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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PIEMONTITE
5, Sr, f-epidote, s-epidote
Ca(1.74)Sr(0.16)Al(1.83)Fe(0.06)Mn(1.15)Si(3)O(12)OH
Monoclinic P 2(1)/m Z = 2
R =0.031 NR =2810
6 .6 .1995
Ref.Str.:
Catti M., Ferraris G., Ivaldi G. (1989)
* Neues Jb. Miner., Mh., H.8, 357-366
Reserv:
SM307-Ca[Ca(0.862)Sr(0.138)][Al(0.775)Mn(0.225)]Al
[Mn(0.94)Fe(0.06)]Si(3)O(12)OH. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.87 alpha = 90.0
b = 5.699 beta = 115.3
c = 10.201 gamma = 90.0
Unit cell volume (cub. angs.) = 466.2
Molar volume ( cub.cm/mol.) = 140.41
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.758 0.75 0.1536 1.07 Ca = 1.00
2 0.5975 0.75 0.4255 1.13 Ca = 0.86, Sr = 0.14
3 0.3414 0.75 0.0449 0.68 Si = 1.00
4 0.6844 0.25 0.2746 0.67 Si = 1.00
5 0.1852 0.75 0.3194 0.71 Si = 1.00
6 0.0 0.0 0.0 0.61 Al = 0.77, Mn = 0.22
7 0.0 0.0 0.5 0.61 Al = 1.00
8 0.2957 0.25 0.2215 0.58 Mn = 0.94, Fe = 0.06
9 0.2335 0.9911 0.0354 1.06 O = 1.00
10 0.3057 0.9788 0.3552 0.98 O = 1.00
11 0.7967 0.0164 0.3377 0.9 O = 1.00
12 0.0601 0.25 0.1322 0.77 O = 1.00
13 0.0681 0.75 0.4082 0.94 O = 1.00
14 0.5147 0.75 0.1813 0.98 O = 1.00
15 0.527 0.25 0.3141 1.15 O = 1.00
16 0.619 0.25 0.0981 1.42 O = 1.00
17 0.0865 0.25 0.4327 0.84 O = 1.00
18 0.0423 0.75 0.1468 0.93 O = 1.00
19 0.057 0.25 0.352 2.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.758 0.75 0.1536
2 2 0.5975 0.75 0.4255
3 3 0.3414 0.75 0.0449
4 4 0.6844 0.25 0.2746
5 5 0.1852 0.75 0.3194
6 6 0.0 0.0 0.0
7 7 0.0 0.0 0.5
8 8 0.2957 0.25 0.2215
9 9 0.2335 0.9911 0.0354
10 10 0.3057 0.9788 0.3552
11 11 0.7967 0.0164 0.3377
12 12 0.0601 0.25 0.1322
13 13 0.0681 0.75 0.4082
14 14 0.5147 0.75 0.1813
15 15 0.527 0.25 0.3141
16 16 0.619 0.25 0.0981
17 17 0.0865 0.25 0.4327
18 18 0.0423 0.75 0.1468
19 19 0.057 0.25 0.352
20 1 0.242 0.25 0.8464
21 2 0.4025 0.25 0.5745
22 3 0.6586 0.25 0.9551
23 4 0.3156 0.75 0.7254
24 5 0.8148 0.25 0.6806
25 6 0.0 0.5 0.0
26 7 0.0 0.5 0.5
27 8 0.7043 0.75 0.7785
28 9 0.7665 0.4911 0.9646
29 10 0.6943 0.4788 0.6448
30 11 0.2033 0.5164 0.6623
31 12 0.9399 0.75 0.8678
32 13 0.9319 0.25 0.5918
33 14 0.4853 0.25 0.8187
34 15 0.473 0.75 0.6859
35 16 0.381 0.75 0.9019
36 17 0.9135 0.75 0.5673
37 18 0.9577 0.25 0.8532
38 19 0.943 0.75 0.648
39 9 0.2335 0.5089 0.0354
40 10 0.3057 0.5212 0.3552
41 11 0.7967 0.4836 0.3377
42 9 0.7665 0.0089 0.9646
43 10 0.6943 0.0212 0.6448
44 11 0.2033 0.9836 0.6623
X-ray density (g/cm cub.) = 3.53
MU (1/cm) = 304.147 Mass attenuation coefficient (cm**2/g) = 86.226
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca 2.88 7
2.3235 11
2.8645 13
2.2931 14
2.5522 18
2.4544 9
2.3235 11
2.4544 9
2 Ca ,Sr 3.072 10
2.7069 10
2.7535 11
2.2762 14
3.0323 15
3.0323 15
2.5473 10
2.5462 17
2.7069 10
2.7535 11
2.5473 10
3 Si 2.1 4
1.6535 9
1.5719 14
1.6399 16
1.6535 9
4 Si 2.1 4
1.622 11
1.6101 15
1.6388 16
1.622 11
5 Si 2.1 4
1.6255 10
1.6443 13
1.6731 18
1.6255 10
6 Al ,Mn 2.724 6
1.9451 9
1.8757 12
1.9832 18
1.8757 12
1.9832 18
1.9451 9
7 Al 2.316 6
1.8574 11
1.9378 13
1.8815 17
1.9378 13
1.8815 17
1.8574 11
8 Mn ,Fe 2.724 6
2.2782 9
2.038 10
1.8894 12
1.8561 15
2.2782 9
2.038 10
9 O 3.264 9
3.045 10
2.6107 12
2.6742 14
2.7754 18
2.7906 12
2.6414 16
2.7803 18
2.9509 9
2.7481 9
10 O 3.264 8
3.045 9
2.8414 12
2.7218 13
2.6685 15
2.8474 17
2.7263 18
3.0911 10
2.6079 10
11 O 3.264 9
2.6716 13
2.7742 14
2.6572 15
2.634 16
2.6814 17
2.6967 13
2.6058 17
2.6626 11
3.0364 11
12 O 3.264 10
2.6107 9
2.8414 10
2.9729 17
2.8613 18
2.8613 18
2.7906 9
2.5915 18
2.6107 9
2.8414 10
2.7906 9
13 O 3.264 10
2.7218 10
2.6716 11
2.859 17
2.859 17
2.5771 18
2.6967 11
2.5331 17
2.7218 10
2.6716 11
2.6967 11
14 O 3.264 9
2.6742 9
2.7742 11
3.1369 15
3.1369 15
3.2198 16
3.2198 16
2.577 16
2.6742 9
2.7742 11
15 O 3.264 7
2.6685 10
2.6572 11
3.1369 14
3.1369 14
2.6567 16
2.6685 10
2.6572 11
16 O 3.264 8
2.634 11
3.2198 14
3.2198 14
2.6567 15
2.6414 9
2.577 14
2.634 11
2.6414 9
17 O 3.264 10
2.8474 10
2.6814 11
2.9729 12
2.859 13
2.859 13
2.6058 11
2.5331 13
2.8474 10
2.6814 11
2.6058 11
18 O 3.264 10
2.7754 9
2.7263 10
2.8613 12
2.8613 12
2.5771 13
2.7803 9
2.5915 12
2.7754 9
2.7263 10
2.7803 9
19 H 1.632 1
0.7497 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 0 1 4.791 9.582 0.054 283.72 2 6.8 11.9
2 1 0 0 5.512 11.024 0.062 213.79 2 11.4 25.8
3 1 0 -1 5.547 11.095 0.063 211.04 2 22.8 100.6
4 1 0 1 8.734 17.469 0.099 83.8 2 8.5 5.6
5 1 0 -2 8.802 17.604 0.099 82.48 2 59.8 271.1
6 0 1 1 9.142 18.284 0.103 76.3 4 1.9 0.5
7 1 1 0 9.545 19.089 0.108 69.82 4 18.8 45.3
8 1 1 -1 9.565 19.131 0.108 69.5 4 15.3 29.8
9 0 0 2 9.616 19.232 0.108 68.75 2 2.6 0.4
10 2 0 -1 10.002 20.005 0.113 63.38 2 2.3 0.3
11 2 0 0 11.076 22.152 0.125 51.3 2 54.0 137.6
12 2 0 -2 11.148 22.296 0.126 50.61 2 66.3 204.7
13 1 1 1 11.73 23.459 0.132 45.51 4 23.3 45.4
14 1 1 -2 11.781 23.561 0.133 45.1 4 13.7 15.6
15 0 1 2 12.408 24.816 0.139 40.45 4 6.4 3.0
16 2 1 -1 12.714 25.428 0.143 38.43 4 72.1 368.1
17 1 0 2 13.031 26.063 0.146 36.48 2 52.4 92.1
18 1 0 -3 13.109 26.217 0.147 36.03 2 9.3 2.8
19 2 1 0 13.585 27.17 0.152 33.4 4 12.4 9.4
20 2 1 -2 13.645 27.289 0.153 33.1 4 9.1 5.1
21 2 0 1 13.886 27.772 0.156 31.89 2 56.6 94.2
22 2 0 -3 14.002 28.005 0.157 31.33 2 1.8 0.1
23 0 0 3 14.511 29.022 0.163 29.03 2 33.4 29.9
24 1 1 2 15.242 30.483 0.171 26.13 4 21.0 21.2
25 3 0 -1 15.279 30.558 0.171 26.0 2 22.7 12.3
26 1 1 -3 15.309 30.617 0.171 25.89 4 148.5 1050.2
27 3 0 -2 15.319 30.638 0.171 25.85 2 75.7 136.4
28 0 2 0 15.683 31.367 0.175 24.58 2 134.7 410.5
29 2 1 1 15.988 31.976 0.179 23.58 4 40.1 69.9
30 2 1 -3 16.09 32.181 0.18 23.26 4 23.5 23.6
31 0 2 1 16.435 32.87 0.184 22.21 4 3.9 0.6
32 0 1 3 16.541 33.081 0.185 21.91 4 88.6 316.6
33 1 2 0 16.671 33.342 0.186 21.54 4 77.8 240.2
34 1 2 -1 16.684 33.367 0.186 21.5 4 2.0 0.2
35 3 0 0 16.748 33.496 0.187 21.32 2 91.3 163.5
36 3 0 -3 16.859 33.717 0.188 21.02 2 16.1 5.0
37 3 1 -1 17.227 34.454 0.192 20.05 4 112.9 470.8
38 3 1 -2 17.263 34.526 0.193 19.96 4 24.5 22.0
39 2 0 2 17.68 35.361 0.197 18.95 2 108.0 203.2
40 1 0 3 17.714 35.428 0.198 18.87 2 1.1 0.0
41 1 0 -4 17.796 35.592 0.198 18.68 2 40.8 28.6
42 2 0 -4 17.821 35.642 0.199 18.62 2 21.3 7.8
43 1 2 1 18.062 36.125 0.201 18.08 4 14.6 7.1
44 1 2 -2 18.097 36.194 0.202 18.0 4 51.7 88.5
45 0 2 2 18.528 37.056 0.206 17.1 4 87.0 238.4
46 3 1 0 18.559 37.119 0.207 17.03 4 13.4 5.6
47 3 1 -3 18.661 37.321 0.208 16.83 4 96.9 291.0
48 2 2 -1 18.742 37.484 0.209 16.67 4 30.2 28.1
49 2 2 0 19.368 38.736 0.215 15.5 4 16.9 8.1
50 2 2 -2 19.411 38.823 0.216 15.43 4 60.6 104.3
51 2 1 2 19.416 38.832 0.216 15.42 4 23.8 16.1
52 3 0 1 19.423 38.846 0.216 15.4 2 24.9 8.8
53 1 1 3 19.447 38.895 0.216 15.36 4 44.4 55.7
54 0 0 4 19.517 39.034 0.217 15.24 2 0.9 0.0
55 1 1 -4 19.523 39.046 0.217 15.23 4 31.5 27.9
56 2 1 -4 19.546 39.092 0.217 15.19 4 42.7 50.9
57 3 0 -4 19.585 39.171 0.218 15.12 2 45.7 29.1
58 4 0 -2 20.327 40.654 0.225 13.92 2 23.7 7.2
59 1 2 2 20.611 41.222 0.229 13.5 4 21.3 11.3
60 1 2 -3 20.662 41.325 0.229 13.42 4 54.7 73.8
61 4 0 -1 20.892 41.784 0.231 13.1 2 119.2 171.3
62 4 0 -3 20.974 41.947 0.232 12.98 2 41.7 20.8
63 3 1 1 21.036 42.073 0.233 12.9 4 4.0 0.4
64 0 1 4 21.124 42.248 0.234 12.78 4 25.6 15.4
65 3 1 -4 21.188 42.377 0.235 12.69 4 14.6 5.0
66 2 2 1 21.191 42.382 0.235 12.69 4 87.3 177.9
67 2 2 -3 21.272 42.544 0.235 12.58 4 88.3 180.5
68 0 2 3 21.628 43.257 0.239 12.12 4 83.6 156.0
69 4 1 -2 21.885 43.77 0.242 11.8 4 11.0 2.6
70 2 0 3 22.041 44.082 0.244 11.61 2 77.2 63.8
71 3 2 -1 22.18 44.359 0.245 11.45 4 28.7 17.3
72 2 0 -5 22.197 44.395 0.245 11.43 2 19.7 4.1
73 3 2 -2 22.209 44.418 0.245 11.42 4 14.4 4.4
74 4 1 -1 22.418 44.836 0.248 11.18 4 6.6 0.9
75 4 1 -3 22.495 44.991 0.248 11.09 4 1.5 0.0
76 4 0 0 22.595 45.19 0.249 10.98 2 71.2 51.2
77 1 0 4 22.647 45.294 0.25 10.92 2 13.4 1.8
78 1 0 -5 22.733 45.466 0.251 10.83 2 31.6 9.9
79 4 0 -4 22.748 45.496 0.251 10.82 2 20.3 4.1
80 3 0 2 22.953 45.906 0.253 10.6 2 11.1 1.2
81 3 0 -5 23.152 46.303 0.255 10.39 2 33.9 11.0
82 3 2 0 23.273 46.546 0.256 10.27 4 14.3 3.9
83 3 2 -3 23.357 46.714 0.257 10.19 4 13.7 3.5
84 2 1 3 23.508 47.015 0.259 10.04 4 46.5 39.9
85 2 1 -5 23.656 47.312 0.26 9.9 4 5.7 0.6
86 2 2 2 23.99 47.981 0.264 9.59 4 78.5 108.6
87 1 2 3 24.017 48.034 0.264 9.56 4 23.8 10.0
88 4 1 0 24.035 48.07 0.264 9.55 4 2.6 0.1
89 1 2 -4 24.081 48.162 0.265 9.51 4 56.6 56.0
90 1 1 4 24.085 48.17 0.265 9.5 4 44.4 34.5
91 2 2 -4 24.1 48.2 0.265 9.49 4 85.4 127.4
92 1 1 -5 24.167 48.334 0.266 9.43 4 41.4 29.8
93 4 1 -4 24.181 48.362 0.266 9.42 4 1.4 0.0
94 3 1 2 24.377 48.754 0.268 9.25 4 45.7 35.5
95 0 3 1 24.456 48.912 0.269 9.18 4 0.8 0.0
96 3 1 -5 24.566 49.133 0.27 9.08 4 0.2 0.0
97 1 3 0 24.627 49.253 0.27 9.03 4 34.0 19.2
98 1 3 -1 24.636 49.271 0.271 9.03 4 9.9 1.6
99 0 0 5 24.684 49.367 0.271 8.99 2 28.7 6.8
100 4 0 1 25.255 50.51 0.277 8.53 2 24.7 4.8
101 3 2 1 25.376 50.752 0.278 8.44 4 28.3 12.4
102 0 2 4 25.452 50.904 0.279 8.38 4 36.4 20.5
103 4 0 -5 25.466 50.932 0.279 8.37 2 1.5 0.0
104 3 2 -4 25.507 51.015 0.28 8.34 4 6.7 0.7
105 1 3 1 25.657 51.314 0.281 8.23 4 24.4 9.0
106 1 3 -2 25.683 51.366 0.281 8.21 4 16.0 3.9
107 5 0 -2 25.841 51.683 0.283 8.1 2 83.6 52.1
108 5 0 -3 25.885 51.77 0.283 8.07 2 27.7 5.7
109 0 3 2 26.011 52.022 0.285 7.98 4 5.1 0.4
110 0 1 5 26.036 52.072 0.285 7.96 4 34.3 17.3
111 4 2 -2 26.114 52.229 0.286 7.9 4 42.6 26.4
112 2 3 -1 26.175 52.35 0.286 7.86 4 55.7 44.9
113 4 2 -1 26.583 53.165 0.29 7.59 4 27.2 10.3
114 4 1 1 26.586 53.172 0.291 7.59 4 2.7 0.1
115 4 2 -3 26.65 53.301 0.291 7.55 4 19.0 5.0
116 2 3 0 26.66 53.319 0.291 7.54 4 12.3 2.1
117 2 3 -2 26.693 53.387 0.292 7.52 4 5.6 0.4
118 4 1 -5 26.79 53.579 0.293 7.46 4 63.5 55.4
119 5 0 -1 26.804 53.609 0.293 7.45 2 15.2 1.6
120 2 0 4 26.806 53.612 0.293 7.45 2 34.3 8.1
121 5 0 -4 26.931 53.862 0.294 7.37 2 13.8 1.3
122 2 0 -6 26.975 53.95 0.294 7.34 2 69.2 32.4
123 3 0 3 27.101 54.202 0.296 7.26 2 16.4 1.8
124 5 1 -2 27.152 54.305 0.296 7.23 4 36.9 18.1
125 5 1 -3 27.194 54.388 0.297 7.21 4 33.0 14.4
126 3 0 -6 27.327 54.654 0.298 7.13 2 69.6 31.8
127 2 2 3 27.548 55.097 0.3 7.0 4 4.8 0.3
128 1 3 2 27.643 55.286 0.301 6.94 4 12.8 2.1
129 2 2 -5 27.681 55.362 0.302 6.92 4 22.9 6.7
130 1 3 -3 27.684 55.369 0.302 6.92 4 95.2 115.4
131 1 0 5 27.827 55.654 0.303 6.84 2 46.3 13.5
132 1 0 -6 27.918 55.835 0.304 6.79 2 134.6 113.3
133 4 2 0 28.02 56.04 0.305 6.73 4 49.3 30.2
134 1 2 4 28.065 56.13 0.305 6.71 4 70.4 61.1
135 5 1 -1 28.084 56.168 0.306 6.7 4 95.2 111.8
136 2 1 4 28.086 56.171 0.306 6.7 4 43.3 23.1
137 2 3 1 28.111 56.222 0.306 6.69 4 30.1 11.1
138 1 2 -5 28.138 56.277 0.306 6.67 4 2.4 0.1
139 4 2 -4 28.151 56.303 0.306 6.66 4 116.8 167.2
140 2 3 -3 28.176 56.353 0.307 6.65 4 14.7 2.6
141 5 1 -4 28.207 56.413 0.307 6.63 4 30.5 11.4
142 2 1 -6 28.249 56.498 0.307 6.61 4 36.3 16.0
143 3 2 2 28.327 56.655 0.308 6.57 4 67.8 55.6
144 3 1 3 28.371 56.743 0.308 6.55 4 24.0 7.0
145 0 3 3 28.467 56.934 0.309 6.5 4 64.4 49.5
146 3 2 -5 28.498 56.996 0.31 6.48 4 14.7 2.6
147 3 1 -6 28.591 57.181 0.311 6.43 4 15.4 2.8
148 4 0 2 28.684 57.368 0.312 6.39 2 6.2 0.2
149 5 0 0 28.703 57.406 0.312 6.38 2 21.2 2.6
150 5 0 -5 28.905 57.809 0.314 6.28 2 4.5 0.1
151 3 3 -1 28.92 57.84 0.314 6.27 4 93.6 101.1
152 4 0 -6 28.942 57.884 0.314 6.26 2 137.5 108.9
153 3 3 -2 28.944 57.888 0.314 6.26 4 32.5 12.1
154 1 1 5 29.077 58.153 0.315 6.19 4 76.3 66.4
155 1 1 -6 29.165 58.329 0.316 6.15 4 17.4 3.4
156 3 3 0 29.831 59.662 0.323 5.85 4 19.6 4.1
157 0 2 5 29.832 59.665 0.323 5.85 4 12.6 1.7
158 3 3 -3 29.902 59.804 0.324 5.82 4 65.1 45.3
159 4 1 2 29.911 59.821 0.324 5.81 4 75.8 61.4
160 5 1 0 29.929 59.858 0.324 5.8 4 53.1 30.1
161 0 0 6 30.075 60.149 0.325 5.74 2 43.6 10.0
162 5 1 -5 30.125 60.251 0.326 5.72 4 26.6 7.4
163 4 1 -6 30.162 60.324 0.326 5.7 4 1.9 0.0
164 4 2 1 30.336 60.673 0.328 5.63 4 0.7 0.0
165 2 3 2 30.438 60.876 0.329 5.59 4 19.6 3.9
166 1 3 3 30.461 60.921 0.329 5.58 4 20.5 4.3
167 1 3 -4 30.515 61.03 0.33 5.56 4 15.5 2.5
168 4 2 -5 30.523 61.047 0.33 5.56 4 46.5 22.1
169 2 3 -4 30.532 61.063 0.33 5.55 4 25.4 6.6
170 5 2 -2 30.857 61.714 0.333 5.42 4 13.2 1.7
171 5 2 -3 30.896 61.792 0.333 5.41 4 8.9 0.8
172 0 1 6 31.268 62.535 0.337 5.27 4 0.6 0.0
173 6 0 -3 31.404 62.807 0.338 5.22 2 52.0 13.0
174 5 0 1 31.43 62.861 0.338 5.21 2 0.6 0.0
175 3 3 1 31.628 63.256 0.34 5.14 4 8.4 0.7
176 0 3 4 31.694 63.388 0.341 5.11 4 16.1 2.5
177 5 0 -6 31.697 63.395 0.341 5.11 2 43.5 8.9
178 5 2 -1 31.72 63.439 0.341 5.1 4 34.4 11.1
179 2 2 4 31.721 63.442 0.341 5.1 4 61.5 35.5
180 3 3 -4 31.742 63.485 0.341 5.1 4 6.8 0.4
181 3 0 4 31.752 63.504 0.342 5.09 2 56.1 14.7
182 6 0 -2 31.806 63.611 0.342 5.07 2 5.3 0.1
183 5 2 -4 31.834 63.667 0.342 5.06 4 102.7 98.4
184 2 2 -6 31.873 63.746 0.343 5.05 4 72.4 48.7
185 6 0 -4 31.897 63.793 0.343 5.04 2 96.0 42.7
186 2 0 5 31.94 63.88 0.343 5.03 2 9.5 0.4
187 3 2 3 31.987 63.974 0.344 5.01 4 32.2 9.6
188 3 0 -7 32.003 64.005 0.344 5.01 2 7.5 0.3
189 2 0 -7 32.122 64.243 0.345 4.96 2 22.8 2.4
190 3 2 -6 32.191 64.382 0.346 4.94 4 85.2 66.0
191 4 3 -2 32.272 64.543 0.347 4.92 4 2.5 0.1
192 6 1 -3 32.569 65.137 0.349 4.82 4 11.3 1.1
193 5 1 1 32.595 65.189 0.35 4.81 4 32.8 9.5
194 1 2 5 32.645 65.289 0.35 4.79 4 21.9 4.2
195 4 3 -1 32.683 65.366 0.351 4.78 4 0.4 0.0
196 1 2 -6 32.727 65.454 0.351 4.77 4 20.8 3.8
197 0 4 0 32.727 65.455 0.351 4.77 2 220.1 212.6
198 4 3 -3 32.743 65.485 0.351 4.76 4 5.6 0.3
199 4 0 3 32.752 65.505 0.351 4.76 2 50.4 11.1
200 5 1 -6 32.857 65.713 0.352 4.73 4 9.8 0.8
201 3 1 4 32.91 65.821 0.353 4.71 4 6.3 0.3
202 6 1 -2 32.963 65.926 0.353 4.7 4 27.7 6.6
203 4 0 -7 33.051 66.102 0.354 4.67 2 8.6 0.3
204 6 1 -4 33.052 66.104 0.354 4.67 4 25.8 5.7
205 6 0 -1 33.085 66.17 0.354 4.66 2 9.4 0.4
206 2 1 5 33.095 66.189 0.354 4.66 4 74.2 47.2
207 3 1 -7 33.156 66.312 0.355 4.64 4 41.6 14.7
208 0 4 1 33.165 66.33 0.355 4.64 4 5.0 0.2
209 6 0 -5 33.263 66.526 0.356 4.61 2 31.2 4.1
210 2 1 -7 33.273 66.546 0.356 4.6 4 37.2 11.7
211 1 0 6 33.305 66.609 0.356 4.59 2 14.8 0.9
212 1 4 0 33.306 66.612 0.356 4.59 4 5.8 0.3
213 1 4 -1 33.313 66.627 0.357 4.59 4 12.9 1.4
214 1 0 -7 33.401 66.802 0.357 4.57 2 33.0 4.6
215 4 2 2 33.427 66.853 0.358 4.56 4 128.9 139.5
216 5 2 0 33.444 66.888 0.358 4.55 4 53.2 23.7
217 2 3 3 33.538 67.076 0.359 4.53 4 33.9 9.5
218 5 2 -5 33.629 67.257 0.359 4.5 4 18.8 2.9
219 2 3 -5 33.656 67.312 0.36 4.49 4 7.0 0.4
220 4 2 -6 33.663 67.326 0.36 4.49 4 34.4 9.8
221 4 1 3 33.892 67.785 0.362 4.43 4 0.7 0.0
222 4 3 0 33.959 67.919 0.363 4.41 4 2.2 0.0
223 1 3 4 33.999 67.998 0.363 4.4 4 42.6 14.7
224 1 3 -5 34.065 68.13 0.364 4.38 4 29.8 7.2
225 4 3 -4 34.077 68.153 0.364 4.38 4 5.7 0.3
226 1 4 1 34.164 68.328 0.365 4.36 4 3.8 0.1
227 1 4 -2 34.186 68.372 0.365 4.35 4 33.4 8.9
228 4 1 -7 34.186 68.372 0.365 4.35 4 40.6 13.2
229 6 1 -1 34.219 68.439 0.365 4.34 4 36.6 10.7
230 3 3 2 34.235 68.469 0.365 4.34 4 22.9 4.2
231 3 3 -5 34.388 68.776 0.367 4.3 4 8.7 0.6
232 6 1 -5 34.395 68.79 0.367 4.29 4 17.6 2.5
233 1 1 6 34.436 68.871 0.367 4.28 4 1.7 0.0
234 0 4 2 34.462 68.924 0.367 4.28 4 2.8 0.1
235 1 1 -7 34.53 69.061 0.368 4.26 4 6.7 0.3
236 2 4 -1 34.601 69.202 0.369 4.24 4 1.9 0.0
237 0 2 6 34.708 69.415 0.37 4.22 4 64.5 32.3
238 5 0 2 34.887 69.774 0.371 4.17 2 71.4 19.5
239 2 4 0 35.013 70.026 0.372 4.14 4 27.2 5.6
240 2 4 -2 35.042 70.084 0.373 4.13 4 35.6 9.6
241 6 0 0 35.193 70.385 0.374 4.1 2 23.3 2.0
242 5 0 -7 35.213 70.425 0.374 4.09 2 0.2 0.0
243 6 0 -6 35.452 70.904 0.377 4.04 2 18.7 1.3
244 0 3 5 35.597 71.193 0.378 4.01 4 27.8 5.7
245 0 0 7 35.778 71.557 0.38 3.97 2 24.0 2.1
246 1 4 2 35.858 71.716 0.38 3.95 4 28.1 5.7
247 1 4 -3 35.894 71.788 0.381 3.94 4 7.4 0.4
248 6 2 -3 35.945 71.89 0.381 3.93 4 43.6 13.7
249 5 2 1 35.97 71.94 0.381 3.93 4 19.2 2.7
250 5 1 2 35.995 71.989 0.381 3.92 4 20.4 3.0
251 4 3 1 36.057 72.115 0.382 3.91 4 4.3 0.1
252 5 2 -6 36.22 72.441 0.384 3.87 4 42.4 12.8
253 4 3 -5 36.229 72.457 0.384 3.87 4 50.2 17.9
254 2 4 1 36.265 72.529 0.384 3.86 4 33.9 8.2
255 3 2 4 36.272 72.543 0.384 3.86 4 5.2 0.2
256 6 1 0 36.296 72.593 0.384 3.86 4 20.6 3.0
257 5 1 -7 36.316 72.632 0.384 3.85 4 9.9 0.7
258 2 4 -3 36.322 72.643 0.384 3.85 4 3.1 0.1
259 6 2 -2 36.322 72.644 0.384 3.85 4 74.6 39.4
260 6 2 -4 36.407 72.815 0.385 3.84 4 71.6 36.1
261 2 2 5 36.448 72.896 0.386 3.83 4 22.3 3.5
262 3 2 -7 36.507 73.014 0.386 3.82 4 7.6 0.4
263 5 3 -2 36.536 73.071 0.386 3.81 4 37.7 10.0
264 6 1 -6 36.553 73.106 0.387 3.81 4 22.0 3.4
265 5 3 -3 36.571 73.142 0.387 3.8 4 22.3 3.5
266 0 4 3 36.576 73.151 0.387 3.8 4 13.6 1.3
267 2 2 -7 36.619 73.237 0.387 3.79 4 7.6 0.4
268 0 1 7 36.875 73.75 0.39 3.74 4 48.1 16.0
269 3 0 5 36.887 73.774 0.39 3.74 2 66.6 15.3
270 3 4 -1 36.973 73.947 0.39 3.72 4 13.5 1.3
271 3 4 -2 36.995 73.989 0.391 3.72 4 48.9 16.4
272 3 0 -8 37.163 74.326 0.392 3.69 2 87.6 26.1
273 4 2 3 37.213 74.427 0.393 3.68 4 73.0 36.1
274 5 3 -1 37.332 74.665 0.394 3.66 4 88.2 52.4
275 2 3 4 37.334 74.668 0.394 3.66 4 36.5 9.0
276 4 0 4 37.403 74.805 0.394 3.65 2 66.0 14.6
277 5 3 -4 37.438 74.876 0.395 3.64 4 15.6 1.6
278 2 3 -6 37.475 74.95 0.395 3.63 4 32.2 6.9
279 2 0 6 37.484 74.968 0.395 3.63 2 59.7 11.9
280 4 2 -7 37.496 74.991 0.395 3.63 4 11.9 1.0
281 7 0 -3 37.517 75.034 0.395 3.63 2 20.4 1.4
282 6 2 -1 37.528 75.056 0.395 3.62 4 42.5 12.0
283 7 0 -4 37.566 75.133 0.396 3.62 2 26.1 2.3
284 3 3 3 37.581 75.161 0.396 3.62 4 26.1 4.5
285 2 0 -8 37.681 75.362 0.397 3.6 2 55.7 10.3
286 6 2 -5 37.697 75.393 0.397 3.59 4 73.9 36.1
287 1 2 6 37.736 75.472 0.397 3.59 4 38.2 9.6
288 4 0 -8 37.741 75.481 0.397 3.59 2 21.2 1.5
289 3 3 -6 37.77 75.541 0.398 3.58 4 19.0 2.4
290 3 4 0 37.781 75.562 0.398 3.58 4 59.4 23.3
291 1 2 -7 37.827 75.655 0.398 3.57 4 14.7 1.4
292 3 4 -3 37.844 75.688 0.398 3.57 4 8.4 0.5
293 3 1 5 37.972 75.943 0.399 3.55 4 8.7 0.5
294 6 0 1 38.073 76.145 0.4 3.53 2 24.8 2.0
295 1 3 5 38.194 76.387 0.401 3.51 4 66.0 28.1
296 3 1 -8 38.245 76.49 0.402 3.5 4 0.6 0.0
297 1 3 -6 38.271 76.541 0.402 3.5 4 5.3 0.2
298 7 0 -2 38.293 76.585 0.402 3.5 2 11.1 0.4
299 2 4 2 38.324 76.648 0.403 3.49 4 79.8 40.9
300 1 4 3 38.344 76.688 0.403 3.49 4 3.6 0.1
301 1 4 -4 38.393 76.786 0.403 3.48 4 29.5 5.6
302 2 4 -4 38.408 76.816 0.403 3.48 4 6.8 0.3
303 6 0 -7 38.409 76.817 0.403 3.48 2 23.9 1.8
304 7 0 -5 38.439 76.879 0.404 3.47 2 1.0 0.0
305 4 1 4 38.482 76.964 0.404 3.47 4 13.9 1.2
306 2 1 6 38.563 77.125 0.405 3.45 4 17.9 2.0
307 7 1 -3 38.595 77.191 0.405 3.45 4 8.3 0.4
308 7 1 -4 38.644 77.289 0.405 3.44 4 15.6 1.5
309 2 1 -8 38.758 77.516 0.406 3.43 4 0.3 0.0
310 4 1 -8 38.817 77.634 0.407 3.42 4 10.5 0.7
311 4 3 2 38.927 77.854 0.408 3.4 4 58.8 21.6
312 5 3 0 38.943 77.887 0.408 3.4 4 45.8 13.1
313 5 0 3 39.015 78.03 0.409 3.39 2 17.8 1.0
314 5 3 -5 39.117 78.234 0.41 3.37 4 11.7 0.8
315 6 1 1 39.146 78.292 0.41 3.37 4 0.8 0.0
316 4 3 -6 39.15 78.299 0.41 3.37 4 3.9 0.1
317 1 0 7 39.175 78.351 0.41 3.36 2 8.1 0.2
318 5 2 2 39.244 78.487 0.411 3.35 4 19.7 2.4
319 1 0 -8 39.28 78.559 0.411 3.35 2 12.9 0.5
320 7 1 -2 39.364 78.728 0.412 3.34 4 18.3 2.1
321 5 0 -8 39.397 78.794 0.412 3.33 2 4.0 0.0
322 3 4 1 39.4 78.8 0.412 3.33 4 19.0 2.2
323 0 4 4 39.46 78.92 0.413 3.33 4 14.5 1.3
324 6 1 -7 39.479 78.958 0.413 3.32 4 67.1 27.6
325 3 4 -4 39.504 79.008 0.413 3.32 4 43.3 11.4
326 7 1 -5 39.51 79.02 0.413 3.32 4 1.5 0.0
327 6 2 0 39.537 79.073 0.413 3.31 4 28.6 5.0
328 5 2 -7 39.556 79.112 0.413 3.31 4 26.3 4.2
329 6 2 -6 39.786 79.572 0.415 3.28 4 38.9 9.1
330 7 0 -1 39.878 79.755 0.416 3.27 2 14.1 0.6
331 4 4 -2 39.988 79.975 0.417 3.26 4 2.5 0.0
332 5 1 3 40.081 80.162 0.418 3.24 4 8.7 0.5
333 0 2 7 40.1 80.199 0.418 3.24 4 49.5 14.6
334 7 0 -6 40.119 80.239 0.418 3.24 2 1.2 0.0
335 0 3 6 40.138 80.276 0.418 3.24 4 6.3 0.2
336 1 1 7 40.24 80.481 0.419 3.23 4 10.5 0.6
337 1 1 -8 40.344 80.688 0.42 3.21 4 5.9 0.2
338 4 4 -1 40.365 80.731 0.42 3.21 4 60.1 21.4
339 4 4 -3 40.421 80.841 0.421 3.2 4 19.5 2.2
340 5 1 -8 40.46 80.921 0.421 3.2 4 5.3 0.2
341 7 1 -1 40.938 81.876 0.425 3.14 4 10.9 0.7
342 2 4 3 41.157 82.314 0.427 3.12 4 37.4 8.0
343 3 2 5 41.171 82.341 0.427 3.12 4 32.3 6.0
344 7 1 -6 41.178 82.357 0.427 3.12 4 41.2 9.8
345 2 4 -5 41.267 82.533 0.428 3.11 4 8.6 0.4
346 6 3 -3 41.319 82.637 0.429 3.1 4 9.6 0.5
347 5 3 1 41.342 82.685 0.429 3.1 4 33.2 6.3
348 3 2 -8 41.438 82.876 0.43 3.09 4 34.5 6.8
349 4 4 0 41.549 83.098 0.431 3.08 4 41.7 9.9
350 5 3 -6 41.583 83.165 0.431 3.08 4 4.6 0.1
351 1 4 4 41.586 83.173 0.431 3.08 4 7.8 0.3
352 3 3 4 41.632 83.264 0.431 3.07 4 1.6 0.0
353 1 4 -5 41.648 83.296 0.431 3.07 4 16.1 1.5
354 4 4 -4 41.659 83.318 0.431 3.07 4 14.5 1.2
355 4 2 4 41.671 83.341 0.432 3.07 4 22.3 2.8
356 6 3 -2 41.68 83.36 0.432 3.07 4 25.3 3.6
357 6 0 2 41.689 83.378 0.432 3.07 2 13.3 0.5
358 2 2 6 41.75 83.499 0.432 3.06 4 26.0 3.8
359 6 3 -4 41.762 83.525 0.432 3.06 4 25.2 3.6
360 7 2 -3 41.782 83.564 0.433 3.06 4 33.3 6.2
361 2 3 5 41.801 83.602 0.433 3.06 4 62.7 22.1
362 3 4 2 41.806 83.613 0.433 3.06 4 6.5 0.2
363 7 2 -4 41.83 83.66 0.433 3.05 4 8.2 0.4
364 3 3 -7 41.858 83.716 0.433 3.05 4 36.5 7.5
365 0 0 8 41.926 83.852 0.434 3.05 2 5.8 0.1
366 2 2 -8 41.941 83.883 0.434 3.04 4 24.5 3.4
367 3 4 -5 41.95 83.9 0.434 3.04 4 18.2 1.9
368 2 3 -7 41.966 83.931 0.434 3.04 4 29.5 4.9
369 4 2 -8 41.999 83.999 0.434 3.04 4 11.7 0.8
370 6 0 -8 42.1 84.199 0.435 3.03 2 74.0 15.2
371 7 0 0 42.251 84.502 0.436 3.02 2 6.7 0.1
372 6 2 1 42.323 84.646 0.437 3.01 4 14.8 1.2
373 7 2 -2 42.537 85.075 0.439 2.99 4 22.9 2.9
374 4 3 3 42.539 85.079 0.439 2.99 4 1.5 0.0
375 3 0 6 42.567 85.135 0.439 2.99 2 12.1 0.4
376 7 0 -7 42.586 85.172 0.439 2.99 2 12.5 0.4
377 6 2 -7 42.651 85.302 0.44 2.98 4 9.6 0.5
378 4 0 5 42.657 85.315 0.44 2.98 2 7.0 0.1
379 7 2 -5 42.681 85.362 0.44 2.98 4 10.4 0.6
380 6 1 2 42.741 85.481 0.441 2.97 4 7.3 0.3
381 4 3 -7 42.812 85.625 0.441 2.97 4 37.4 7.6
382 6 3 -1 42.844 85.687 0.441 2.97 4 29.3 4.7
383 3 0 -9 42.875 85.749 0.442 2.96 2 15.7 0.7
384 0 5 1 42.917 85.835 0.442 2.96 4 1.8 0.0
385 0 1 8 42.977 85.954 0.443 2.96 4 51.4 14.4
386 6 3 -5 43.007 86.015 0.443 2.95 4 12.7 0.9
387 4 0 -9 43.04 86.079 0.443 2.95 2 1.8 0.0
388 1 3 6 43.045 86.091 0.443 2.95 4 4.4 0.1
389 1 5 0 43.047 86.093 0.443 2.95 4 1.8 0.0
390 1 5 -1 43.054 86.107 0.443 2.95 4 7.9 0.3
391 0 4 5 43.09 86.18 0.443 2.95 4 16.8 1.5
392 1 3 -7 43.134 86.268 0.444 2.94 4 11.9 0.8
393 6 1 -8 43.15 86.3 0.444 2.94 4 21.8 2.6
394 5 2 3 43.244 86.488 0.445 2.94 4 12.3 0.8
395 7 1 0 43.301 86.602 0.445 2.93 4 57.1 17.6
396 1 2 7 43.401 86.803 0.446 2.92 4 9.0 0.4
397 1 2 -8 43.504 87.007 0.447 2.92 4 53.3 15.2
398 4 4 1 43.528 87.056 0.447 2.92 4 8.8 0.4
399 2 0 7 43.551 87.102 0.447 2.91 2 39.6 4.2
400 3 1 6 43.616 87.233 0.448 2.91 4 29.0 4.5
401 5 2 -8 43.619 87.238 0.448 2.91 4 56.8 17.2
402 7 1 -7 43.635 87.27 0.448 2.91 4 61.9 20.5
403 4 4 -5 43.692 87.383 0.448 2.9 4 6.0 0.2
404 4 1 5 43.706 87.412 0.449 2.9 4 30.8 5.1
405 2 0 -9 43.769 87.538 0.449 2.9 2 37.4 3.7
406 5 0 4 43.82 87.64 0.449 2.9 2 2.0 0.0
407 1 5 1 43.841 87.681 0.45 2.89 4 6.3 0.2
408 1 5 -2 43.861 87.722 0.45 2.89 4 3.0 0.0
409 3 1 -9 43.923 87.846 0.45 2.89 4 21.2 2.4
410 5 4 -2 43.985 87.97 0.451 2.89 4 53.0 14.9
411 8 0 -4 44.007 88.015 0.451 2.88 2 14.8 0.6
412 5 4 -3 44.019 88.038 0.451 2.88 4 12.8 0.9
413 4 1 -9 44.088 88.175 0.452 2.88 4 71.1 26.8
414 7 2 -1 44.091 88.183 0.452 2.88 4 18.0 1.7
415 0 5 2 44.118 88.236 0.452 2.88 4 4.6 0.1
416 2 5 -1 44.248 88.496 0.453 2.87 4 34.1 6.2
417 5 0 -9 44.263 88.526 0.453 2.87 2 13.9 0.5
418 7 2 -6 44.33 88.659 0.454 2.86 4 35.0 6.4
419 8 0 -3 44.353 88.706 0.454 2.86 2 78.1 16.1
420 8 0 -5 44.462 88.923 0.455 2.86 2 33.0 2.9
421 5 3 2 44.516 89.032 0.455 2.85 4 26.3 3.6
422 2 1 7 44.598 89.196 0.456 2.85 4 28.3 4.2
423 2 5 0 44.634 89.268 0.456 2.85 4 7.6 0.3
424 2 5 -2 44.661 89.323 0.456 2.85 4 2.4 0.0
425 5 4 -1 44.75 89.501 0.457 2.84 4 15.1 1.2
426 2 4 4 44.752 89.504 0.457 2.84 4 20.7 2.2
427 6 3 0 44.803 89.607 0.457 2.84 4 16.1 1.4
428 2 1 -9 44.816 89.632 0.458 2.84 4 45.5 10.8
429 5 3 -7 44.822 89.644 0.458 2.84 4 11.1 0.6
430 5 4 -4 44.853 89.705 0.458 2.84 4 11.7 0.7
431 5 1 4 44.867 89.734 0.458 2.84 4 16.2 1.4
432 2 4 -6 44.888 89.776 0.458 2.83 4 41.3 8.9
433 3 4 3 44.99 89.98 0.459 2.83 4 10.1 0.5
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 4.791 9.582 9.22255 11.9 1.0 1.0 5.6
2 1 0 0 5.512 11.024 8.01921 25.8 2.2 2.2 5.6
3 1 0 -1 5.547 11.095 7.96808 100.6 8.5 8.6 5.6
4 1 0 -2 8.802 17.604 5.03379 271.1 22.8 23.1 5.6
5 1 1 0 9.545 19.089 4.6454 75.1 6.3 6.4 5.6
6 2 0 0 11.076 22.152 4.00961 137.6 11.6 11.7 5.6
7 2 0 -2 11.148 22.296 3.98404 204.7 17.3 17.4 5.6
8 1 1 1 11.73 23.459 3.78903 45.4 3.8 3.8 5.6
9 1 1 -2 11.781 23.561 3.7728 15.6 1.3 1.3 5.6
10 2 1 -1 12.714 25.428 3.49998 368.1 31.0 31.1 5.6
11 1 0 2 13.031 26.063 3.41609 92.1 7.8 7.8 5.6
12 2 0 1 13.886 27.772 3.20962 94.2 7.9 8.0 5.6
13 0 0 3 14.511 29.022 3.07418 29.9 2.5 2.5 5.6
14 1 1 2 15.242 30.483 2.93003 21.2 1.8 1.8 5.6
15 3 0 -1 15.279 30.558 2.92305 12.3 1.0 1.0 5.6
16 1 1 -3 15.309 30.617 2.91752 1186.6 100.0 100.0 5.6
17 0 2 0 15.683 31.367 2.8495 410.5 34.6 34.6 5.6
18 2 1 1 15.988 31.976 2.7966 69.9 5.9 5.9 5.6
19 2 1 -3 16.09 32.181 2.77925 23.6 2.0 2.0 5.6
20 0 1 3 16.541 33.081 2.70564 316.6 26.7 26.6 5.6
21 1 2 0 16.671 33.342 2.68503 240.4 20.3 20.2 5.7
22 3 0 0 16.748 33.496 2.67307 163.5 13.8 13.7 5.7
23 3 1 -1 17.227 34.454 2.60089 470.8 39.7 39.5 5.7
24 3 1 -2 17.263 34.526 2.59562 22.0 1.9 1.8 5.7
25 2 0 2 17.68 35.361 2.53627 203.2 17.1 17.1 5.7
26 1 0 -4 17.796 35.592 2.52028 36.4 3.1 3.1 5.7
27 1 2 -2 18.097 36.194 2.47976 88.5 7.5 7.4 5.7
28 0 2 2 18.528 37.056 2.42403 238.4 20.1 20.0 5.7
29 3 1 -3 18.661 37.321 2.40741 291.0 24.5 24.4 5.7
30 2 2 -1 18.742 37.484 2.3973 28.1 2.4 2.4 5.7
31 2 2 -2 19.411 38.823 2.3177 129.1 10.9 10.8 5.7
32 1 1 3 19.447 38.895 2.31358 55.7 4.7 4.7 5.7
33 2 1 -4 19.546 39.092 2.30236 78.8 6.6 6.6 5.7
34 3 0 -4 19.585 39.171 2.29789 29.1 2.4 2.4 5.7
35 1 2 -3 20.662 41.325 2.18295 73.8 6.2 6.2 5.7
36 4 0 -1 20.892 41.784 2.16001 171.3 14.4 14.3 5.7
37 4 0 -3 20.974 41.947 2.15198 20.8 1.8 1.7 5.7
38 0 1 4 21.124 42.248 2.13735 15.4 1.3 1.3 5.7
39 2 2 1 21.191 42.382 2.1309 182.9 15.4 15.2 5.7
40 2 2 -3 21.272 42.544 2.12319 180.5 15.2 15.0 5.7
41 0 2 3 21.628 43.257 2.08982 156.0 13.1 13.0 5.7
42 2 0 3 22.041 44.082 2.05258 63.8 5.4 5.3 5.7
43 3 2 -1 22.18 44.359 2.04041 21.4 1.8 1.8 5.7
44 4 0 0 22.595 45.19 2.0048 51.2 4.3 4.3 5.7
45 1 0 -5 22.733 45.466 1.99327 14.1 1.2 1.2 5.7
46 2 1 3 23.508 47.015 1.93115 39.9 3.4 3.3 5.7
47 2 2 2 23.99 47.981 1.89452 118.6 10.0 9.8 5.7
48 2 2 -4 24.1 48.2 1.8864 217.9 18.4 18.0 5.7
49 1 1 -5 24.167 48.334 1.8815 29.8 2.5 2.5 5.7
50 3 1 2 24.377 48.754 1.86627 35.5 3.0 2.9 5.7
51 1 3 0 24.627 49.253 1.84851 20.9 1.8 1.7 5.7
52 3 2 1 25.376 50.752 1.79739 12.4 1.0 1.0 5.8
53 0 2 4 25.452 50.904 1.79238 20.5 1.7 1.7 5.8
54 1 3 1 25.657 51.314 1.77901 12.9 1.1 1.1 5.8
55 5 0 -2 25.841 51.683 1.76717 52.1 4.4 4.3 5.8
56 0 1 5 26.036 52.072 1.75488 17.3 1.5 1.4 5.8
57 4 2 -2 26.114 52.229 1.74999 26.4 2.2 2.2 5.8
58 2 3 -1 26.175 52.35 1.74621 44.9 3.8 3.7 5.8
59 4 1 -5 26.79 53.579 1.70901 65.0 5.5 5.3 5.8
60 2 0 -6 26.975 53.95 1.69816 32.4 2.7 2.7 5.8
61 5 1 -2 27.152 54.305 1.68789 18.1 1.5 1.5 5.8
62 5 1 -3 27.194 54.388 1.68549 14.4 1.2 1.2 5.8
63 3 0 -6 27.327 54.654 1.67793 31.8 2.7 2.6 5.8
64 1 3 -3 27.684 55.369 1.65794 122.1 10.3 10.0 5.8
65 1 0 5 27.827 55.654 1.65011 13.5 1.1 1.1 5.8
66 1 0 -6 27.918 55.835 1.64518 113.3 9.5 9.3 5.8
67 4 2 0 28.02 56.04 1.63965 30.2 2.5 2.5 5.8
68 5 1 -1 28.084 56.168 1.63623 207.2 17.5 17.0 5.8
69 4 2 -4 28.151 56.303 1.63263 169.8 14.3 13.9 5.8
70 2 1 -6 28.249 56.498 1.62744 16.0 1.3 1.3 5.8
71 3 2 2 28.327 56.655 1.62333 55.6 4.7 4.6 5.8
72 0 3 3 28.467 56.934 1.61602 49.5 4.2 4.1 5.8
73 4 0 -6 28.942 57.884 1.59173 222.1 18.7 18.2 5.8
74 1 1 5 29.077 58.153 1.58501 66.4 5.6 5.4 5.8
75 4 1 2 29.911 59.821 1.54473 136.8 11.5 11.2 5.8
76 2 3 -4 30.532 61.063 1.51626 31.2 2.6 2.5 5.8
77 6 0 -3 31.404 62.807 1.47828 13.0 1.1 1.1 5.9
78 2 2 4 31.721 63.442 1.46501 57.9 4.9 4.7 5.9
79 3 0 4 31.752 63.504 1.46372 14.7 1.2 1.2 5.9
80 5 2 -4 31.834 63.667 1.46038 98.4 8.3 8.0 5.9
81 2 2 -6 31.873 63.746 1.45876 91.5 7.7 7.4 5.9
82 3 2 -6 32.191 64.382 1.44588 66.0 5.6 5.3 5.9
83 4 0 3 32.752 65.505 1.42379 227.9 19.2 18.4 5.9
84 2 1 5 33.095 66.189 1.41071 47.2 4.0 3.8 5.9
85 3 1 -7 33.156 66.312 1.40839 14.9 1.3 1.2 5.9
86 2 1 -7 33.273 66.546 1.40402 15.8 1.3 1.3 5.9
87 4 2 2 33.427 66.853 1.3983 167.7 14.1 13.5 5.9
88 1 3 4 33.999 67.998 1.37752 14.7 1.2 1.2 5.9
89 4 1 -7 34.186 68.372 1.3709 22.1 1.9 1.8 5.9
90 6 1 -1 34.219 68.439 1.36972 14.9 1.3 1.2 5.9
91 0 2 6 34.708 69.415 1.35282 32.3 2.7 2.6 5.9
92 5 0 2 34.887 69.774 1.34675 19.5 1.6 1.6 5.9
93 2 4 -2 35.042 70.084 1.34155 15.3 1.3 1.2 5.9
94 6 2 -3 35.945 71.89 1.31221 16.4 1.4 1.3 5.9
95 4 3 -5 36.229 72.457 1.30333 30.8 2.6 2.5 5.9
96 6 2 -2 36.322 72.644 1.30044 43.2 3.6 3.4 6.0
97 6 2 -4 36.407 72.815 1.29781 36.1 3.0 2.9 6.0
98 5 3 -2 36.536 73.071 1.29389 13.3 1.1 1.1 6.0
99 0 1 7 36.875 73.75 1.28365 31.2 2.6 2.5 6.0
100 3 4 -2 36.995 73.989 1.28008 17.7 1.5 1.4 6.0
101 3 0 -8 37.163 74.326 1.27511 26.1 2.2 2.1 6.0
102 4 2 3 37.213 74.427 1.27365 36.1 3.0 2.9 6.0
103 5 3 -1 37.332 74.665 1.27017 61.4 5.2 4.9 6.0
104 4 0 4 37.403 74.805 1.26814 14.6 1.2 1.2 6.0
105 2 0 6 37.484 74.968 1.26579 19.8 1.7 1.6 6.0
106 6 2 -1 37.528 75.056 1.26452 13.4 1.1 1.1 6.0
107 6 2 -5 37.697 75.393 1.25969 46.4 3.9 3.7 6.0
108 3 4 0 37.781 75.562 1.25731 25.6 2.2 2.0 6.0
109 1 3 5 38.194 76.387 1.24576 28.1 2.4 2.2 6.0
110 2 4 2 38.324 76.648 1.24218 41.0 3.5 3.2 6.0
111 4 3 2 38.927 77.854 1.22592 34.8 2.9 2.7 6.0
112 6 1 -7 39.479 78.958 1.21152 40.3 3.4 3.2 6.0
113 0 2 7 40.1 80.199 1.19587 14.6 1.2 1.2 6.0
114 4 4 -1 40.365 80.731 1.18933 21.4 1.8 1.7 6.1
115 7 1 -6 41.178 82.357 1.16992 23.8 2.0 1.9 6.1
116 2 3 5 41.801 83.602 1.15562 28.6 2.4 2.2 6.1
117 6 0 -8 42.1 84.199 1.14895 15.2 1.3 1.2 6.1
118 0 1 8 42.977 85.954 1.12993 15.3 1.3 1.2 6.1
119 7 1 0 43.301 86.602 1.12313 17.6 1.5 1.4 6.1
120 1 2 -8 43.504 87.007 1.11894 15.6 1.3 1.2 6.1
121 7 1 -7 43.635 87.27 1.11625 42.2 3.6 3.3 6.2
122 5 4 -2 43.985 87.97 1.10916 15.5 1.3 1.2 6.2
123 4 1 -9 44.088 88.175 1.10711 28.6 2.4 2.2 6.2
124 8 0 -3 44.353 88.706 1.10186 22.5 1.9 1.7 6.2
125 2 1 -9 44.816 89.632 1.09285 12.8 1.1 1.0 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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