5868 23
2.6465 27
2.5706 31
2.5531 34
2.5751 39
3.3284 42
26 O 3.432 10
2.7359 17
2.5967 18
2.8351 20
2.654 20
2.6773 22
2.787 24
3.1448 29
3.386 30
2.6736 33
3.1146 46
27 O 3.432 9
2.7977 19
2.8995 21
3.3449 24
2.6465 25
2.7902 30
2.6336 34
2.6725 39
3.3685 42
2.8089 42
28 O 3.432 8
2.6855 17
2.7946 17
2.6073 18
2.6754 19
2.7736 20
2.8834 24
2.9243 33
2.9588 43
29 O 3.432 9
3.202 20
3.1448 26
2.5519 33
2.5232 35
2.4727 36
3.4134 37
2.3715 43
3.3293 46
2.2004 46
30 O 3.432 10
3.316 17
3.2763 18
2.7784 19
3.3993 20
2.8106 21
3.4284 22
2.7241 22
3.386 26
2.7902 27
3.1682 42
31 O 3.432 11
2.7098 21
2.6433 23
2.8305 23
2.5706 25
2.8678 32
3.3846 36
2.8536 38
2.7376 39
3.3643 42
2.8889 44
2.4429 45
32 O 3.432 7
3.322 21
3.312 22
2.8835 23
3.1393 24
2.8678 31
2.7874 34
2.79 39
33 O 3.432 9
2.8787 17
2.7885 20
2.6736 26
2.9243 28
2.5519 29
2.5353 35
2.5413 36
3.4002 37
2.3614 43
34 O 3.432 10
2.8003 23
2.5531 25
2.6336 27
2.7874 32
2.8141 38
2.8381 39
2.643 39
3.1733 40
3.2013 41
2.9927 45
35 O 3.432 7
3.2263 20
2.5232 29
2.5353 33
2.5069 36
3.3889 40
2.2309 44
2.2158 46
36 O 3.432 8
2.4727 29
3.3846 31
2.5413 33
2.5069 35
3.3929 40
3.2113 44
2.4341 44
2.3557 45
37 O 3.432 9
3.3522 17
3.4134 29
3.4002 33
2.5297 38
2.5521 40
2.4919 41
2.4137 43
3.2732 43
2.3767 46
38 O 3.432 10
2.853 23
2.8536 31
2.8141 34
2.5297 37
2.7492 39
2.6653 40
2.4705 41
2.2173 44
2.5312 45
2.988 45
39 O 3.432 10
2.5751 25
2.6725 27
2.7376 31
2.79 32
2.643 34
2.8381 34
2.7492 38
3.1287 40
3.4232 42
2.5857 45
40 O 3.432 9
3.1733 34
3.3889 35
3.3929 36
2.5521 37
2.6653 38
3.1287 39
2.5042 41
2.4225 44
3.1676 46
41 O 3.432 6
3.2013 34
2.4919 37
2.4705 38
2.5042 40
2.2646 43
2.2773 45
42 F 3.396 8
2.8047 19
2.7731 21
2.7387 22
3.3284 25
2.8089 27
3.3685 27
3.1682 30
3.3643 31
43 H(2)O 3.6 9
2.8169 17
2.9588 28
2.3715 29
2.3614 33
3.2732 37
2.4137 37
2.2646 41
3.5264 45
3.0849 46
44 H(2)O 3.6 11
2.986 23
2.8889 31
2.2309 35
2.4341 36
3.2113 36
3.5931 37
2.2173 38
2.4225 40
3.152 45
3.5831 45
3.3496 46
45 H(2)O 3.6 12
2.6276 23
2.4429 31
2.9927 34
2.3557 36
3.568 37
2.988 38
2.5312 38
2.5857 39
2.2773 41
3.5264 43
3.5831 44
3.152 44
46 H(2)O 3.6 12
3.3629 17
2.2216 18
3.5183 20
3.1146 26
2.2004 29
3.3293 29
2.2158 35
3.4714 36
2.3767 37
3.1676 40
3.0849 43
3.3496 44
X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 0 0 1 3.088 6.177 0.035 686.02 2 40.2 706.0
2 0 1 0 6.181 12.361 0.07 169.58 2 44.5 213.8
3 0 0 2 6.186 12.372 0.07 169.28 2 63.5 434.8
4 0 -1 1 6.784 13.567 0.077 140.38 2 12.5 14.0
5 0 1 1 7.043 14.086 0.08 130.06 2 28.5 67.1
6 1 0 0 8.127 16.254 0.092 97.14 2 6.0 2.2
7 -1 0 1 8.435 16.87 0.095 90.01 2 26.6 40.7
8 0 -1 2 8.553 17.106 0.097 87.48 2 97.9 534.2
9 1 0 1 8.96 17.92 0.101 79.52 2 60.6 186.0
10 0 1 2 8.965 17.93 0.101 79.43 2 61.4 191.1
11 0 0 3 9.302 18.603 0.105 73.63 2 53.4 133.8
12 -1 0 2 9.78 19.561 0.11 66.39 2 26.5 29.7
13 -1 1 0 10.176 20.353 0.115 61.16 2 79.4 245.7
14 1 1 0 10.294 20.589 0.116 59.72 2 23.7 21.4
15 -1 -1 1 10.455 20.91 0.118 57.83 2 133.3 654.9
16 -1 1 1 10.513 21.025 0.118 57.17 2 65.0 153.9
17 1 0 2 10.678 21.356 0.12 55.35 2 10.5 3.9
18 1 -1 1 10.774 21.548 0.121 54.33 2 69.1 165.3
19 0 -1 3 10.952 21.903 0.123 52.51 2 16.3 8.9
20 1 1 1 11.052 22.104 0.124 51.53 2 53.3 93.2
21 0 1 3 11.44 22.88 0.129 47.95 2 66.1 133.4
22 -1 -1 2 11.497 22.993 0.129 47.46 2 10.5 3.3
23 -1 1 2 11.707 23.413 0.132 45.7 2 51.5 77.1
24 -1 0 3 11.826 23.652 0.133 44.74 2 34.9 34.7
25 1 -1 2 12.176 24.351 0.137 42.09 2 56.3 84.9
26 0 2 0 12.435 24.869 0.14 40.27 2 22.6 13.1
27 0 0 4 12.445 24.891 0.14 40.19 2 103.4 274.0
28 1 1 2 12.57 25.141 0.141 39.36 2 46.1 53.4
29 0 -2 1 12.68 25.361 0.142 38.64 2 35.5 31.0
30 1 0 3 12.949 25.899 0.145 36.97 2 10.6 2.6
31 0 2 1 12.967 25.934 0.146 36.86 2 31.6 23.5
32 -1 -1 3 13.224 26.447 0.148 35.37 2 36.6 30.1
33 -1 1 3 13.545 27.09 0.152 33.61 2 88.1 166.2
34 0 -2 2 13.665 27.33 0.153 32.99 2 57.2 68.7
35 0 -1 4 13.672 27.345 0.153 32.95 2 7.1 1.1
36 1 -1 3 14.158 28.315 0.159 30.6 2 42.2 34.7
37 0 2 2 14.196 28.391 0.159 30.43 2 63.7 78.8
38 0 1 4 14.203 28.406 0.159 30.39 2 54.4 57.3
39 -1 0 4 14.293 28.586 0.16 29.99 2 12.0 2.8
40 1 1 3 14.63 29.259 0.164 28.53 2 34.1 21.2
41 -1 2 0 14.844 29.687 0.166 27.66 2 7.6 1.0
42 1 2 0 15.009 30.019 0.168 27.01 2 33.2 19.0
43 -1 -2 1 15.061 30.122 0.169 26.81 2 105.3 189.4
44 -1 2 1 15.143 30.287 0.17 26.5 2 104.6 184.6
45 1 -2 1 15.209 30.417 0.17 26.26 2 100.6 169.4
46 0 -2 3 15.256 30.513 0.171 26.08 2 34.2 19.4
47 -1 -1 4 15.424 30.849 0.173 25.47 2 86.5 121.5
48 1 0 4 15.554 31.109 0.174 25.02 2 44.2 31.1
49 1 2 1 15.612 31.223 0.175 24.82 2 107.5 182.6
50 0 0 5 15.628 31.255 0.175 24.77 2 192.0 581.4
51 -1 -2 2 15.761 31.521 0.176 24.32 2 41.9 27.2
52 -1 1 4 15.823 31.646 0.177 24.11 2 16.6 4.2
53 0 2 3 15.974 31.948 0.179 23.62 2 56.5 48.1
54 -1 2 2 16.074 32.149 0.18 23.31 2 28.4 11.9
55 1 -2 2 16.198 32.395 0.181 22.92 2 196.9 566.3
56 2 0 0 16.423 32.846 0.184 22.25 2 120.7 206.6
57 -2 0 1 16.44 32.881 0.184 22.2 2 146.2 302.5
58 1 -1 4 16.532 33.065 0.185 21.93 2 61.3 52.5
59 0 -1 5 16.583 33.166 0.185 21.79 2 38.8 20.9
60 1 2 2 16.805 33.609 0.188 21.17 2 173.1 404.3
61 2 0 1 17.01 34.02 0.19 20.61 2 39.2 20.1
62 -1 0 5 17.023 34.046 0.19 20.58 2 59.5 46.5
63 -1 -2 3 17.037 34.073 0.19 20.54 2 110.7 160.5
64 1 1 4 17.055 34.11 0.19 20.5 2 88.0 101.1
65 -2 0 2 17.06 34.12 0.19 20.48 2 97.8 124.7
66 0 1 5 17.141 34.282 0.191 20.27 2 32.3 13.5
67 0 -2 4 17.305 34.61 0.193 19.86 2 10.1 1.3
68 -2 1 0 17.538 35.076 0.196 19.28 2 15.3 2.9
69 -1 2 3 17.547 35.093 0.196 19.26 2 138.9 236.7
70 -2 1 1 17.608 35.217 0.196 19.12 2 19.0 4.4
71 -2 -1 1 17.644 35.288 0.197 19.03 2 11.3 1.5
72 2 1 0 17.681 35.363 0.197 18.94 2 23.9 6.9
73 1 -2 3 17.718 35.435 0.198 18.86 2 15.0 2.7
74 -1 -1 5 17.947 35.895 0.2 18.34 2 71.8 60.2
75 2 -1 1 18.04 36.081 0.201 18.13 2 23.3 6.3
76 2 0 2 18.149 36.298 0.202 17.89 2 30.0 10.2
77 0 2 4 18.16 36.32 0.202 17.87 2 7.4 0.6
78 -2 -1 2 18.175 36.351 0.202 17.83 2 35.0 13.9
79 -2 0 3 18.228 36.456 0.203 17.72 2 93.3 98.3
80 -2 1 2 18.245 36.49 0.203 17.68 2 10.2 1.2
81 2 1 1 18.284 36.569 0.204 17.6 2 19.0 4.0
82 1 0 5 18.377 36.755 0.205 17.41 2 45.2 22.6
83 -1 1 5 18.401 36.801 0.205 17.36 2 38.4 16.3
84 1 2 3 18.487 36.974 0.206 17.18 2 8.2 0.7
85 -1 -2 4 18.786 37.572 0.209 16.58 2 65.1 44.8
86 0 3 0 18.844 37.687 0.21 16.47 2 33.6 11.8
87 0 0 6 18.86 37.721 0.21 16.44 2 87.2 79.7
88 0 -3 1 18.963 37.926 0.211 16.24 2 56.4 32.9
89 2 -1 2 19.076 38.152 0.212 16.03 2 16.0 2.6
90 1 -1 5 19.179 38.358 0.213 15.84 2 28.9 8.4
91 -2 -1 3 19.235 38.47 0.214 15.74 2 25.5 6.5
92 0 3 1 19.264 38.528 0.214 15.69 2 8.4 0.7
93 -2 1 3 19.401 38.801 0.216 15.44 2 17.0 2.9
94 2 1 2 19.408 38.816 0.216 15.43 2 14.2 2.0
95 -1 2 4 19.454 38.908 0.216 15.35 2 42.5 17.6
96 0 -3 2 19.614 39.229 0.218 15.07 2 43.1 17.8
97 0 -1 6 19.629 39.257 0.218 15.05 2 13.8 1.8
98 1 -2 4 19.663 39.326 0.218 14.99 2 17.4 2.9
99 0 -2 5 19.69 39.38 0.219 14.95 2 29.5 8.3
100 1 1 5 19.738 39.476 0.219 14.86 2 18.9 3.4
101 2 0 3 19.758 39.516 0.219 14.83 2 58.3 32.1
102 -2 0 4 19.861 39.722 0.221 14.66 2 20.6 4.0
103 -1 0 6 19.936 39.873 0.221 14.54 2 10.2 1.0
104 0 3 2 20.195 40.391 0.224 14.13 2 18.4 3.0
105 0 1 6 20.209 40.419 0.224 14.11 2 6.1 0.3
106 -1 3 0 20.55 41.101 0.228 13.59 2 31.2 8.5
107 1 2 4 20.559 41.118 0.228 13.58 2 13.6 1.6
108 2 -1 3 20.577 41.153 0.228 13.55 2 20.4 3.6
109 0 2 5 20.648 41.296 0.229 13.45 2 37.7 12.2
110 -2 2 0 20.693 41.385 0.229 13.38 2 70.1 41.9
111 -1 -1 6 20.702 41.405 0.229 13.37 2 42.6 15.5
112 -1 -3 1 20.73 41.461 0.23 13.33 2 19.1 3.1
113 1 3 0 20.738 41.476 0.23 13.32 2 15.7 2.1
114 -2 -1 4 20.754 41.509 0.23 13.29 2 25.9 5.7
115 0 -3 3 20.755 41.509 0.23 13.29 2 40.9 14.2
116 1 -3 1 20.78 41.561 0.23 13.25 2 33.5 9.5
117 -2 2 1 20.8 41.601 0.231 13.23 2 44.7 16.8
118 -1 3 1 20.824 41.648 0.231 13.19 2 43.8 16.1
119 -2 -2 1 20.862 41.724 0.231 13.14 2 35.4 10.5
120 -1 -2 5 20.91 41.82 0.232 13.07 2 7.8 0.5
121 2 2 0 20.941 41.882 0.232 13.03 2 85.3 60.4
122 2 1 3 20.981 41.963 0.232 12.97 2 10.5 0.9
123 -2 1 4 21.003 42.005 0.233 12.94 2 18.9 2.9
124 2 -2 1 21.085 42.17 0.234 12.83 2 67.0 36.7
125 -1 1 6 21.198 42.395 0.235 12.68 2 53.5 23.1
126 -1 -3 2 21.22 42.441 0.235 12.65 2 28.2 6.4
127 1 3 1 21.243 42.486 0.235 12.62 2 12.7 1.3
128 -2 -2 2 21.28 42.559 0.236 12.57 2 89.3 63.9
129 1 0 6 21.363 42.726 0.236 12.46 2 45.5 16.4
130 -2 2 2 21.402 42.804 0.237 12.41 2 61.2 29.6
131 1 -3 2 21.5 43.001 0.238 12.28 2 16.1 2.0
132 2 2 1 21.512 43.024 0.238 12.27 2 53.2 22.1
133 0 3 3 21.583 43.166 0.239 12.18 2 40.4 12.7
134 -1 3 2 21.585 43.171 0.239 12.17 2 38.3 11.4
135 -1 2 5 21.704 43.408 0.24 12.02 2 11.7 1.1
136 2 0 4 21.752 43.504 0.241 11.96 2 96.9 71.6
137 -2 0 5 21.874 43.749 0.242 11.81 2 27.3 5.6
138 1 -2 5 21.942 43.885 0.243 11.73 2 66.4 33.0
139 2 -2 2 21.955 43.91 0.243 11.72 2 71.6 38.3
140 1 -1 6 22.029 44.058 0.243 11.63 2 80.9 48.5
141 0 0 7 22.157 44.313 0.245 11.48 2 95.6 66.9
142 -2 -2 3 22.17 44.341 0.245 11.46 2 35.8 9.4
143 -1 -3 3 22.181 44.362 0.245 11.45 2 70.9 36.7
144 1 3 2 22.218 44.436 0.245 11.41 2 7.5 0.4
145 0 -3 4 22.323 44.646 0.247 11.29 2 26.0 4.9
146 0 -2 6 22.331 44.662 0.247 11.28 2 8.0 0.5
147 -2 2 3 22.465 44.93 0.248 11.13 2 57.9 23.8
148 2 -1 4 22.467 44.934 0.248 11.12 2 5.4 0.2
149 2 2 2 22.544 45.089 0.249 11.04 2 92.8 60.5
150 1 1 6 22.617 45.234 0.25 10.96 2 45.1 14.2
151 -2 -1 5 22.659 45.318 0.25 10.91 2 39.6 10.9
152 1 -3 3 22.673 45.346 0.25 10.9 2 42.7 12.6
153 0 -1 7 22.789 45.579 0.251 10.77 2 54.9 20.7
154 -1 3 3 22.795 45.591 0.251 10.76 2 24.5 4.1
155 2 1 4 22.931 45.863 0.253 10.62 2 12.0 1.0
156 1 2 5 22.938 45.876 0.253 10.61 2 79.9 43.1
157 -2 1 5 22.977 45.955 0.253 10.57 2 35.2 8.3
158 -1 0 7 22.997 45.994 0.254 10.55 2 46.1 14.3
159 2 -2 3 23.26 46.521 0.256 10.28 2 59.8 23.4
160 -1 -2 6 23.332 46.663 0.257 10.21 2 35.9 8.4
161 0 3 4 23.363 46.726 0.257 10.18 2 27.1 4.8
162 0 2 6 23.371 46.742 0.257 10.17 2 26.5 4.5
163 0 1 7 23.391 46.782 0.258 10.15 2 79.5 40.9
164 -2 -2 4 23.492 46.984 0.259 10.06 2 58.8 22.2
165 -1 -3 4 23.567 47.134 0.26 9.98 2 7.2 0.3
166 1 3 3 23.616 47.232 0.26 9.94 2 54.9 19.1
167 -1 -1 7 23.64 47.281 0.26 9.91 2 5.8 0.2
168 -2 2 4 23.942 47.883 0.263 9.63 2 32.8 6.6
169 2 2 3 23.992 47.984 0.264 9.59 2 34.5 7.3
170 2 0 5 24.059 48.118 0.265 9.53 2 57.1 19.8
171 -1 1 7 24.17 48.341 0.266 9.43 2 37.2 8.3
172 -2 0 6 24.197 48.395 0.266 9.4 2 120.9 87.6
173 -1 2 6 24.228 48.456 0.266 9.38 2 39.6 9.4
174 1 -3 4 24.247 48.494 0.267 9.36 2 73.1 31.9
175 0 -3 5 24.256 48.513 0.267 9.35 2 13.1 1.0
176 -1 3 4 24.402 48.804 0.268 9.22 2 40.7 9.8
177 1 0 7 24.487 48.975 0.269 9.15 2 45.5 12.1
178 1 -2 6 24.491 48.982 0.269 9.15 2 105.1 64.4
179 2 -1 5 24.681 49.362 0.271 8.99 2 14.8 1.3
180 -2 -1 6 24.885 49.769 0.273 8.82 2 11.6 0.8
181 2 -2 4 24.949 49.899 0.274 8.77 2 22.2 2.8
182 -3 0 1 25.003 50.007 0.274 8.73 2 43.7 10.6
183 1 -1 7 25.048 50.096 0.275 8.69 2 8.4 0.4
184 3 0 0 25.093 50.187 0.275 8.66 2 18.4 1.9
185 0 -2 7 25.18 50.361 0.276 8.59 2 69.0 26.1
186 -2 -2 5 25.194 50.388 0.276 8.58 2 27.2 4.0
187 2 1 5 25.195 50.389 0.276 8.58 2 39.6 8.6
188 -2 3 0 25.26 50.52 0.277 8.53 2 55.9 17.0
189 -2 1 6 25.262 50.523 0.277 8.53 2 16.7 1.5
190 -1 -3 5 25.326 50.653 0.278 8.48 2 22.3 2.7
191 -3 0 2 25.346 50.691 0.278 8.46 2 32.3 5.6
192 1 3 4 25.386 50.772 0.278 8.43 2 51.8 14.4
193 -2 3 1 25.392 50.785 0.278 8.43 2 66.1 23.5
194 -2 -3 1 25.472 50.944 0.279 8.37 2 8.4 0.4
195 0 3 5 25.475 50.951 0.279 8.36 2 47.6 12.1
196 0 4 0 25.509 51.018 0.28 8.34 2 205.4 224.1
197 0 0 8 25.532 51.064 0.28 8.32 2 15.0 1.2
198 2 -3 1 25.557 51.114 0.28 8.3 2 111.0 65.2
199 0 -4 1 25.563 51.126 0.28 8.3 2 54.1 15.5
200 1 2 6 25.569 51.138 0.28 8.29 2 116.2 71.4
201 2 3 0 25.579 51.159 0.28 8.29 2 86.9 39.9
202 3 0 1 25.612 51.225 0.281 8.26 2 40.5 8.6
203 1 1 7 25.662 51.324 0.281 8.23 2 14.5 1.1
204 -2 2 5 25.779 51.559 0.282 8.14 2 17.2 1.5
205 -2 -3 2 25.791 51.582 0.282 8.13 2 123.4 79.0
206 2 2 4 25.803 51.606 0.283 8.12 2 25.4 3.3
207 -3 1 1 25.82 51.64 0.283 8.11 2 23.5 2.8
208 -3 1 0 25.869 51.737 0.283 8.08 2 74.4 28.5
209 0 4 1 25.88 51.761 0.283 8.07 2 16.8 1.5
210 -3 -1 1 25.899 51.798 0.284 8.06 2 62.8 20.3
211 -2 3 2 25.949 51.899 0.284 8.02 2 75.7 29.3
212 -1 -2 7 25.998 51.996 0.285 7.99 2 48.9 12.2
213 3 1 0 26.026 52.052 0.285 7.97 2 50.7 13.1
214 0 -4 2 26.042 52.083 0.285 7.96 2 6.1 0.2
215 0 -1 8 26.063 52.126 0.285 7.94 2 1.3 0.0
216 -3 0 3 26.108 52.216 0.286 7.91 2 14.4 1.0
217 2 3 1 26.11 52.22 0.286 7.91 2 53.8 14.6
218 1 -3 5 26.171 52.342 0.286 7.87 2 6.1 0.2
219 -1 0 8 26.191 52.382 0.286 7.85 2 38.7 7.5
220 -3 -1 2 26.194 52.387 0.287 7.85 2 47.7 11.4
221 -3 1 2 26.194 52.388 0.287 7.85 2 19.5 1.9
222 2 -3 2 26.273 52.546 0.287 7.8 2 25.7 3.3
223 0 2 7 26.29 52.58 0.288 7.79 2 73.6 26.8
224 3 -1 1 26.338 52.676 0.288 7.75 2 15.6 1.2
225 -1 3 5 26.354 52.708 0.288 7.74 2 79.7 31.4
226 0 -3 6 26.499 52.998 0.29 7.65 2 70.0 23.8
227 -2 -3 3 26.526 53.052 0.29 7.63 2 18.1 1.6
228 3 0 2 26.542 53.085 0.29 7.62 2 17.7 1.5
229 3 1 1 26.571 53.141 0.29 7.6 2 15.1 1.1
230 2 0 6 26.627 53.254 0.291 7.56 2 17.0 1.4
231 0 4 2 26.665 53.33 0.291 7.54 2 20.5 2.0
232 0 1 8 26.686 53.372 0.292 7.52 2 0.3 0.0
233 -1 -1 8 26.738 53.477 0.292 7.49 2 63.8 19.4
234 -2 0 7 26.779 53.558 0.292 7.46 2 100.2 47.7
235 -1 4 0 26.851 53.701 0.293 7.42 2 17.3 1.4
236 -3 -1 3 26.901 53.801 0.294 7.39 2 59.7 16.8
237 -2 3 3 26.912 53.825 0.294 7.38 2 16.3 1.3
238 0 -4 3 26.928 53.856 0.294 7.37 2 44.5 9.3
239 2 -2 5 26.972 53.944 0.294 7.34 2 48.7 11.1
240 -3 1 3 26.977 53.955 0.294 7.34 2 87.7 36.0
241 -1 2 7 26.982 53.964 0.295 7.34 2 76.0 27.0
242 1 -4 1 27.0 54.0 0.295 7.33 2 34.7 5.6
243 -1 -4 1 27.01 54.021 0.295 7.32 2 33.7 5.3
244 2 3 2 27.046 54.091 0.295 7.3 2 17.8 1.5
245 1 4 0 27.055 54.11 0.295 7.29 2 8.3 0.3
246 -1 4 1 27.113 54.225 0.296 7.26 2 26.9 3.4
247 2 -1 6 27.168 54.337 0.296 7.22 2 58.5 15.8
248 3 -1 2 27.212 54.424 0.297 7.2 2 64.5 19.1
249 -2 -2 6 27.226 54.453 0.297 7.19 2 96.8 42.9
250 -3 0 4 27.265 54.531 0.297 7.17 2 25.5 3.0
251 1 -2 7 27.266 54.532 0.297 7.17 2 93.0 39.5
252 -1 1 8 27.3 54.6 0.298 7.14 2 43.7 8.7
253 -1 -4 2 27.375 54.75 0.298 7.1 2 29.9 4.0
254 -2 -1 7 27.382 54.763 0.299 7.1 2 29.2 3.9
255 2 -3 3 27.385 54.77 0.299 7.09 2 47.3 10.1
256 -1 -3 6 27.41 54.82 0.299 7.08 2 36.9 6.1
257 1 3 5 27.479 54.959 0.3 7.04 2 10.8 0.5
258 1 4 1 27.508 55.015 0.3 7.02 2 46.2 9.6
259 3 1 2 27.516 55.031 0.3 7.02 2 51.0 11.6
260 1 -4 2 27.557 55.113 0.3 6.99 2 49.2 10.8
261 -2 -3 4 27.654 55.307 0.301 6.94 2 42.0 7.8
262 2 1 6 27.724 55.448 0.302 6.9 2 38.0 6.4
263 1 0 8 27.744 55.488 0.302 6.89 2 20.0 1.8
264 -1 4 2 27.778 55.556 0.303 6.87 2 9.6 0.4
265 -2 1 7 27.81 55.619 0.303 6.85 2 44.8 8.8
266 0 4 3 27.839 55.678 0.303 6.83 2 6.3 0.2
267 3 0 3 27.855 55.709 0.303 6.83 2 21.2 1.9
268 0 3 6 27.872 55.744 0.303 6.82 2 5.1 0.1
269 2 2 5 27.932 55.863 0.304 6.78 2 50.1 10.9
270 -2 2 6 27.932 55.864 0.304 6.78 2 84.8 31.1
271 -3 -1 4 27.998 55.996 0.305 6.75 2 40.5 7.1
272 -1 -4 3 28.138 56.276 0.306 6.67 2 46.6 9.2
273 -3 1 4 28.148 56.295 0.306 6.67 2 14.5 0.9
274 0 -4 4 28.196 56.392 0.307 6.64 2 56.9 13.7
275 0 -2 8 28.212 56.424 0.307 6.63 2 49.5 10.4
276 1 -1 8 28.221 56.443 0.307 6.63 2 34.1 4.9
277 -3 2 1 28.243 56.487 0.307 6.61 2 117.5 58.2
278 -3 2 0 28.252 56.504 0.307 6.61 2 103.1 44.8
279 -2 3 4 28.253 56.506 0.307 6.61 2 60.1 15.2
280 1 4 2 28.355 56.71 0.308 6.56 2 18.7 1.5
281 2 3 3 28.36 56.719 0.308 6.55 2 68.1 19.4
282 -3 -2 1 28.391 56.783 0.309 6.54 2 135.8 76.8
283 1 -3 6 28.399 56.797 0.309 6.53 2 20.8 1.8
284 1 2 7 28.417 56.834 0.309 6.52 2 79.4 26.2
285 3 -1 3 28.467 56.933 0.309 6.5 2 5.1 0.1
286 1 -4 3 28.504 57.008 0.31 6.48 2 3.8 0.1
287 3 2 0 28.548 57.096 0.31 6.46 2 93.8 36.2
288 -1 3 6 28.607 57.213 0.311 6.43 2 11.1 0.5
289 -3 -2 2 28.632 57.263 0.311 6.41 2 13.5 0.7
290 -3 2 2 28.632 57.264 0.311 6.41 2 3.9 0.1
291 3 -2 1 28.657 57.315 0.311 6.4 2 68.1 18.9
292 -3 0 5 28.786 57.572 0.313 6.34 2 51.6 10.8
293 -1 4 3 28.829 57.658 0.313 6.31 2 33.2 4.4
294 3 1 3 28.835 57.67 0.313 6.31 2 16.1 1.0
295 1 1 8 28.861 57.723 0.313 6.3 2 56.1 12.6
296 2 -3 4 28.862 57.724 0.313 6.3 2 14.1 0.8
297 -1 -2 8 28.878 57.755 0.313 6.29 2 119.1 56.8
298 0 0 9 29.005 58.011 0.315 6.23 2 106.4 44.9
299 0 -3 7 29.01 58.02 0.315 6.23 2 84.5 28.3
300 3 2 1 29.097 58.194 0.316 6.18 2 39.6 6.2
301 -2 -3 5 29.144 58.288 0.316 6.16 2 46.2 8.4
302 -3 -2 3 29.262 58.525 0.317 6.11 2 59.4 13.7
303 -1 -4 4 29.28 58.559 0.317 6.1 2 21.6 1.8
304 2 -2 6 29.287 58.574 0.318 6.09 2 4.4 0.1
305 0 4 4 29.371 58.743 0.318 6.05 2 70.8 19.3
306 0 2 8 29.387 58.775 0.319 6.05 2 84.7 27.7
307 -3 2 3 29.408 58.816 0.319 6.04 2 65.1 16.3
308 2 0 7 29.424 58.847 0.319 6.03 2 86.3 28.6
309 3 -2 2 29.449 58.899 0.319 6.02 2 62.3 14.9
310 0 -1 9 29.457 58.915 0.319 6.01 2 43.4 7.2
311 -3 -1 5 29.458 58.916 0.319 6.01 2 71.5 19.6
312 3 0 4 29.517 59.034 0.32 5.99 2 64.8 16.0
313 -1 0 9 29.52 59.04 0.32 5.99 2 24.7 2.3
314 -2 -2 7 29.55 59.1 0.32 5.97 2 41.3 6.5
315 1 4 3 29.575 59.151 0.32 5.96 2 12.2 0.6
316 -2 0 8 29.588 59.176 0.321 5.96 2 13.8 0.7
317 -3 1 5 29.675 59.349 0.321 5.92 2 30.6 3.5
318 -1 -3 7 29.779 59.558 0.322 5.87 2 8.1 0.2
319 0 -4 5 29.815 59.63 0.323 5.85 2 108.6 44.0
320 1 -4 4 29.819 59.638 0.323 5.85 2 34.7 4.5
321 1 3 6 29.857 59.714 0.323 5.84 2 30.9 3.6
322 2 -1 7 29.896 59.791 0.324 5.82 2 29.7 3.3
323 -2 3 5 29.939 59.879 0.324 5.8 2 32.8 4.0
324 -1 2 8 29.941 59.881 0.324 5.8 2 129.7 62.1
325 -1 -1 9 29.991 59.982 0.324 5.78 2 42.9 6.8
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 0 0 1 3.088 6.177 14.29702 706.0 92.4 94.0 5.5
2 0 0 2 6.186 12.372 7.14851 648.6 84.9 86.0 5.6
3 0 -1 1 6.784 13.567 6.52105 14.0 1.8 1.9 5.6
4 0 1 1 7.043 14.086 6.28199 67.1 8.8 8.9 5.6
5 -1 0 1 8.435 16.87 5.25115 40.7 5.3 5.4 5.6
6 0 -1 2 8.553 17.106 5.17913 534.2 69.9 70.7 5.6
7 0 1 2 8.965 17.93 4.94296 377.1 49.4 49.8 5.6
8 0 0 3 9.302 18.603 4.76567 133.8 17.5 17.7 5.6
9 -1 0 2 9.78 19.561 4.5345 29.7 3.9 3.9 5.6
10 -1 1 0 10.176 20.353 4.35981 245.7 32.2 32.4 5.6
11 1 1 0 10.294 20.589 4.31035 21.4 2.8 2.8 5.6
12 -1 -1 1 10.455 20.91 4.24491 654.9 85.7 86.4 5.6
13 -1 1 1 10.513 21.025 4.22178 153.9 20.1 20.3 5.6
14 1 -1 1 10.774 21.548 4.1205 165.3 21.6 21.8 5.6
15 0 -1 3 10.952 21.903 4.05452 8.9 1.2 1.2 5.6
16 1 1 1 11.052 22.104 4.01817 93.2 12.2 12.3 5.6
17 0 1 3 11.44 22.88 3.88363 133.4 17.5 17.6 5.6
18 -1 1 2 11.707 23.413 3.79632 77.1 10.1 10.2 5.6
19 -1 0 3 11.826 23.652 3.75857 34.7 4.5 4.6 5.6
20 1 -1 2 12.176 24.351 3.65219 84.9 11.1 11.2 5.6
21 0 0 4 12.445 24.891 3.57425 287.1 37.6 37.8 5.6
22 1 1 2 12.57 25.141 3.53924 53.4 7.0 7.0 5.6
23 0 -2 1 12.68 25.361 3.50907 31.0 4.1 4.1 5.6
24 0 2 1 12.967 25.934 3.43282 26.1 3.4 3.4 5.6
25 -1 -1 3 13.224 26.447 3.36728 30.1 3.9 4.0 5.6
26 -1 1 3 13.545 27.09 3.28884 166.2 21.8 21.8 5.6
27 0 -2 2 13.665 27.33 3.26052 69.8 9.1 9.2 5.6
28 1 -1 3 14.158 28.315 3.14926 34.7 4.5 4.6 5.6
29 0 2 2 14.196 28.391 3.141 136.0 17.8 17.8 5.6
30 1 1 3 14.63 29.259 3.04978 21.2 2.8 2.8 5.6
31 1 2 0 15.009 30.019 2.97432 19.0 2.5 2.5 5.6
32 -1 -2 1 15.061 30.122 2.96437 189.4 24.8 24.8 5.6
33 -1 2 1 15.143 30.287 2.94861 184.6 24.2 24.2 5.6
34 1 -2 1 15.209 30.417 2.93628 169.4 22.2 22.2 5.6
35 0 -2 3 15.256 30.513 2.92726 19.4 2.5 2.5 5.6
36 -1 -1 4 15.424 30.849 2.89618 121.5 15.9 15.9 5.6
37 1 0 4 15.554 31.109 2.87256 31.1 4.1 4.1 5.6
38 0 0 5 15.628 31.255 2.8594 764.1 100.0 100.0 5.6
39 -1 -2 2 15.761 31.521 2.83588 27.2 3.6 3.6 5.6
40 0 2 3 15.974 31.948 2.79897 48.1 6.3 6.3 5.6
41 -1 2 2 16.074 32.149 2.78196 11.9 1.6 1.6 5.6
42 1 -2 2 16.198 32.395 2.76134 566.3 74.1 74.0 5.6
43 -2 0 1 16.44 32.881 2.72165 509.1 66.6 66.5 5.6
44 1 -1 4 16.532 33.065 2.70696 52.5 6.9 6.9 5.6
45 0 -1 5 16.583 33.166 2.69893 20.9 2.7 2.7 5.6
46 1 2 2 16.805 33.609 2.66434 404.3 52.9 52.8 5.7
47 -1 -2 3 17.037 34.073 2.6291 453.0 59.3 59.1 5.7
48 0 1 5 17.141 34.282 2.61353 13.5 1.8 1.8 5.7
49 -1 2 3 17.547 35.093 2.55498 239.6 31.4 31.3 5.7
50 -1 -1 5 17.947 35.895 2.49976 60.2 7.9 7.8 5.7
51 -2 -1 2 18.175 36.351 2.46942 24.7 3.2 3.2 5.7
52 -2 0 3 18.228 36.456 2.46253 99.5 13.0 13.0 5.7
53 1 0 5 18.377 36.755 2.44319 39.0 5.1 5.1 5.7
54 -1 -2 4 18.786 37.572 2.39191 44.8 5.9 5.8 5.7
55 0 0 6 18.86 37.721 2.38284 91.5 12.0 11.9 5.7
56 0 -3 1 18.963 37.926 2.37037 32.9 4.3 4.3 5.7
57 1 -1 5 19.179 38.358 2.3447 8.4 1.1 1.1 5.7
58 -1 2 4 19.454 38.908 2.3128 17.6 2.3 2.3 5.7
59 0 -3 2 19.614 39.229 2.29465 19.6 2.6 2.6 5.7
60 0 -2 5 19.69 39.38 2.28617 11.2 1.5 1.5 5.7
61 2 0 3 19.758 39.516 2.27861 35.5 4.6 4.6 5.7
62 -1 3 0 20.55 41.101 2.19433 13.6 1.8 1.8 5.7
63 0 2 5 20.648 41.296 2.18442 12.2 1.6 1.6 5.7
64 -2 2 0 20.693 41.385 2.1799 57.4 7.5 7.4 5.7
65 0 -3 3 20.755 41.509 2.17368 25.1 3.3 3.2 5.7
66 -2 2 1 20.8 41.601 2.16911 42.4 5.6 5.5 5.7
67 -2 -2 1 20.862 41.724 2.16296 10.5 1.4 1.4 5.7
68 2 2 0 20.941 41.882 2.15518 60.4 7.9 7.8 5.7
69 2 -2 1 21.085 42.17 2.14116 36.7 4.8 4.8 5.7
70 -1 1 6 21.198 42.395 2.13029 29.6 3.9 3.8 5.7
71 -2 -2 2 21.28 42.559 2.12246 63.9 8.4 8.3 5.7
72 1 0 6 21.363 42.726 2.11454 16.4 2.2 2.1 5.7
73 -2 2 2 21.402 42.804 2.11089 29.6 3.9 3.8 5.7
74 2 2 1 21.512 43.024 2.1006 24.1 3.2 3.1 5.7
75 0 3 3 21.583 43.166 2.094 24.1 3.2 3.1 5.7
76 2 0 4 21.752 43.504 2.07854 71.6 9.4 9.3 5.7
77 2 -2 2 21.955 43.91 2.06025 71.2 9.3 9.2 5.7
78 1 -1 6 22.029 44.058 2.05366 48.5 6.4 6.3 5.7
79 0 0 7 22.157 44.313 2.04243 112.9 14.8 14.6 5.7
80 -2 2 3 22.465 44.93 2.01582 24.0 3.1 3.1 5.7
81 2 2 2 22.544 45.089 2.00909 60.5 7.9 7.8 5.7
82 1 1 6 22.617 45.234 2.00295 14.2 1.9 1.8 5.7
83 1 -3 3 22.673 45.346 1.99829 23.5 3.1 3.0 5.7
84 0 -1 7 22.789 45.579 1.98861 24.8 3.3 3.2 5.7
85 1 2 5 22.938 45.876 1.97641 43.1 5.6 5.6 5.7
86 -1 0 7 22.997 45.994 1.97163 22.6 3.0 2.9 5.7
87 2 -2 3 23.26 46.521 1.95052 23.4 3.1 3.0 5.7
88 -1 -2 6 23.332 46.663 1.94489 8.4 1.1 1.1 5.7
89 0 1 7 23.391 46.782 1.94023 50.2 6.6 6.5 5.7
90 -2 -2 4 23.492 46.984 1.93235 22.2 2.9 2.9 5.7
91 1 3 3 23.616 47.232 1.92277 19.3 2.5 2.5 5.7
92 2 0 5 24.059 48.118 1.88945 19.8 2.6 2.5 5.7
93 -2 0 6 24.197 48.395 1.87928 95.9 12.5 12.3 5.7
94 1 -3 4 24.247 48.494 1.87565 42.3 5.5 5.4 5.7
95 -1 3 4 24.402 48.804 1.86446 9.8 1.3 1.3 5.7
96 1 -2 6 24.491 48.982 1.85812 76.4 10.0 9.8 5.7
97 -3 0 1 25.003 50.007 1.82241 10.6 1.4 1.4 5.7
98 0 -2 7 25.18 50.361 1.81043 38.7 5.1 5.0 5.8
99 -2 3 0 25.26 50.52 1.80509 18.5 2.4 2.4 5.8
100 -3 0 2 25.346 50.691 1.79939 8.3 1.1 1.1 5.8
101 -2 3 1 25.392 50.785 1.7963 37.9 5.0 4.9 5.8
102 0 3 5 25.475 50.951 1.79084 12.1 1.6 1.5 5.8
103 0 4 0 25.509 51.018 1.78865 225.3 29.5 28.9 5.8
104 1 2 6 25.569 51.138 1.78472 192.0 25.1 24.6 5.8
105 3 0 1 25.612 51.225 1.7819 8.6 1.1 1.1 5.8
106 2 2 4 25.803 51.606 1.76962 86.7 11.3 11.1 5.8
107 -3 1 0 25.869 51.737 1.76544 30.0 3.9 3.8 5.8
108 -3 -1 1 25.899 51.798 1.76352 20.3 2.7 2.6 5.8
109 -2 3 2 25.949 51.899 1.76032 29.3 3.8 3.8 5.8
110 3 1 0 26.026 52.052 1.75551 25.2 3.3 3.2 5.8
111 2 3 1 26.11 52.22 1.75027 15.6 2.0 2.0 5.8
112 -3 -1 2 26.194 52.387 1.74506 20.8 2.7 2.7 5.8
113 0 2 7 26.29 52.58 1.73912 30.1 3.9 3.9 5.8
114 -1 3 5 26.354 52.708 1.73519 32.6 4.3 4.2 5.8
115 0 -3 6 26.499 52.998 1.72638 25.4 3.3 3.3 5.8
116 -1 -1 8 26.738 53.477 1.71205 19.4 2.5 2.5 5.8
117 -2 0 7 26.779 53.558 1.70963 47.7 6.2 6.1 5.8
118 -3 -1 3 26.901 53.801 1.70249 27.4 3.6 3.5 5.8
119 -1 2 7 26.982 53.964 1.69774 85.0 11.1 10.9 5.8
120 2 -1 6 27.168 54.337 1.68696 15.8 2.1 2.0 5.8
121 -2 -2 6 27.226 54.453 1.68364 62.0 8.1 7.9 5.8
122 1 -2 7 27.266 54.532 1.6814 42.4 5.6 5.4 5.8
123 -1 1 8 27.3 54.6 1.67944 8.7 1.1 1.1 5.8
124 2 -3 3 27.385 54.77 1.67465 24.2 3.2 3.1 5.8
125 3 1 2 27.516 55.031 1.6673 21.2 2.8 2.7 5.8
126 1 -4 2 27.557 55.113 1.66502 10.8 1.4 1.4 5.8
127 -2 -3 4 27.654 55.307 1.65963 7.8 1.0 1.0 5.8
128 2 1 6 27.724 55.448 1.65575 8.1 1.1 1.0 5.8
129 -2 1 7 27.81 55.619 1.65106 8.8 1.1 1.1 5.8
130 -2 2 6 27.932 55.864 1.64442 41.9 5.5 5.3 5.8
131 -1 -4 3 28.138 56.276 1.63333 10.1 1.3 1.3 5.8
132 0 -4 4 28.196 56.392 1.63026 29.0 3.8 3.7 5.8
133 -3 2 1 28.243 56.487 1.62775 118.2 15.5 15.0 5.8
134 2 3 3 28.36 56.719 1.62163 20.9 2.7 2.7 5.8
135 -3 -2 1 28.391 56.783 1.61996 104.8 13.7 13.3 5.8
136 3 2 0 28.548 57.096 1.61183 36.2 4.7 4.6 5.8
137 3 -2 1 28.657 57.315 1.60619 18.9 2.5 2.4 5.8
138 -3 0 5 28.786 57.572 1.59961 10.8 1.4 1.4 5.8
139 -1 -2 8 28.878 57.755 1.59498 70.2 9.2 8.9 5.8
140 0 0 9 29.005 58.011 1.58856 73.2 9.6 9.3 5.8
141 -2 -3 5 29.144 58.288 1.58166 8.4 1.1 1.1 5.8
142 -3 -2 3 29.262 58.525 1.57583 15.6 2.0 2.0 5.8
143 0 2 8 29.387 58.775 1.56973 47.0 6.2 6.0 5.8
144 2 0 7 29.424 58.847 1.56795 44.9 5.9 5.7 5.8
145 -3 -1 5 29.458 58.916 1.5663 41.7 5.5 5.3 5.8
146 3 0 4 29.517 59.034 1.56345 18.3 2.4 2.3 5.8
147 0 -4 5 29.815 59.63 1.54924 48.5 6.3 6.1 5.8
148 -1 2 8 29.941 59.881 1.54333 66.1 8.7 8.4 5.8
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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