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
3, Sr, f-epidote, s-epidote
Ca(1.82)Sr(0.06)Al(1.86)Mn(0.82)Fe(0.35)Si(3)O(12)OH
Monoclinic P 2(1)/m Z = 2
R =0.05 NR =3651
2 .6 .1995
Ref.Str.:
Catti M., Ferraris G., Ivaldi G. (1989)
* Neues Jb. Miner., Mh., H.8, 357-366
Reserv:
SM86-Ca[Ca(0.947)Sr(0.053)][Al(0.891)Mn(0.179)]Al
[Mn(0.64)Fe(0.35)Al(0.07)]Si(3)O(12)OH. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.879 alpha = 90.0
b = 5.687 beta = 115.35
c = 10.187 gamma = 90.0
Unit cell volume (cub. angs.) = 464.86
Molar volume ( cub.cm/mol.) = 140.0
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.7566 0.75 0.1521 0.96 Ca = 1.00
2 0.5991 0.75 0.4253 1.08 Ca = 0.95, Sr = 0.05
3 0.3419 0.75 0.0461 0.6 Si = 1.00
4 0.6855 0.25 0.274 0.59 Si = 1.00
5 0.1857 0.75 0.3195 0.61 Si = 1.00
6 0.0 0.0 0.0 0.52 Al = 0.89, Mn = 0.18
7 0.0 0.0 0.5 0.54 Al = 1.00
8 0.2963 0.25 0.2225 0.58 Mn = 0.64, Fe = 0.35, Al = 0.07
9 0.2342 0.9921 0.0367 0.95 O = 1.00
10 0.3065 0.9797 0.3558 0.86 O = 1.00
11 0.7974 0.0161 0.3363 0.83 O = 1.00
12 0.0583 0.25 0.1317 0.72 O = 1.00
13 0.0706 0.75 0.4099 0.85 O = 1.00
14 0.5148 0.75 0.1821 0.92 O = 1.00
15 0.5291 0.25 0.3137 1.12 O = 1.00
16 0.6188 0.25 0.0972 1.38 O = 1.00
17 0.0876 0.25 0.4336 0.8 O = 1.00
18 0.0422 0.75 0.1475 0.72 O = 1.00
19 0.07 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 0.7566 0.75 0.1521
2 2 0.5991 0.75 0.4253
3 3 0.3419 0.75 0.0461
4 4 0.6855 0.25 0.274
5 5 0.1857 0.75 0.3195
6 6 0.0 0.0 0.0
7 7 0.0 0.0 0.5
8 8 0.2963 0.25 0.2225
9 9 0.2342 0.9921 0.0367
10 10 0.3065 0.9797 0.3558
11 11 0.7974 0.0161 0.3363
12 12 0.0583 0.25 0.1317
13 13 0.0706 0.75 0.4099
14 14 0.5148 0.75 0.1821
15 15 0.5291 0.25 0.3137
16 16 0.6188 0.25 0.0972
17 17 0.0876 0.25 0.4336
18 18 0.0422 0.75 0.1475
19 19 0.07 0.25 0.352
20 1 0.2434 0.25 0.8479
21 2 0.4009 0.25 0.5747
22 3 0.6581 0.25 0.9539
23 4 0.3145 0.75 0.726
24 5 0.8143 0.25 0.6805
25 6 0.0 0.5 0.0
26 7 0.0 0.5 0.5
27 8 0.7037 0.75 0.7775
28 9 0.7658 0.4921 0.9633
29 10 0.6935 0.4797 0.6442
30 11 0.2026 0.5161 0.6637
31 12 0.9417 0.75 0.8683
32 13 0.9294 0.25 0.5901
33 14 0.4852 0.25 0.8179
34 15 0.4709 0.75 0.6863
35 16 0.3812 0.75 0.9028
36 17 0.9124 0.75 0.5664
37 18 0.9578 0.25 0.8525
38 19 0.93 0.75 0.648
39 9 0.2342 0.5079 0.0367
40 10 0.3065 0.5203 0.3558
41 11 0.7974 0.4839 0.3363
42 9 0.7658 0.0079 0.9633
43 10 0.6935 0.0203 0.6442
44 11 0.2026 0.9839 0.6637
X-ray density (g/cm cub.) = 3.52
MU (1/cm) = 300.835 Mass attenuation coefficient (cm**2/g) = 85.399
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca 2.88 6
2.3152 11
2.2945 14
2.5563 18
2.4477 9
2.3152 11
2.4477 9
2 Ca ,Sr 3.072 10
2.717 10
2.753 11
2.2606 14
3.0264 15
3.0264 15
2.5372 10
2.526 17
2.717 10
2.753 11
2.5372 10
3 Si 2.1 4
1.6556 9
1.5668 14
1.6398 16
1.6556 9
4 Si 2.1 4
1.6185 11
1.604 15
1.6374 16
1.6185 11
5 Si 2.1 4
1.6291 10
1.6427 13
1.6679 18
1.6291 10
6 Al ,Mn 2.724 6
1.9494 9
1.8694 12
1.9843 18
1.8694 12
1.9843 18
1.9494 9
7 Al 2.316 6
1.8592 11
1.9363 13
1.88 17
1.9363 13
1.88 17
1.8592 11
8 Mn ,Fe ,Al 2.724 6
2.268 9
2.0273 10
1.9098 12
1.8685 15
2.268 9
2.0273 10
9 O 3.264 10
3.0327 10
2.6118 12
2.6715 14
3.2624 15
2.7791 18
2.7872 12
2.6428 16
2.7842 18
2.9334 9
2.7536 9
10 O 3.264 8
3.0327 9
2.8501 12
2.7177 13
2.6794 15
2.8439 17
2.7299 18
3.0744 10
2.6126 10
11 O 3.264 9
2.6794 13
2.771 14
2.651 15
2.6286 16
2.6841 17
2.6894 13
2.6034 17
2.6604 11
3.0266 11
12 O 3.264 10
2.6118 9
2.8501 10
2.9734 17
2.8551 18
2.8551 18
2.7872 9
2.5909 18
2.6118 9
2.8501 10
2.7872 9
13 O 3.264 10
2.7177 10
2.6794 11
2.8523 17
2.8523 17
2.5752 18
2.6894 11
2.5362 17
2.7177 10
2.6794 11
2.6894 11
14 O 3.264 9
2.6715 9
2.771 11
3.123 15
3.123 15
3.2203 16
3.2203 16
2.5715 16
2.6715 9
2.771 11
15 O 3.264 9
3.2624 9
2.6794 10
2.651 11
3.123 14
3.123 14
2.6462 16
3.2624 9
2.6794 10
2.651 11
16 O 3.264 8
2.6286 11
3.2203 14
3.2203 14
2.6462 15
2.6428 9
2.5715 14
2.6286 11
2.6428 9
17 O 3.264 10
2.8439 10
2.6841 11
2.9734 12
2.8523 13
2.8523 13
2.6034 11
2.5362 13
2.8439 10
2.6841 11
2.6034 11
18 O 3.264 10
2.7791 9
2.7299 10
2.8551 12
2.8551 12
2.5752 13
2.7842 9
2.5909 12
2.7791 9
2.7299 10
2.7842 9
19 H 1.632 1
0.7773 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 4.8 9.599 0.054 282.7 2 10.5 28.7
2 1 0 0 5.509 11.017 0.062 214.05 2 13.7 37.1
3 1 0 -1 5.545 11.091 0.063 211.2 2 23.1 104.1
4 1 0 1 8.741 17.482 0.099 83.67 2 12.6 12.3
5 1 0 -2 8.811 17.622 0.099 82.31 2 61.2 285.4
6 0 1 1 9.161 18.322 0.103 75.98 4 0.8 0.1
7 1 1 0 9.556 19.112 0.108 69.64 4 18.7 45.2
8 1 1 -1 9.578 19.155 0.108 69.32 4 17.9 41.0
9 0 0 2 9.633 19.267 0.109 68.5 2 0.2 0.0
10 2 0 -1 9.992 19.984 0.113 63.51 2 2.1 0.2
11 2 0 0 11.069 22.138 0.125 51.36 2 56.6 152.4
12 2 0 -2 11.144 22.287 0.125 50.65 2 68.9 222.3
13 1 1 1 11.746 23.491 0.132 45.38 4 22.8 43.6
14 1 1 -2 11.799 23.597 0.133 44.95 4 17.1 24.3
15 0 1 2 12.432 24.865 0.14 40.28 4 3.9 1.1
16 2 1 -1 12.716 25.432 0.143 38.41 4 70.4 352.0
17 1 0 2 13.048 26.097 0.147 36.38 2 56.4 107.0
18 1 0 -3 13.128 26.257 0.147 35.91 2 8.4 2.3
19 2 1 0 13.589 27.179 0.153 33.38 4 11.5 8.2
20 2 1 -2 13.651 27.302 0.153 33.06 4 12.3 9.2
21 2 0 1 13.889 27.777 0.156 31.87 2 52.5 81.3
22 2 0 -3 14.009 28.018 0.157 31.29 2 2.5 0.2
23 0 0 3 14.537 29.075 0.163 28.92 2 33.4 29.9
24 3 0 -1 15.264 30.527 0.171 26.05 2 25.1 15.2
25 1 1 2 15.265 30.53 0.171 26.05 4 20.0 19.3
26 3 0 -2 15.305 30.61 0.171 25.9 2 73.5 129.4
27 1 1 -3 15.334 30.669 0.172 25.8 4 145.7 1014.2
28 0 2 0 15.717 31.435 0.176 24.46 2 132.8 399.0
29 2 1 1 15.999 31.997 0.179 23.54 4 37.4 61.0
30 2 1 -3 16.105 32.209 0.18 23.21 4 27.0 31.3
31 0 2 1 16.47 32.941 0.184 22.11 4 5.9 1.4
32 0 1 3 16.572 33.144 0.185 21.82 4 88.5 316.4
33 1 2 0 16.702 33.404 0.187 21.45 4 76.7 233.6
34 1 2 -1 16.715 33.43 0.187 21.41 4 3.1 0.4
35 3 0 0 16.738 33.475 0.187 21.35 2 93.9 174.1
36 3 0 -3 16.852 33.704 0.188 21.04 2 13.9 3.8
37 3 1 -1 17.221 34.442 0.192 20.07 4 111.7 463.3
38 3 1 -2 17.258 34.517 0.193 19.97 4 23.0 19.5
39 2 0 2 17.694 35.388 0.197 18.91 2 107.0 200.5
40 1 0 3 17.741 35.483 0.198 18.8 2 2.4 0.1
41 1 0 -4 17.826 35.653 0.199 18.61 2 38.8 26.0
42 2 0 -4 17.84 35.679 0.199 18.58 2 19.0 6.2
43 1 2 1 18.096 36.192 0.202 18.01 4 18.9 11.8
44 1 2 -2 18.132 36.263 0.202 17.93 4 51.4 87.6
45 3 1 0 18.557 37.114 0.207 17.04 4 17.2 9.3
46 0 2 2 18.567 37.134 0.207 17.02 4 89.6 252.8
47 3 1 -3 18.662 37.324 0.208 16.83 4 98.8 304.0
48 2 2 -1 18.766 37.531 0.209 16.62 4 30.6 28.8
49 2 2 0 19.392 38.784 0.216 15.46 4 20.3 11.7
50 3 0 1 19.422 38.844 0.216 15.41 2 26.1 9.7
51 2 1 2 19.436 38.871 0.216 15.38 4 25.7 18.8
52 2 2 -2 19.437 38.874 0.216 15.38 4 60.4 103.7
53 1 1 3 19.479 38.959 0.216 15.31 4 45.0 57.4
54 0 0 4 19.553 39.107 0.217 15.18 2 3.3 0.1
55 1 1 -4 19.558 39.116 0.217 15.17 4 29.8 25.0
56 2 1 -4 19.57 39.14 0.217 15.15 4 43.6 53.2
57 3 0 -4 19.59 39.18 0.218 15.12 2 43.4 26.4
58 4 0 -2 20.305 40.611 0.225 13.96 2 21.9 6.2
59 1 2 2 20.649 41.298 0.229 13.44 4 18.2 8.2
60 1 2 -3 20.702 41.405 0.229 13.37 4 57.0 80.3
61 4 0 -1 20.872 41.744 0.231 13.13 2 120.6 176.6
62 4 0 -3 20.956 41.913 0.232 13.01 2 36.8 16.3
63 3 1 1 21.042 42.084 0.233 12.89 4 1.6 0.1
64 0 1 4 21.165 42.33 0.234 12.72 4 23.0 12.5
65 3 1 -4 21.199 42.398 0.235 12.68 4 15.5 5.6
66 2 2 1 21.219 42.439 0.235 12.65 4 85.0 169.2
67 2 2 -3 21.303 42.605 0.236 12.54 4 85.9 171.2
68 0 2 3 21.673 43.346 0.24 12.06 4 84.2 158.3
69 4 1 -2 21.871 43.742 0.242 11.82 4 9.7 2.1
70 2 0 3 22.066 44.133 0.244 11.58 2 75.8 61.5
71 3 2 -1 22.194 44.388 0.245 11.43 4 30.1 19.2
72 3 2 -2 22.224 44.448 0.246 11.4 4 10.7 2.4
73 2 0 -5 22.228 44.456 0.246 11.4 2 19.4 4.0
74 4 1 -1 22.405 44.811 0.247 11.19 4 5.2 0.5
75 4 1 -3 22.485 44.97 0.248 11.1 4 0.4 0.0
76 4 0 0 22.581 45.162 0.249 11.0 2 72.5 53.5
77 1 0 4 22.685 45.37 0.25 10.88 2 11.3 1.3
78 4 0 -4 22.739 45.479 0.251 10.82 2 16.1 2.6
79 1 0 -5 22.774 45.548 0.251 10.79 2 35.0 12.3
80 3 0 2 22.963 45.926 0.253 10.59 2 12.0 1.4
81 3 0 -5 23.168 46.337 0.255 10.38 2 31.2 9.4
82 3 2 0 23.289 46.579 0.257 10.26 4 15.0 4.3
83 3 2 -3 23.376 46.753 0.258 10.17 4 16.0 4.8
84 2 1 3 23.538 47.075 0.259 10.01 4 50.3 46.9
85 2 1 -5 23.691 47.382 0.261 9.87 4 6.8 0.9
86 2 2 2 24.025 48.05 0.264 9.56 4 76.9 104.5
87 4 1 0 24.027 48.055 0.264 9.55 4 1.9 0.1
88 1 2 3 24.062 48.124 0.265 9.52 4 24.0 10.2
89 1 1 4 24.127 48.254 0.265 9.47 4 41.0 29.4
90 1 2 -4 24.128 48.256 0.265 9.46 4 59.5 62.1
91 2 2 -4 24.138 48.277 0.265 9.45 4 84.0 123.4
92 4 1 -4 24.179 48.357 0.266 9.42 4 1.9 0.1
93 1 1 -5 24.212 48.424 0.266 9.39 4 42.5 31.4
94 3 1 2 24.392 48.785 0.268 9.23 4 43.1 31.7
95 0 3 1 24.511 49.021 0.269 9.13 4 2.3 0.1
96 3 1 -5 24.588 49.177 0.27 9.07 4 2.1 0.1
97 1 3 0 24.678 49.357 0.271 8.99 4 32.9 18.0
98 1 3 -1 24.688 49.375 0.271 8.98 4 12.0 2.4
99 0 0 5 24.731 49.461 0.272 8.95 2 25.2 5.3
100 4 0 1 25.25 50.5 0.277 8.53 2 23.5 4.4
101 3 2 1 25.398 50.795 0.278 8.42 4 28.1 12.3
102 4 0 -5 25.468 50.936 0.279 8.37 2 2.0 0.0
103 0 2 4 25.504 51.008 0.279 8.34 4 35.3 19.3
104 3 2 -4 25.534 51.068 0.28 8.32 4 4.6 0.3
105 1 3 1 25.711 51.421 0.282 8.19 4 24.1 8.8
106 1 3 -2 25.738 51.475 0.282 8.17 4 18.8 5.4
107 5 0 -2 25.813 51.627 0.283 8.12 2 83.3 52.1
108 5 0 -3 25.858 51.716 0.283 8.08 2 31.0 7.2
109 0 3 2 26.069 52.137 0.285 7.94 4 3.0 0.1
110 0 1 5 26.087 52.174 0.285 7.92 4 37.9 21.1
111 4 2 -2 26.119 52.238 0.286 7.9 4 42.0 25.8
112 2 3 -1 26.221 52.442 0.287 7.83 4 54.0 42.2
113 4 1 1 26.587 53.174 0.291 7.59 4 4.5 0.3
114 4 2 -1 26.588 53.176 0.291 7.59 4 25.5 9.1
115 4 2 -3 26.658 53.316 0.291 7.54 4 22.8 7.2
116 2 3 0 26.706 53.412 0.292 7.51 4 11.6 1.9
117 2 3 -2 26.741 53.482 0.292 7.49 4 7.9 0.9
118 5 0 -1 26.779 53.558 0.292 7.47 2 13.3 1.2
119 4 1 -5 26.797 53.595 0.293 7.45 4 62.6 54.1
120 2 0 4 26.843 53.686 0.293 7.42 2 34.7 8.3
121 5 0 -4 26.91 53.82 0.294 7.38 2 15.1 1.6
122 2 0 -6 27.018 54.035 0.295 7.32 2 64.2 27.9
123 3 0 3 27.123 54.246 0.296 7.25 2 19.9 2.7
124 5 1 -2 27.131 54.261 0.296 7.25 4 35.6 17.0
125 5 1 -3 27.174 54.348 0.296 7.22 4 37.3 18.5
126 3 0 -6 27.357 54.713 0.298 7.11 2 73.6 35.7
127 2 2 3 27.591 55.182 0.301 6.97 4 4.6 0.3
128 1 3 2 27.7 55.401 0.302 6.91 4 12.4 2.0
129 2 2 -5 27.728 55.457 0.302 6.9 4 26.0 8.6
130 1 3 -3 27.743 55.486 0.302 6.89 4 94.1 112.8
131 1 0 5 27.877 55.754 0.304 6.81 2 47.6 14.3
132 1 0 -6 27.97 55.941 0.304 6.76 2 136.7 116.9
133 4 2 0 28.029 56.059 0.305 6.73 4 48.7 29.6
134 5 1 -1 28.065 56.129 0.305 6.71 4 96.7 116.1
135 1 2 4 28.119 56.237 0.306 6.68 4 70.4 61.2
136 2 1 4 28.127 56.254 0.306 6.68 4 42.0 21.8
137 2 3 1 28.16 56.321 0.306 6.66 4 28.2 9.8
138 4 2 -4 28.165 56.33 0.306 6.66 4 115.8 165.2
139 5 1 -4 28.192 56.384 0.307 6.64 4 29.2 10.5
140 1 2 -5 28.195 56.39 0.307 6.64 4 0.5 0.0
141 2 3 -3 28.228 56.456 0.307 6.62 4 17.5 3.8
142 2 1 -6 28.296 56.592 0.308 6.59 4 36.4 16.1
143 3 2 2 28.357 56.714 0.308 6.55 4 69.6 58.8
144 3 1 3 28.398 56.796 0.309 6.53 4 24.8 7.5
145 0 3 3 28.53 57.06 0.31 6.46 4 64.4 49.7
146 3 2 -5 28.534 57.067 0.31 6.46 4 14.7 2.6
147 3 1 -6 28.625 57.25 0.311 6.42 4 13.4 2.1
148 5 0 0 28.684 57.369 0.312 6.39 2 18.0 1.9
149 4 0 2 28.69 57.381 0.312 6.38 2 6.5 0.2
150 5 0 -5 28.893 57.786 0.314 6.28 2 2.4 0.0
151 4 0 -6 28.957 57.914 0.314 6.25 2 136.8 108.2
152 3 3 -1 28.958 57.916 0.314 6.25 4 92.6 99.2
153 3 3 -2 28.983 57.965 0.315 6.24 4 31.4 11.4
154 1 1 5 29.13 58.26 0.316 6.17 4 73.4 61.4
155 1 1 -6 29.221 58.442 0.317 6.12 4 17.8 3.6
156 3 3 0 29.871 59.741 0.323 5.83 4 22.0 5.2
157 0 2 5 29.894 59.788 0.324 5.82 4 10.1 1.1
158 5 1 0 29.916 59.832 0.324 5.81 4 51.3 28.3
159 4 1 2 29.922 59.843 0.324 5.81 4 75.3 60.9
160 3 3 -3 29.944 59.888 0.324 5.8 4 67.5 48.9
161 5 1 -5 30.119 60.238 0.326 5.72 4 25.5 6.9
162 0 0 6 30.134 60.268 0.326 5.72 2 42.6 9.6
163 4 1 -6 30.182 60.363 0.326 5.7 4 4.1 0.2
164 4 2 1 30.352 60.704 0.328 5.63 4 1.0 0.0
165 2 3 2 30.493 60.986 0.329 5.57 4 20.9 4.5
166 1 3 3 30.524 61.049 0.33 5.55 4 21.8 4.9
167 4 2 -5 30.546 61.091 0.33 5.55 4 46.3 22.0
168 1 3 -4 30.581 61.161 0.33 5.53 4 14.2 2.1
169 2 3 -4 30.589 61.179 0.33 5.53 4 26.4 7.1
170 5 2 -2 30.852 61.705 0.333 5.42 4 14.6 2.1
171 5 2 -3 30.892 61.785 0.333 5.41 4 7.2 0.5
172 0 1 6 31.331 62.661 0.338 5.24 4 1.3 0.0
173 6 0 -3 31.368 62.737 0.338 5.23 2 51.7 12.9
174 5 0 1 31.421 62.842 0.338 5.21 2 2.9 0.0
175 3 3 1 31.672 63.344 0.341 5.12 4 10.4 1.0
176 5 0 -6 31.697 63.394 0.341 5.11 2 48.6 11.2
177 5 2 -1 31.716 63.433 0.341 5.1 4 33.8 10.8
178 0 3 4 31.764 63.528 0.342 5.09 4 13.5 1.7
179 6 0 -2 31.771 63.541 0.342 5.09 2 8.0 0.3
180 2 2 4 31.774 63.548 0.342 5.08 4 63.1 37.5
181 3 0 4 31.787 63.575 0.342 5.08 2 59.2 16.5
182 3 3 -4 31.79 63.58 0.342 5.08 4 7.7 0.6
183 5 2 -4 31.834 63.669 0.342 5.06 4 106.8 107.0
184 6 0 -4 31.865 63.73 0.343 5.05 2 97.0 44.0
185 2 2 -6 31.931 63.863 0.343 5.03 4 70.7 46.6
186 2 0 5 31.99 63.98 0.344 5.01 2 6.2 0.2
187 3 2 3 32.026 64.053 0.344 5.0 4 37.8 13.2
188 3 0 -7 32.046 64.093 0.344 4.99 2 8.3 0.3
189 2 0 -7 32.178 64.356 0.346 4.95 2 23.8 2.6
190 3 2 -6 32.238 64.475 0.346 4.93 4 88.5 71.4
191 4 3 -2 32.3 64.6 0.347 4.91 4 2.0 0.0
192 6 1 -3 32.539 65.077 0.349 4.83 4 13.8 1.7
193 5 1 1 32.59 65.18 0.35 4.81 4 30.5 8.3
194 1 2 5 32.709 65.419 0.351 4.77 4 23.1 4.7
195 4 3 -1 32.712 65.423 0.351 4.77 4 0.5 0.0
196 4 0 3 32.771 65.542 0.351 4.75 2 48.1 10.2
197 4 3 -3 32.774 65.547 0.351 4.75 4 4.5 0.2
198 1 2 -6 32.794 65.589 0.352 4.75 4 18.9 3.1
199 0 4 0 32.805 65.61 0.352 4.74 2 221.3 215.0
200 5 1 -6 32.861 65.723 0.352 4.73 4 8.4 0.6
201 6 1 -2 32.933 65.866 0.353 4.7 4 25.5 5.7
202 3 1 4 32.95 65.899 0.353 4.7 4 5.1 0.2
203 6 1 -4 33.026 66.052 0.354 4.68 4 24.9 5.4
204 6 0 -1 33.054 66.107 0.354 4.67 2 10.1 0.4
205 4 0 -7 33.08 66.16 0.354 4.66 2 5.7 0.1
206 2 1 5 33.149 66.297 0.355 4.64 4 75.1 48.5
207 3 1 -7 33.204 66.408 0.355 4.62 4 40.4 14.0
208 6 0 -5 33.238 66.476 0.356 4.61 2 29.9 3.8
209 0 4 1 33.244 66.488 0.356 4.61 4 7.5 0.5
210 2 1 -7 33.333 66.666 0.357 4.59 4 36.6 11.3
211 1 0 6 33.368 66.735 0.357 4.58 2 16.2 1.1
212 1 4 0 33.382 66.764 0.357 4.57 4 7.7 0.5
213 1 4 -1 33.39 66.78 0.357 4.57 4 13.1 1.5
214 5 2 0 33.446 66.892 0.358 4.55 4 57.1 27.5
215 4 2 2 33.451 66.903 0.358 4.55 4 131.7 146.2
216 1 0 -7 33.467 66.935 0.358 4.55 2 36.1 5.5
217 2 3 3 33.6 67.2 0.359 4.51 4 36.9 11.4
218 5 2 -5 33.637 67.274 0.36 4.5 4 20.4 3.5
219 4 2 -6 33.696 67.392 0.36 4.48 4 34.4 9.8
220 2 3 -5 33.722 67.445 0.36 4.47 4 7.8 0.5
221 4 1 3 33.916 67.831 0.362 4.42 4 1.8 0.0
222 4 3 0 33.991 67.983 0.363 4.4 4 1.1 0.0
223 1 3 4 34.071 68.142 0.364 4.38 4 39.8 12.9
224 4 3 -4 34.113 68.226 0.364 4.37 4 6.2 0.3
225 1 3 -5 34.139 68.279 0.364 4.36 4 30.5 7.5
226 6 1 -1 34.193 68.387 0.365 4.35 4 37.0 11.0
227 4 1 -7 34.219 68.439 0.365 4.34 4 38.1 11.7
228 1 4 1 34.242 68.484 0.365 4.33 4 6.2 0.3
229 1 4 -2 34.265 68.53 0.365 4.33 4 34.3 9.4
230 3 3 2 34.285 68.57 0.366 4.32 4 21.0 3.5
231 6 1 -5 34.375 68.75 0.366 4.3 4 16.3 2.1
232 3 3 -5 34.444 68.888 0.367 4.28 4 6.8 0.4
233 1 1 6 34.502 69.005 0.368 4.27 4 0.8 0.0
234 0 4 2 34.544 69.088 0.368 4.26 4 1.5 0.0
235 1 1 -7 34.601 69.201 0.369 4.24 4 7.0 0.4
236 2 4 -1 34.673 69.346 0.369 4.22 4 1.8 0.0
237 0 2 6 34.781 69.563 0.37 4.2 4 65.7 33.5
238 5 0 2 34.889 69.777 0.371 4.17 2 72.4 20.2
239 2 4 0 35.085 70.171 0.373 4.12 4 29.0 6.4
240 2 4 -2 35.115 70.231 0.373 4.12 4 37.8 10.9
241 6 0 0 35.168 70.337 0.374 4.1 2 26.0 2.6
242 5 0 -7 35.226 70.452 0.374 4.09 2 0.4 0.0
243 6 0 -6 35.437 70.874 0.376 4.04 2 16.4 1.0
244 0 3 5 35.676 71.353 0.379 3.99 4 30.8 7.0
245 0 0 7 35.852 71.704 0.38 3.95 2 22.1 1.8
246 6 2 -3 35.931 71.861 0.381 3.93 4 40.9 12.2
247 1 4 2 35.94 71.881 0.381 3.93 4 31.2 7.1
248 1 4 -3 35.977 71.955 0.381 3.92 4 6.5 0.3
249 5 2 1 35.98 71.96 0.381 3.92 4 16.9 2.1
250 5 1 2 36.001 72.002 0.382 3.92 4 20.3 3.0
251 4 3 1 36.095 72.19 0.382 3.9 4 5.8 0.2
252 5 2 -6 36.239 72.477 0.384 3.87 4 39.6 11.2
253 4 3 -5 36.272 72.545 0.384 3.86 4 49.1 17.2
254 6 1 0 36.277 72.554 0.384 3.86 4 21.8 3.4
255 6 2 -2 36.307 72.615 0.384 3.86 4 72.7 37.7
256 3 2 4 36.323 72.647 0.384 3.85 4 3.4 0.1
257 5 1 -7 36.334 72.668 0.385 3.85 4 6.8 0.3
258 2 4 1 36.34 72.68 0.385 3.85 4 31.3 7.0
259 6 2 -4 36.396 72.792 0.385 3.84 4 72.2 37.1
260 2 4 -3 36.399 72.798 0.385 3.84 4 2.1 0.0
261 2 2 5 36.514 73.027 0.386 3.81 4 23.7 4.0
262 6 1 -6 36.543 73.085 0.386 3.81 4 21.2 3.2
263 5 3 -2 36.554 73.108 0.387 3.81 4 36.4 9.4
264 3 2 -7 36.566 73.133 0.387 3.8 4 6.2 0.3
265 5 3 -3 36.591 73.182 0.387 3.8 4 26.2 4.8
266 0 4 3 36.663 73.326 0.388 3.78 4 14.3 1.4
267 2 2 -7 36.69 73.38 0.388 3.78 4 7.7 0.4
268 3 0 5 36.937 73.874 0.39 3.73 2 66.6 15.3
269 0 1 7 36.952 73.905 0.39 3.73 4 49.1 16.6
270 3 4 -1 37.039 74.078 0.391 3.71 4 15.4 1.6
271 3 4 -2 37.061 74.122 0.391 3.71 4 48.1 15.9
272 3 0 -8 37.223 74.445 0.393 3.68 2 91.7 28.6
273 4 2 3 37.249 74.499 0.393 3.67 4 71.5 34.7
274 5 3 -1 37.352 74.705 0.394 3.66 4 89.5 54.2
275 2 3 4 37.406 74.812 0.394 3.65 4 35.8 8.7
276 4 0 4 37.436 74.871 0.395 3.64 2 64.4 14.0
277 5 3 -4 37.462 74.924 0.395 3.64 4 14.3 1.4
278 7 0 -3 37.472 74.945 0.395 3.63 2 19.3 1.2
279 6 2 -1 37.516 75.033 0.395 3.63 4 42.4 12.1
280 7 0 -4 37.523 75.047 0.395 3.62 2 28.5 2.7
281 4 2 -7 37.541 75.083 0.396 3.62 4 10.8 0.8
282 2 0 6 37.549 75.099 0.396 3.62 2 63.2 13.4
283 2 3 -6 37.552 75.104 0.396 3.62 4 32.1 6.9
284 3 3 3 37.64 75.28 0.396 3.6 4 26.3 4.6
285 6 2 -5 37.691 75.383 0.397 3.6 4 73.6 36.1
286 2 0 -8 37.753 75.507 0.397 3.59 2 55.6 10.3
287 4 0 -8 37.785 75.57 0.398 3.58 2 20.9 1.4
288 1 2 6 37.814 75.628 0.398 3.57 4 38.8 10.0
289 3 3 -6 37.837 75.673 0.398 3.57 4 16.8 1.9
290 3 4 0 37.848 75.696 0.398 3.57 4 61.6 25.1
291 1 2 -7 37.909 75.817 0.399 3.56 4 17.5 2.0
292 3 4 -3 37.913 75.827 0.399 3.56 4 6.6 0.3
293 3 1 5 38.026 76.051 0.4 3.54 4 8.2 0.4
294 6 0 1 38.058 76.116 0.4 3.53 2 22.2 1.6
295 7 0 -2 38.249 76.499 0.402 3.5 2 11.8 0.5
296 1 3 5 38.277 76.554 0.402 3.5 4 63.4 26.0
297 3 1 -8 38.308 76.617 0.402 3.49 4 2.1 0.0
298 1 3 -6 38.357 76.713 0.403 3.49 4 6.0 0.2
299 7 0 -5 38.401 76.803 0.403 3.48 2 3.2 0.0
300 2 4 2 38.405 76.809 0.403 3.48 4 79.5 40.7
301 6 0 -7 38.406 76.811 0.403 3.48 2 22.1 1.6
302 1 4 3 38.433 76.866 0.403 3.47 4 2.8 0.0
303 1 4 -4 38.484 76.967 0.404 3.47 4 29.0 5.4
304 2 4 -4 38.492 76.983 0.404 3.47 4 5.1 0.2
305 4 1 4 38.519 77.038 0.404 3.46 4 14.9 1.4
306 7 1 -3 38.556 77.111 0.405 3.46 4 7.3 0.3
307 7 1 -4 38.606 77.212 0.405 3.45 4 16.7 1.8
308 2 1 6 38.632 77.264 0.405 3.44 4 21.2 2.9
309 2 1 -8 38.834 77.668 0.407 3.41 4 2.4 0.0
310 4 1 -8 38.866 77.731 0.407 3.41 4 9.7 0.6
311 5 3 0 38.968 77.936 0.408 3.39 4 44.2 12.3
312 4 3 2 38.973 77.946 0.408 3.39 4 58.3 21.3
313 5 0 3 39.03 78.06 0.409 3.39 2 18.9 1.1
314 6 1 1 39.136 78.272 0.41 3.37 4 0.1 0.0
315 5 3 -5 39.148 78.295 0.41 3.37 4 11.0 0.7
316 4 3 -6 39.203 78.406 0.41 3.36 4 5.7 0.2
317 1 0 7 39.255 78.51 0.411 3.35 2 4.5 0.1
318 5 2 2 39.264 78.527 0.411 3.35 4 20.7 2.7
319 7 1 -2 39.326 78.651 0.411 3.34 4 15.3 1.4
320 1 0 -8 39.363 78.725 0.412 3.34 2 10.8 0.4
321 5 0 -8 39.426 78.851 0.412 3.33 2 3.9 0.0
322 3 4 1 39.471 78.942 0.413 3.32 4 19.6 2.4
323 7 1 -5 39.477 78.953 0.413 3.32 4 2.6 0.0
324 6 1 -7 39.481 78.962 0.413 3.32 4 69.5 29.7
325 6 2 0 39.531 79.063 0.413 3.32 4 28.3 4.9
326 0 4 4 39.555 79.11 0.413 3.31 4 15.9 1.6
327 3 4 -4 39.579 79.158 0.414 3.31 4 41.9 10.7
328 5 2 -7 39.587 79.173 0.414 3.31 4 28.3 4.9
329 6 2 -6 39.79 79.579 0.415 3.28 4 44.7 12.1
330 7 0 -1 39.839 79.678 0.416 3.28 2 17.1 0.9
331 4 4 -2 40.045 80.091 0.418 3.25 4 0.9 0.0
332 7 0 -6 40.089 80.179 0.418 3.24 2 1.1 0.0
333 5 1 3 40.101 80.201 0.418 3.24 4 11.7 0.8
334 0 2 7 40.189 80.377 0.419 3.23 4 47.6 13.5
335 0 3 6 40.23 80.461 0.419 3.23 4 6.8 0.3
336 1 1 7 40.324 80.647 0.42 3.22 4 10.6 0.7
337 4 4 -1 40.423 80.847 0.421 3.2 4 60.9 22.0
338 1 1 -8 40.431 80.861 0.421 3.2 4 0.9 0.0
339 4 4 -3 40.481 80.961 0.421 3.2 4 17.2 1.8
340 5 1 -8 40.493 80.986 0.422 3.2 4 5.1 0.2
341 7 1 -1 40.904 81.808 0.425 3.15 4 14.3 1.2
342 7 1 -6 41.153 82.306 0.427 3.12 4 42.0 10.2
343 3 2 5 41.237 82.474 0.428 3.11 4 29.4 5.0
344 2 4 3 41.246 82.492 0.428 3.11 4 36.4 7.6
345 6 3 -3 41.327 82.654 0.429 3.1 4 11.7 0.8
346 2 4 -5 41.359 82.719 0.429 3.1 4 8.4 0.4
347 5 3 1 41.374 82.748 0.429 3.1 4 31.4 5.6
348 3 2 -8 41.514 83.027 0.43 3.08 4 34.7 6.9
349 4 4 0 41.61 83.22 0.431 3.08 4 43.7 10.9
350 5 3 -6 41.622 83.245 0.431 3.07 4 3.9 0.1
351 1 4 4 41.685 83.37 0.432 3.07 4 6.7 0.3
352 6 0 2 41.686 83.372 0.432 3.07 2 14.0 0.6
353 6 3 -2 41.688 83.377 0.432 3.07 4 23.1 3.0
354 3 3 4 41.704 83.407 0.432 3.07 4 2.7 0.0
355 4 2 4 41.72 83.441 0.432 3.06 4 19.5 2.2
356 4 4 -4 41.724 83.447 0.432 3.06 4 11.9 0.8
357 1 4 -5 41.749 83.497 0.432 3.06 4 18.8 2.0
358 7 2 -3 41.756 83.512 0.432 3.06 4 31.3 5.5
359 6 3 -4 41.774 83.547 0.432 3.06 4 24.5 3.4
360 7 2 -4 41.806 83.612 0.433 3.06 4 6.1 0.2
361 2 2 6 41.831 83.662 0.433 3.05 4 27.1 4.1
362 3 4 2 41.885 83.77 0.433 3.05 4 7.2 0.3
363 2 3 5 41.887 83.773 0.433 3.05 4 63.7 22.9
364 3 3 -7 41.938 83.875 0.434 3.04 4 35.2 7.0
365 0 0 8 42.018 84.036 0.434 3.04 2 3.4 0.0
366 2 2 -8 42.03 84.059 0.435 3.04 4 27.8 4.3
367 3 4 -5 42.034 84.067 0.435 3.04 4 16.5 1.5
368 2 3 -7 42.057 84.113 0.435 3.03 4 29.5 4.9
369 4 2 -8 42.061 84.121 0.435 3.03 4 11.4 0.7
370 6 0 -8 42.111 84.222 0.435 3.03 2 74.2 15.4
371 7 0 0 42.22 84.44 0.436 3.02 2 7.4 0.2
372 6 2 1 42.326 84.653 0.437 3.01 4 12.4 0.9
373 7 2 -2 42.513 85.026 0.439 2.99 4 23.7 3.1
374 7 0 -7 42.566 85.133 0.439 2.99 2 13.7 0.5
375 4 3 3 42.596 85.193 0.439 2.99 4 0.6 0.0
376 3 0 6 42.635 85.27 0.44 2.98 2 14.2 0.6
377 7 2 -5 42.661 85.323 0.44 2.98 4 7.1 0.3
378 6 2 -7 42.666 85.331 0.44 2.98 4 8.3 0.4
379 4 0 5 42.707 85.414 0.44 2.98 2 6.4 0.1
380 6 1 2 42.742 85.484 0.441 2.97 4 10.1 0.6
381 6 3 -1 42.855 85.71 0.441 2.97 4 29.8 4.9
382 4 3 -7 42.879 85.758 0.442 2.96 4 35.2 6.8
383 3 0 -9 42.953 85.906 0.442 2.96 2 14.5 0.6
384 6 3 -5 43.024 86.049 0.443 2.95 4 11.8 0.8
385 0 5 1 43.03 86.059 0.443 2.95 4 0.9 0.0
386 0 1 8 43.073 86.146 0.443 2.95 4 51.0 14.2
387 4 0 -9 43.103 86.205 0.444 2.95 2 3.7 0.0
388 1 3 6 43.144 86.287 0.444 2.94 4 5.0 0.1
389 1 5 0 43.157 86.314 0.444 2.94 4 2.0 0.0
390 1 5 -1 43.164 86.328 0.444 2.94 4 9.7 0.5
391 6 1 -8 43.166 86.332 0.444 2.94 4 20.8 2.4
392 0 4 5 43.197 86.394 0.444 2.94 4 14.7 1.2
393 1 3 -7 43.235 86.471 0.445 2.94 4 12.0 0.8
394 7 1 0 43.274 86.548 0.445 2.93 4 55.9 17.0
395 5 2 3 43.277 86.553 0.445 2.93 4 13.1 0.9
396 1 2 7 43.497 86.994 0.447 2.92 4 7.9 0.3
397 4 4 1 43.595 87.19 0.448 2.91 4 8.0 0.3
398 1 2 -8 43.603 87.206 0.448 2.91 4 55.6 16.7
399 7 1 -7 43.62 87.24 0.448 2.91 4 60.8 19.9
400 2 0 7 43.635 87.271 0.448 2.91 2 38.2 3.9
401 5 2 -8 43.665 87.329 0.448 2.91 4 56.1 16.9
402 3 1 6 43.688 87.376 0.448 2.9 4 26.3 3.7
403 4 1 5 43.76 87.52 0.449 2.9 4 32.2 5.6
404 4 4 -5 43.764 87.528 0.449 2.9 4 5.7 0.2
405 5 0 4 43.851 87.702 0.45 2.89 2 3.3 0.0
406 2 0 -9 43.861 87.722 0.45 2.89 2 36.5 3.6
407 8 0 -4 43.951 87.903 0.451 2.89 2 12.0 0.4
408 1 5 1 43.953 87.906 0.451 2.89 4 6.0 0.2
409 1 5 -2 43.974 87.949 0.451 2.89 4 4.6 0.1
410 3 1 -9 44.005 88.011 0.451 2.88 4 18.2 1.8
411 5 4 -2 44.034 88.067 0.451 2.88 4 53.0 15.0
412 5 4 -3 44.069 88.138 0.451 2.88 4 15.2 1.2
413 7 2 -1 44.071 88.142 0.451 2.88 4 19.9 2.1
414 4 1 -9 44.155 88.31 0.452 2.87 4 73.0 28.4
415 0 5 2 44.235 88.469 0.453 2.87 4 2.9 0.0
416 8 0 -3 44.296 88.593 0.453 2.87 2 78.0 16.2
417 5 0 -9 44.309 88.618 0.453 2.87 2 12.9 0.4
418 7 2 -6 44.318 88.635 0.453 2.87 4 35.0 6.5
419 2 5 -1 44.355 88.71 0.454 2.86 4 33.2 5.9
420 8 0 -5 44.409 88.818 0.454 2.86 2 30.1 2.4
421 5 3 2 44.557 89.115 0.455 2.85 4 26.0 3.6
422 2 1 7 44.687 89.374 0.456 2.84 4 28.5 4.3
423 2 5 0 44.742 89.484 0.457 2.84 4 7.0 0.3
424 2 5 -2 44.77 89.541 0.457 2.84 4 4.3 0.1
425 5 4 -1 44.801 89.602 0.457 2.84 4 13.7 1.0
426 6 3 0 44.82 89.64 0.458 2.84 4 17.2 1.6
427 2 4 4 44.852 89.705 0.458 2.84 4 21.3 2.4
428 5 3 -7 44.874 89.749 0.458 2.83 4 8.7 0.4
429 5 1 4 44.903 89.805 0.458 2.83 4 12.8 0.9
430 5 4 -4 44.907 89.813 0.458 2.83 4 12.4 0.8
431 2 1 -9 44.912 89.825 0.458 2.83 4 44.6 10.4
432 2 4 -6 44.993 89.987 0.459 2.83 4 38.2 7.7
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 0 0 1 4.8 9.599 9.20609 28.7 2.8 2.9 5.6
2 1 0 0 5.509 11.017 8.02403 37.1 3.7 3.7 5.6
3 1 0 -1 5.545 11.091 7.97104 104.1 10.3 10.4 5.6
4 1 0 1 8.741 17.482 5.06873 12.3 1.2 1.2 5.6
5 1 0 -2 8.811 17.622 5.02873 285.4 28.1 28.4 5.6
6 1 1 0 9.556 19.112 4.63983 86.2 8.5 8.6 5.6
7 2 0 0 11.069 22.138 4.01202 152.4 15.0 15.1 5.6
8 2 0 -2 11.144 22.287 3.98552 222.3 21.9 22.1 5.6
9 1 1 1 11.746 23.491 3.78391 43.6 4.3 4.3 5.6
10 1 1 -2 11.799 23.597 3.76718 24.3 2.4 2.4 5.6
11 2 1 -1 12.716 25.432 3.49939 352.0 34.7 34.9 5.6
12 1 0 2 13.048 26.097 3.41172 107.0 10.6 10.6 5.6
13 2 0 1 13.889 27.777 3.209 81.3 8.0 8.0 5.6
14 0 0 3 14.537 29.075 3.0687 29.9 3.0 3.0 5.6
15 1 1 2 15.265 30.53 2.92563 34.5 3.4 3.4 5.6
16 3 0 -2 15.305 30.61 2.91818 129.4 12.8 12.8 5.6
17 1 1 -3 15.334 30.669 2.91275 1014.2 100.0 100.0 5.6
18 0 2 0 15.717 31.435 2.8435 399.0 39.3 39.3 5.6
19 2 1 1 15.999 31.997 2.79477 61.0 6.0 6.0 5.6
20 2 1 -3 16.105 32.209 2.77685 31.3 3.1 3.1 5.6
21 0 1 3 16.572 33.144 2.70062 316.4 31.2 31.1 5.6
22 1 2 0 16.702 33.404 2.68019 234.0 23.1 23.0 5.7
23 3 0 0 16.738 33.475 2.67468 174.1 17.2 17.1 5.7
24 3 1 -1 17.221 34.442 2.60178 463.3 45.7 45.5 5.7
25 3 1 -2 17.258 34.517 2.59632 19.5 1.9 1.9 5.7
26 2 0 2 17.694 35.388 2.53437 200.5 19.8 19.7 5.7
27 1 0 -4 17.826 35.653 2.51617 32.2 3.2 3.2 5.7
28 1 2 1 18.096 36.192 2.47993 11.8 1.2 1.2 5.7
29 1 2 -2 18.132 36.263 2.4752 87.6 8.6 8.6 5.7
30 0 2 2 18.567 37.134 2.41914 262.0 25.8 25.7 5.7
31 3 1 -3 18.662 37.324 2.40724 304.0 30.0 29.8 5.7
32 2 2 -1 18.766 37.531 2.39443 28.8 2.8 2.8 5.7
33 2 2 0 19.392 38.784 2.31991 11.7 1.2 1.1 5.7
34 2 2 -2 19.437 38.874 2.31476 132.2 13.0 12.9 5.7
35 1 1 3 19.479 38.959 2.3099 57.4 5.7 5.6 5.7
36 2 1 -4 19.57 39.14 2.29963 104.6 10.3 10.2 5.7
37 1 2 -3 20.702 41.405 2.17893 80.3 7.9 7.8 5.7
38 4 0 -1 20.872 41.744 2.16201 176.6 17.4 17.2 5.7
39 4 0 -3 20.956 41.913 2.15368 16.3 1.6 1.6 5.7
40 0 1 4 21.165 42.33 2.13344 12.5 1.2 1.2 5.7
41 2 2 1 21.219 42.439 2.1282 174.8 17.2 17.1 5.7
42 2 2 -3 21.303 42.605 2.12026 171.2 16.9 16.7 5.7
43 0 2 3 21.673 43.346 2.08573 158.3 15.6 15.4 5.7
44 2 0 3 22.066 44.133 2.05036 61.5 6.1 6.0 5.7
45 3 2 -1 22.194 44.388 2.03918 19.2 1.9 1.9 5.7
46 4 0 0 22.581 45.162 2.00601 53.5 5.3 5.2 5.7
47 1 0 -5 22.774 45.548 1.98988 12.3 1.2 1.2 5.7
48 2 1 3 23.538 47.075 1.92883 46.9 4.6 4.6 5.7
49 2 2 2 24.025 48.05 1.89196 104.6 10.3 10.1 5.7
50 1 2 3 24.062 48.124 1.88922 10.2 1.0 1.0 5.7
51 2 2 -4 24.138 48.277 1.88359 214.9 21.2 20.8 5.7
52 1 1 -5 24.212 48.424 1.87822 31.4 3.1 3.0 5.7
53 3 1 2 24.392 48.785 1.86517 31.7 3.1 3.1 5.7
54 1 3 0 24.678 49.357 1.84488 20.4 2.0 2.0 5.7
55 3 2 1 25.398 50.795 1.79595 12.3 1.2 1.2 5.8
56 0 2 4 25.504 51.008 1.78896 19.3 1.9 1.9 5.8
57 1 3 1 25.711 51.421 1.77556 14.2 1.4 1.4 5.8
58 5 0 -2 25.813 51.627 1.76897 52.1 5.1 5.0 5.8
59 0 1 5 26.087 52.174 1.7517 21.1 2.1 2.0 5.8
60 4 2 -2 26.119 52.238 1.7497 25.8 2.5 2.5 5.8
61 2 3 -1 26.221 52.442 1.74337 42.2 4.2 4.1 5.8
62 4 1 -5 26.797 53.595 1.70855 55.3 5.5 5.3 5.8
63 2 0 -6 27.018 54.035 1.69567 27.9 2.8 2.7 5.8
64 5 1 -2 27.131 54.261 1.68914 19.6 1.9 1.9 5.8
65 5 1 -3 27.174 54.348 1.68665 18.5 1.8 1.8 5.8
66 3 0 -6 27.357 54.713 1.67624 35.7 3.5 3.4 5.8
67 1 3 -3 27.743 55.486 1.6547 123.4 12.2 11.9 5.8
68 1 0 5 27.877 55.754 1.6474 14.3 1.4 1.4 5.8
69 1 0 -6 27.97 55.941 1.64233 116.9 11.5 11.2 5.8
70 4 2 0 28.029 56.059 1.63916 29.6 2.9 2.8 5.8
71 5 1 -1 28.065 56.129 1.63726 116.1 11.4 11.1 5.8
72 1 2 4 28.119 56.237 1.63438 83.0 8.2 8.0 5.8
73 4 2 -4 28.165 56.33 1.63191 185.5 18.3 17.8 5.8
74 2 1 -6 28.296 56.592 1.62497 16.1 1.6 1.5 5.8
75 3 2 2 28.357 56.714 1.62177 58.8 5.8 5.6 5.8
76 0 3 3 28.53 57.06 1.61276 52.3 5.2 5.0 5.8
77 4 0 -6 28.957 57.914 1.59098 218.8 21.6 20.9 5.8
78 1 1 5 29.13 58.26 1.58235 61.4 6.1 5.9 5.8
79 3 3 -3 29.944 59.888 1.54317 138.1 13.6 13.2 5.8
80 0 0 6 30.134 60.268 1.53435 16.5 1.6 1.6 5.8
81 4 2 -5 30.546 61.091 1.51563 26.9 2.7 2.6 5.8
82 6 0 -3 31.368 62.737 1.47978 12.9 1.3 1.2 5.9
83 5 0 -6 31.697 63.394 1.466 23.0 2.3 2.2 5.9
84 3 0 4 31.787 63.575 1.46227 56.5 5.6 5.4 5.9
85 5 2 -4 31.834 63.669 1.46034 107.0 10.5 10.1 5.9
86 6 0 -4 31.865 63.73 1.45909 44.0 4.3 4.2 5.9
87 2 2 -6 31.931 63.863 1.45637 46.6 4.6 4.4 5.9
88 3 2 3 32.026 64.053 1.45251 13.5 1.3 1.3 5.9
89 3 2 -6 32.238 64.475 1.44401 71.4 7.0 6.8 5.9
90 4 0 3 32.771 65.542 1.42306 13.5 1.3 1.3 5.9
91 0 4 0 32.805 65.61 1.42175 215.0 21.2 20.3 5.9
92 2 1 5 33.149 66.297 1.40867 48.5 4.8 4.6 5.9
93 3 1 -7 33.204 66.408 1.4066 14.0 1.4 1.3 5.9
94 2 1 -7 33.333 66.666 1.40177 11.3 1.1 1.1 5.9
95 4 2 2 33.451 66.903 1.39739 179.2 17.7 16.9 5.9
96 2 3 3 33.6 67.2 1.39192 11.4 1.1 1.1 5.9
97 4 2 -6 33.696 67.392 1.38843 10.3 1.0 1.0 5.9
98 1 3 4 34.071 68.142 1.37495 12.9 1.3 1.2 5.9
99 4 1 -7 34.219 68.439 1.36972 22.7 2.2 2.1 5.9
100 1 4 -2 34.265 68.53 1.36812 12.9 1.3 1.2 5.9
101 0 2 6 34.781 69.563 1.35031 33.5 3.3 3.1 5.9
102 5 0 2 34.889 69.777 1.34668 20.2 2.0 1.9 5.9
103 2 4 -2 35.115 70.231 1.3391 10.9 1.1 1.0 5.9
104 6 2 -3 35.931 71.861 1.31267 19.3 1.9 1.8 5.9
105 5 2 -6 36.239 72.477 1.30302 11.2 1.1 1.0 5.9
106 4 3 -5 36.272 72.545 1.30198 20.6 2.0 1.9 6.0
107 6 2 -2 36.307 72.615 1.30089 38.2 3.8 3.6 6.0
108 6 2 -4 36.396 72.792 1.29816 37.1 3.7 3.5 6.0
109 0 1 7 36.952 73.905 1.28134 31.9 3.1 3.0 6.0
110 3 4 -2 37.061 74.122 1.27813 17.5 1.7 1.6 6.0
111 4 2 3 37.249 74.499 1.27259 63.3 6.2 5.9 6.0
112 5 3 -1 37.352 74.705 1.26959 54.2 5.3 5.0 6.0
113 4 0 4 37.436 74.871 1.26718 25.3 2.5 2.3 6.0
114 6 2 -1 37.516 75.033 1.26485 15.6 1.5 1.4 6.0
115 2 0 6 37.549 75.099 1.2639 20.3 2.0 1.9 6.0
116 6 2 -5 37.691 75.383 1.25985 36.1 3.6 3.4 6.0
117 2 0 -8 37.753 75.507 1.25809 10.3 1.0 1.0 6.0
118 1 2 6 37.814 75.628 1.25637 11.4 1.1 1.1 6.0
119 3 4 0 37.848 75.696 1.25541 26.9 2.7 2.5 6.0
120 1 3 5 38.277 76.554 1.24346 26.0 2.6 2.4 6.0
121 2 4 2 38.405 76.809 1.23996 42.3 4.2 3.9 6.0
122 4 3 2 38.973 77.946 1.2247 33.6 3.3 3.1 6.0
123 6 1 -7 39.481 78.962 1.21147 32.1 3.2 3.0 6.0
124 3 4 -4 39.579 79.158 1.20897 15.6 1.5 1.4 6.0
125 6 2 -6 39.79 79.579 1.20362 12.1 1.2 1.1 6.0
126 0 2 7 40.189 80.377 1.19366 13.5 1.3 1.2 6.0
127 4 4 -1 40.423 80.847 1.18791 22.0 2.2 2.0 6.1
128 7 1 -6 41.153 82.306 1.17051 10.2 1.0 0.9 6.1
129 2 4 3 41.246 82.492 1.16835 12.6 1.2 1.2 6.1
130 4 4 0 41.61 83.22 1.15996 10.9 1.1 1.0 6.1
131 2 3 5 41.887 83.773 1.1537 22.9 2.3 2.1 6.1
132 2 3 -7 42.057 84.113 1.1499 10.8 1.1 1.0 6.1
133 6 0 -8 42.111 84.222 1.14869 15.4 1.5 1.4 6.1
134 4 3 -7 42.879 85.758 1.13201 11.7 1.2 1.1 6.1
135 0 1 8 43.073 86.146 1.1279 14.2 1.4 1.3 6.1
136 7 1 0 43.274 86.548 1.12369 17.9 1.8 1.6 6.1
137 7 1 -7 43.62 87.24 1.11656 36.6 3.6 3.3 6.2
138 5 2 -8 43.665 87.329 1.11564 24.6 2.4 2.2 6.2
139 5 4 -2 44.034 88.067 1.10819 16.7 1.7 1.5 6.2
140 4 1 -9 44.155 88.31 1.10577 28.4 2.8 2.6 6.2
141 8 0 -3 44.296 88.593 1.10297 23.1 2.3 2.1 6.2
142 2 1 -9 44.912 89.825 1.09101 10.4 1.0 0.9 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
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