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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NANNONIITE
1, t-gibbsite
Al(2)(OH)(5)F
Monoclinic P 2(1)/n Z = 4
R =0.1524 NR =2141
13 .2 .26
Ref.Str.:
Biagioni C., Mugnaioli E., Lorenzon S., Mauro D., Musetti S.,
Sejkora, J., Belmonte D., Demitri N., Dolnicek Z. (2024)
Eur. J. Mineral., 36(6), 1011-1022, doi:10.5194/ejm-36-1011-2024
R: Locality - Cetine di Cotorniano mine, Tuscany, Italy.
IMA2024-010. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.688 alpha = 90.0
b = 5.024 beta = 90.77
c = 9.734 gamma = 90.0
Unit cell volume (cub. angs.) = 424.84
Molar volume ( cub.cm/mol.) = 63.97
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.3382 0.0008 0.9926 0.0 Al = 1.00
2 0.1711 0.5049 0.9932 0.0 Al = 1.00
3 0.1816 0.1683 0.8976 0.0 O = 1.00
4 0.1805 0.7979 0.1095 0.0 F = 1.00
5 0.3174 0.67 0.9008 0.0 O = 1.00
6 0.309 0.304 0.1076 0.0 O = 1.00
7 0.4934 0.8516 0.1027 0.0 O = 1.00
8 0.9965 0.6177 0.8933 0.0 O = 1.00
9 0.068 0.079 0.895 0.0 H = 1.00
10 0.307 0.651 0.786 0.0 H = 1.00
11 0.311 0.298 0.209 0.0 H = 1.00
12 0.503 0.872 0.21 0.0 H = 1.00
13 0.971 0.841 0.8928 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.3382 0.0008 0.9926
2 2 0.1711 0.5049 0.9932
3 3 0.1816 0.1683 0.8976
4 4 0.1805 0.7979 0.1095
5 5 0.3174 0.67 0.9008
6 6 0.309 0.304 0.1076
7 7 0.4934 0.8516 0.1027
8 8 0.9965 0.6177 0.8933
9 9 0.068 0.079 0.895
10 10 0.307 0.651 0.786
11 11 0.311 0.298 0.209
12 12 0.503 0.872 0.21
13 13 0.971 0.841 0.8928
14 1 0.6618 0.9992 0.0074
15 2 0.8289 0.4951 0.0068
16 3 0.8184 0.8317 0.1024
17 4 0.8195 0.2021 0.8905
18 5 0.6826 0.33 0.0992
19 6 0.691 0.696 0.8924
20 7 0.5066 0.1484 0.8973
21 8 0.0035 0.3823 0.1067
22 9 0.932 0.921 0.105
23 10 0.693 0.349 0.214
24 11 0.689 0.702 0.791
25 12 0.497 0.128 0.79
26 13 0.029 0.159 0.1072
27 1 0.8382 0.4992 0.4926
28 2 0.6711 0.9951 0.4932
29 3 0.6816 0.3317 0.3976
30 4 0.6805 0.7021 0.6095
31 5 0.8174 0.83 0.4008
32 6 0.809 0.196 0.6076
33 7 0.9934 0.6484 0.6027
34 8 0.4965 0.8823 0.3933
35 9 0.568 0.421 0.395
36 10 0.807 0.849 0.286
37 11 0.811 0.202 0.709
38 12 0.003 0.628 0.71
39 13 0.471 0.659 0.3928
40 1 0.1618 0.5008 0.5074
41 2 0.3289 0.0049 0.5068
42 3 0.3184 0.6683 0.6024
43 4 0.3195 0.2979 0.3905
44 5 0.1826 0.17 0.5992
45 6 0.191 0.804 0.3924
46 7 0.0066 0.3516 0.3973
47 8 0.5035 0.1177 0.6067
48 9 0.432 0.579 0.605
49 10 0.193 0.151 0.714
50 11 0.189 0.798 0.291
51 12 0.997 0.372 0.29
52 13 0.529 0.341 0.6072
X-ray density (g/cm cub.) = 2.47
MU (1/cm) = 60.271 Mass attenuation coefficient (cm**2/g) = 24.407
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Al 2.316 6
1.8386 3
2.0623 4
1.8944 5
1.9093 6
1.8681 7
1.8941 7
2 Al 2.316 6
1.933 3
1.8581 4
1.7729 5
1.9127 6
1.8783 8
1.94 8
3 O 3.264 10
2.7781 4
2.783 5
2.7675 5
2.4099 6
2.7719 8
3.1997 8
3.1503 4
2.8254 7
2.7888 8
2.9048 5
4 F 3.228 9
2.7781 3
2.4534 5
2.7771 6
2.7211 6
2.7335 7
2.7773 8
3.1503 3
2.5931 8
2.7542 6
5 O 3.264 10
2.7675 3
2.783 3
2.4534 4
2.7281 6
2.6367 7
2.8003 8
3.2506 6
2.9123 7
3.0938 7
2.9048 3
6 O 3.264 10
2.4099 3
2.7211 4
2.7771 4
2.7281 5
3.1843 7
2.7815 7
3.2506 5
2.8006 7
2.6831 8
2.7542 4
7 O 3.264 10
2.7335 4
2.6367 5
2.7815 6
3.1843 6
2.8254 3
2.9123 5
3.0938 5
2.8006 6
2.498 7
2.8327 8
8 O 3.264 9
3.1997 3
2.7719 3
2.7773 4
2.8003 5
2.7888 3
2.5931 4
2.6831 6
2.3904 8
2.8327 7
9 H 1.632 1
1.0841 3
10 H 1.632 1
1.124 5
11 H 1.632 1
0.9874 6
12 H 1.632 1
1.0517 7
13 H 1.632 1
1.1435 8
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 1 0 -1 6.78 13.56 0.077 140.55 2 5.4 4.6
2 1 0 1 6.871 13.743 0.078 136.76 2 2.0 0.6
3 0 0 2 9.107 18.214 0.103 76.9 2 128.0 1397.2
4 0 1 1 9.936 19.871 0.112 64.26 4 0.8 0.1
5 1 1 0 10.202 20.403 0.115 60.84 4 60.1 487.1
6 2 0 0 10.215 20.429 0.115 60.68 2 62.9 266.4
7 1 1 -1 11.157 22.315 0.126 50.52 4 3.2 1.2
8 1 1 1 11.214 22.428 0.126 49.99 4 3.2 1.2
9 0 1 2 12.73 25.461 0.143 38.32 4 5.3 2.3
10 2 1 0 13.558 27.116 0.152 33.55 4 1.9 0.3
11 2 0 -2 13.657 27.314 0.153 33.03 2 39.6 57.3
12 1 1 -2 13.694 27.388 0.154 32.84 4 43.5 137.9
13 1 1 2 13.788 27.575 0.155 32.37 4 42.3 128.4
14 2 0 2 13.844 27.688 0.155 32.09 2 46.7 77.6
15 2 1 -1 14.28 28.56 0.16 30.04 4 2.7 0.5
16 2 1 1 14.37 28.74 0.161 29.64 4 7.6 3.8
17 1 0 -3 14.615 29.23 0.164 28.59 2 12.0 4.6
18 1 0 3 14.747 29.494 0.165 28.05 2 1.5 0.1
19 3 0 -1 16.052 32.104 0.179 23.38 2 2.9 0.2
20 3 0 1 16.173 32.347 0.181 23.0 2 0.9 0.0
21 2 1 -2 16.351 32.702 0.183 22.46 4 5.4 1.5
22 0 1 3 16.417 32.834 0.183 22.27 4 0.0 0.0
23 2 1 2 16.51 33.021 0.184 21.99 4 1.0 0.0
24 1 1 -3 17.172 34.345 0.192 20.19 4 0.4 0.0
25 1 1 3 17.287 34.574 0.193 19.9 4 0.6 0.0
26 0 2 0 17.857 35.714 0.199 18.54 2 4.1 0.3
27 3 1 0 17.88 35.76 0.199 18.49 4 7.1 2.1
28 3 1 -1 18.431 36.863 0.205 17.29 4 76.5 224.4
29 0 0 4 18.455 36.91 0.205 17.25 2 47.5 43.2
30 0 2 1 18.463 36.925 0.206 17.23 4 72.9 202.7
31 3 1 1 18.539 37.078 0.206 17.07 4 74.0 207.0
32 1 2 0 18.615 37.229 0.207 16.92 4 10.6 4.2
33 1 2 -1 19.183 38.365 0.213 15.84 4 11.3 4.4
34 1 2 1 19.217 38.435 0.214 15.77 4 17.2 10.4
35 2 1 -3 19.387 38.775 0.215 15.47 4 4.3 0.6
36 2 1 3 19.593 39.187 0.218 15.11 4 2.7 0.2
37 3 1 -2 20.108 40.215 0.223 14.26 4 58.7 109.1
38 0 2 2 20.187 40.373 0.224 14.14 4 58.5 107.4
39 3 1 2 20.308 40.615 0.225 13.95 4 59.1 108.2
40 0 1 4 20.593 41.187 0.228 13.52 4 3.5 0.4
41 3 0 -3 20.742 41.484 0.23 13.31 2 1.0 0.0
42 2 2 0 20.746 41.492 0.23 13.3 4 1.4 0.1
43 4 0 0 20.773 41.547 0.23 13.26 2 0.4 0.0
44 1 2 -2 20.84 41.68 0.231 13.17 4 6.9 1.4
45 1 2 2 20.905 41.81 0.232 13.08 4 4.9 0.7
46 3 0 3 21.034 42.068 0.233 12.9 2 1.0 0.0
47 2 0 -4 21.147 42.294 0.234 12.75 2 20.9 6.2
48 1 1 -4 21.204 42.409 0.235 12.67 4 26.1 19.1
49 2 2 -1 21.25 42.5 0.235 12.61 4 0.5 0.0
50 2 2 1 21.314 42.628 0.236 12.52 4 3.4 0.3
51 1 1 4 21.332 42.665 0.236 12.5 4 25.3 17.7
52 2 0 4 21.403 42.805 0.237 12.41 2 25.4 8.9
53 3 1 -3 22.701 45.402 0.251 10.87 4 87.9 186.1
54 4 1 0 22.73 45.461 0.251 10.83 4 13.7 4.5
55 4 0 -2 22.733 45.466 0.251 10.83 2 34.0 13.9
56 2 2 -2 22.768 45.537 0.251 10.79 4 32.3 24.9
57 0 2 3 22.818 45.637 0.252 10.74 4 85.4 173.5
58 2 2 2 22.889 45.779 0.252 10.67 4 23.3 12.8
59 3 1 3 22.973 45.946 0.253 10.58 4 88.7 184.4
60 4 0 2 22.975 45.95 0.253 10.58 2 23.0 6.2
61 2 1 -4 23.078 46.157 0.254 10.47 4 2.9 0.2
62 4 1 -1 23.17 46.34 0.255 10.38 4 11.8 3.2
63 4 1 1 23.289 46.578 0.257 10.26 4 8.0 1.5
64 2 1 4 23.317 46.634 0.257 10.23 4 2.2 0.1
65 1 2 -3 23.397 46.795 0.258 10.15 4 21.7 10.6
66 1 2 3 23.486 46.972 0.259 10.06 4 15.1 5.1
67 1 0 -5 23.85 47.701 0.262 9.72 2 32.5 11.4
68 3 2 0 23.95 47.9 0.264 9.62 4 2.3 0.1
69 1 0 5 23.996 47.992 0.264 9.58 2 13.0 1.8
70 3 2 -1 24.387 48.774 0.268 9.24 4 11.4 2.7
71 3 2 1 24.473 48.946 0.269 9.16 4 5.5 0.6
72 4 1 -2 24.566 49.132 0.27 9.08 4 3.6 0.3
73 4 1 2 24.794 49.588 0.272 8.9 4 4.8 0.4
74 0 1 5 25.11 50.221 0.275 8.64 4 0.8 0.0
75 2 2 -3 25.157 50.314 0.276 8.61 4 0.4 0.0
76 2 2 3 25.325 50.651 0.278 8.48 4 3.0 0.2
77 1 1 -5 25.623 51.245 0.281 8.25 4 1.8 0.1
78 3 2 -2 25.747 51.495 0.282 8.16 4 3.3 0.2
79 1 1 5 25.761 51.522 0.282 8.15 4 3.0 0.2
80 3 2 2 25.913 51.826 0.284 8.05 4 0.9 0.0
81 3 1 -4 26.003 52.006 0.285 7.98 4 105.9 198.5
82 0 2 4 26.15 52.3 0.286 7.88 4 110.1 211.7
83 3 1 4 26.331 52.662 0.288 7.76 4 106.6 195.2
84 1 2 -4 26.661 53.323 0.291 7.54 4 0.8 0.0
85 5 0 -1 26.699 53.398 0.292 7.52 2 13.0 1.4
86 1 2 4 26.769 53.538 0.292 7.47 4 0.6 0.0
87 4 1 -3 26.808 53.616 0.293 7.45 4 10.6 1.9
88 5 0 1 26.833 53.666 0.293 7.43 2 1.9 0.0
89 4 1 3 27.129 54.258 0.296 7.25 4 1.4 0.0
90 2 1 -5 27.25 54.5 0.297 7.17 4 16.1 4.1
91 2 1 5 27.515 55.029 0.3 7.02 4 5.1 0.4
92 0 3 1 27.822 55.643 0.303 6.84 4 6.3 0.6
93 1 3 0 27.932 55.865 0.304 6.78 4 33.2 16.6
94 3 2 -3 27.935 55.869 0.304 6.78 4 1.7 0.0
95 4 2 0 27.96 55.919 0.304 6.77 4 31.9 15.3
96 5 1 0 27.976 55.952 0.305 6.76 4 29.3 12.9
97 3 2 3 28.169 56.338 0.306 6.65 4 6.9 0.7
98 4 0 -4 28.178 56.356 0.307 6.65 2 56.7 23.7
99 2 2 -4 28.26 56.52 0.307 6.61 4 57.0 47.5
100 3 0 -5 28.283 56.565 0.308 6.59 2 6.7 0.3
101 4 2 -1 28.339 56.678 0.308 6.56 4 18.6 5.0
102 5 1 -1 28.342 56.685 0.308 6.56 4 24.9 9.0
103 0 0 6 28.349 56.698 0.308 6.56 2 9.0 0.6
104 1 3 -1 28.351 56.702 0.308 6.56 4 16.4 3.9
105 1 3 1 28.377 56.753 0.309 6.54 4 18.3 4.8
106 4 2 1 28.442 56.885 0.309 6.51 4 15.2 3.3
107 2 2 4 28.467 56.934 0.309 6.5 4 53.8 41.6
108 5 1 1 28.472 56.943 0.309 6.49 4 13.9 2.8
109 4 0 4 28.591 57.183 0.311 6.43 2 50.8 18.4
110 3 0 5 28.67 57.339 0.311 6.39 2 1.4 0.0
111 0 3 2 29.106 58.213 0.316 6.18 4 9.1 1.1
112 2 3 0 29.535 59.071 0.32 5.98 4 13.4 2.4
113 5 1 -2 29.55 59.099 0.32 5.97 4 30.8 12.6
114 4 2 -2 29.559 59.118 0.32 5.97 4 27.8 10.2
115 1 3 -2 29.608 59.216 0.321 5.95 4 33.7 14.9
116 1 3 2 29.658 59.317 0.321 5.92 4 29.5 11.4
117 4 2 2 29.76 59.52 0.322 5.88 4 34.7 15.7
118 4 1 -4 29.767 59.535 0.322 5.88 4 11.4 1.7
119 5 1 2 29.801 59.602 0.323 5.86 4 29.3 11.2
120 3 1 -5 29.869 59.737 0.323 5.83 4 13.0 2.2
121 2 3 -1 29.927 59.854 0.324 5.81 4 1.2 0.0
122 0 1 6 29.933 59.865 0.324 5.8 4 6.3 0.5
123 2 3 1 29.977 59.954 0.324 5.78 4 6.8 0.6
124 5 0 -3 30.006 60.012 0.325 5.77 2 21.0 2.8
125 0 2 5 30.04 60.08 0.325 5.76 4 9.0 1.0
126 4 1 4 30.167 60.334 0.326 5.7 4 9.7 1.2
127 3 1 5 30.242 60.485 0.327 5.67 4 10.1 1.3
128 2 0 -6 30.307 60.615 0.328 5.64 2 23.6 3.5
129 1 1 -6 30.376 60.753 0.328 5.61 4 24.1 7.2
130 5 0 3 30.379 60.758 0.328 5.61 2 6.3 0.2
131 1 2 -5 30.495 60.991 0.329 5.57 4 10.3 1.3
132 1 1 6 30.525 61.05 0.33 5.55 4 24.6 7.5
133 2 0 6 30.604 61.208 0.33 5.52 2 21.3 2.8
134 1 2 5 30.619 61.238 0.331 5.52 4 0.8 0.0
135 3 2 -4 30.836 61.671 0.333 5.43 4 0.8 0.0
136 3 2 4 31.129 62.259 0.336 5.32 4 1.9 0.0
137 2 3 -2 31.133 62.265 0.336 5.32 4 4.9 0.3
138 0 3 3 31.173 62.346 0.336 5.3 4 3.1 0.1
139 2 3 2 31.23 62.46 0.337 5.28 4 4.1 0.2
140 5 1 -3 31.538 63.076 0.34 5.17 4 21.7 5.4
141 4 2 -3 31.559 63.118 0.34 5.16 4 17.6 3.6
142 1 3 -3 31.643 63.286 0.341 5.13 4 24.7 6.9
143 1 3 3 31.715 63.431 0.341 5.1 4 17.7 3.5
144 2 1 -6 31.831 63.662 0.342 5.06 4 0.2 0.0
145 4 2 3 31.849 63.698 0.343 5.06 4 22.6 5.7
146 5 1 3 31.901 63.801 0.343 5.04 4 25.4 7.2
147 2 2 -5 31.959 63.918 0.344 5.02 4 0.4 0.0
148 3 3 0 32.096 64.192 0.345 4.97 4 136.1 204.1
149 2 1 6 32.12 64.239 0.345 4.97 4 8.8 0.9
150 6 0 0 32.141 64.283 0.345 4.96 2 138.0 104.7
151 2 2 5 32.199 64.398 0.346 4.94 4 1.4 0.0
152 3 3 -1 32.458 64.915 0.348 4.85 4 3.3 0.1
153 3 3 1 32.529 65.058 0.349 4.83 4 0.1 0.0
154 5 2 0 32.619 65.239 0.35 4.8 4 9.2 0.9
155 5 2 -1 32.954 65.908 0.353 4.7 4 15.1 2.4
156 5 2 1 33.072 66.145 0.354 4.66 4 6.8 0.5
157 2 3 -3 33.101 66.203 0.354 4.65 4 16.2 2.7
158 2 3 3 33.243 66.486 0.356 4.61 4 6.3 0.4
159 4 1 -5 33.342 66.685 0.357 4.58 4 10.7 1.2
160 6 0 -2 33.574 67.148 0.359 4.52 2 70.8 25.1
161 3 3 -2 33.6 67.2 0.359 4.51 4 71.5 51.1
162 6 1 0 33.619 67.237 0.359 4.5 4 0.6 0.0
163 3 3 2 33.741 67.481 0.361 4.47 4 78.1 60.5
164 4 1 5 33.812 67.623 0.361 4.45 4 6.3 0.4
165 6 0 2 33.855 67.71 0.362 4.44 2 78.4 30.2
166 6 1 -1 33.937 67.873 0.362 4.42 4 3.2 0.1
167 0 3 4 33.943 67.886 0.362 4.41 4 3.9 0.1
168 1 0 -7 34.046 68.091 0.363 4.39 2 16.5 1.3
169 5 2 -2 34.065 68.13 0.364 4.38 4 5.8 0.3
170 6 1 1 34.077 68.153 0.364 4.38 4 2.1 0.0
171 1 0 7 34.209 68.417 0.365 4.34 2 24.3 2.8
172 3 1 -6 34.225 68.45 0.365 4.34 4 81.7 64.2
173 5 1 -4 34.234 68.469 0.365 4.34 4 28.6 7.9
174 4 2 -4 34.266 68.533 0.365 4.33 4 27.5 7.3
175 5 2 2 34.297 68.595 0.366 4.32 4 3.4 0.1
176 3 2 -5 34.36 68.72 0.366 4.3 4 11.3 1.2
177 1 3 -4 34.381 68.762 0.367 4.3 4 29.4 8.2
178 0 2 6 34.419 68.839 0.367 4.29 4 84.0 67.0
179 1 3 4 34.474 68.948 0.367 4.27 4 26.7 6.8
180 4 2 4 34.637 69.274 0.369 4.23 4 31.5 9.3
181 3 1 6 34.642 69.284 0.369 4.23 4 85.0 67.8
182 5 1 4 34.698 69.395 0.37 4.22 4 30.0 8.4
183 3 2 5 34.707 69.414 0.37 4.22 4 7.3 0.5
184 1 2 -6 34.832 69.663 0.371 4.19 4 9.1 0.8
185 1 2 6 34.97 69.94 0.372 4.15 4 0.7 0.0
186 6 1 -2 35.021 70.042 0.373 4.14 4 8.1 0.6
187 0 1 7 35.086 70.172 0.373 4.12 4 0.2 0.0
188 6 1 2 35.296 70.592 0.375 4.08 4 5.5 0.3
189 1 1 -7 35.483 70.967 0.377 4.03 4 1.3 0.0
190 3 3 -3 35.486 70.973 0.377 4.03 4 2.0 0.0
191 4 3 0 35.508 71.017 0.377 4.03 4 11.1 1.1
192 1 1 7 35.643 71.287 0.378 4.0 4 0.4 0.0
193 3 3 3 35.692 71.384 0.379 3.99 4 3.0 0.1
194 2 3 -4 35.772 71.544 0.379 3.97 4 16.2 2.3
195 4 3 -1 35.842 71.683 0.38 3.95 4 8.7 0.7
196 5 2 -3 35.917 71.835 0.381 3.94 4 13.8 1.7
197 4 3 1 35.933 71.865 0.381 3.93 4 5.8 0.3
198 2 3 4 35.954 71.908 0.381 3.93 4 12.1 1.3
199 4 0 -6 36.075 72.15 0.382 3.9 2 39.1 6.6
200 5 0 -5 36.176 72.352 0.383 3.88 2 18.1 1.4
201 2 2 -6 36.192 72.385 0.383 3.88 4 37.6 12.1
202 5 2 3 36.258 72.516 0.384 3.87 4 1.6 0.0
203 2 2 6 36.464 72.928 0.386 3.82 4 45.6 17.6
204 4 0 6 36.618 73.237 0.387 3.79 2 44.7 8.4
205 5 0 5 36.741 73.482 0.388 3.77 2 8.9 0.3
206 2 1 -7 36.823 73.645 0.389 3.75 4 18.7 2.9
207 6 1 -3 36.841 73.682 0.389 3.75 4 4.1 0.1
208 4 3 -2 36.924 73.847 0.39 3.73 4 2.3 0.0
209 4 3 2 37.103 74.207 0.392 3.7 4 4.4 0.2
210 2 1 7 37.138 74.275 0.392 3.69 4 19.2 3.0
211 6 1 3 37.245 74.491 0.393 3.67 4 4.2 0.1
212 0 3 5 37.355 74.709 0.394 3.65 4 7.1 0.4
213 4 1 -6 37.48 74.959 0.395 3.63 4 4.6 0.2
214 5 1 -5 37.579 75.158 0.396 3.62 4 7.8 0.5
215 4 2 -5 37.621 75.242 0.396 3.61 4 6.7 0.4
216 3 0 -7 37.684 75.368 0.397 3.6 2 1.2 0.0
217 1 3 -5 37.765 75.53 0.398 3.58 4 2.0 0.0
218 0 4 0 37.827 75.654 0.398 3.57 2 28.8 3.3
219 1 3 5 37.876 75.753 0.399 3.56 4 9.2 0.7
220 6 2 0 37.883 75.766 0.399 3.56 4 24.1 4.6
221 6 0 -4 37.981 75.962 0.399 3.55 2 4.7 0.1
222 4 1 6 38.015 76.031 0.4 3.54 4 3.4 0.1
223 4 2 5 38.067 76.134 0.4 3.53 4 0.8 0.0
224 3 3 -4 38.073 76.145 0.4 3.53 4 0.7 0.0
225 5 1 5 38.137 76.273 0.401 3.52 4 0.1 0.0
226 3 0 7 38.152 76.304 0.401 3.52 2 2.0 0.0
227 6 2 -1 38.186 76.372 0.401 3.51 4 36.3 10.3
228 0 4 1 38.197 76.394 0.401 3.51 4 32.3 8.1
229 1 4 0 38.291 76.582 0.402 3.5 4 8.3 0.5
230 6 2 1 38.319 76.639 0.402 3.49 4 29.8 6.9
231 3 3 4 38.339 76.679 0.403 3.49 4 3.7 0.1
232 3 2 -6 38.461 76.922 0.404 3.47 4 3.5 0.1
233 5 2 -4 38.47 76.94 0.404 3.47 4 2.8 0.1
234 6 0 4 38.514 77.029 0.404 3.46 2 2.0 0.0
235 1 4 -1 38.648 77.297 0.405 3.44 4 6.4 0.3
236 7 0 -1 38.656 77.313 0.405 3.44 2 2.2 0.0
237 1 4 1 38.671 77.341 0.406 3.44 4 10.9 0.9
238 4 3 -3 38.731 77.463 0.406 3.43 4 13.1 1.3
239 7 0 1 38.811 77.622 0.407 3.42 2 9.0 0.3
240 3 2 6 38.86 77.72 0.407 3.41 4 1.1 0.0
241 5 2 4 38.913 77.826 0.408 3.4 4 3.7 0.1
242 4 3 3 38.997 77.993 0.408 3.39 4 1.7 0.0
243 3 1 -7 39.068 78.135 0.409 3.38 4 60.8 27.7
244 2 3 -5 39.097 78.194 0.409 3.38 4 20.6 3.2
245 6 2 -2 39.223 78.446 0.41 3.36 4 47.8 17.0
246 0 0 8 39.281 78.561 0.411 3.35 2 90.2 30.2
247 0 2 7 39.285 78.571 0.411 3.35 4 57.3 24.3
248 0 4 2 39.3 78.599 0.411 3.35 4 48.2 17.2
249 2 3 5 39.318 78.636 0.411 3.34 4 8.0 0.5
250 6 1 -4 39.362 78.723 0.412 3.34 4 4.1 0.1
251 6 2 2 39.487 78.975 0.413 3.32 4 46.3 15.8
252 3 1 7 39.531 79.061 0.413 3.32 4 60.0 26.5
253 1 2 -7 39.667 79.335 0.414 3.3 4 8.7 0.6
254 2 4 0 39.673 79.346 0.414 3.3 4 47.7 16.6
255 5 3 0 39.705 79.411 0.415 3.29 4 48.7 17.3
256 1 4 -2 39.736 79.473 0.415 3.29 4 10.4 0.8
257 7 1 0 39.742 79.484 0.415 3.29 4 47.9 16.7
258 1 4 2 39.78 79.561 0.415 3.28 4 5.7 0.2
259 1 2 7 39.821 79.642 0.416 3.28 4 2.6 0.0
260 6 1 4 39.89 79.779 0.416 3.27 4 0.9 0.0
261 5 3 -1 40.015 80.03 0.417 3.25 4 18.5 2.5
262 2 4 -1 40.016 80.032 0.417 3.25 4 21.7 3.4
263 7 1 -1 40.03 80.06 0.418 3.25 4 22.7 3.7
264 2 4 1 40.06 80.119 0.418 3.25 4 13.3 1.3
265 5 3 1 40.125 80.249 0.418 3.24 4 17.4 2.2
266 7 1 1 40.183 80.367 0.419 3.23 4 12.8 1.2
267 0 1 8 40.649 81.298 0.423 3.18 4 2.3 0.0
268 2 0 -8 40.934 81.868 0.425 3.15 2 29.9 3.1
269 2 2 -7 40.96 81.921 0.426 3.14 4 2.1 0.0
270 6 2 -3 40.978 81.956 0.426 3.14 4 43.2 13.0
271 1 1 -8 41.017 82.033 0.426 3.14 4 29.6 6.1
272 7 1 -2 41.043 82.086 0.426 3.13 4 28.8 5.7
273 5 3 -2 41.05 82.1 0.426 3.13 4 28.8 5.7
274 2 4 -2 41.084 82.167 0.427 3.13 4 27.3 5.2
275 0 4 3 41.12 82.239 0.427 3.13 4 42.8 12.7
276 2 4 2 41.171 82.342 0.427 3.12 4 33.4 7.7
277 1 1 8 41.191 82.382 0.427 3.12 4 28.1 5.4
278 4 3 -4 41.239 82.478 0.428 3.11 4 11.4 0.9
279 2 2 7 41.266 82.532 0.428 3.11 4 0.9 0.0
280 5 3 2 41.268 82.537 0.428 3.11 4 32.5 7.3
281 2 0 8 41.283 82.566 0.428 3.11 2 29.1 2.9
282 3 3 -5 41.327 82.654 0.429 3.1 4 1.6 0.0
283 7 1 2 41.348 82.697 0.429 3.1 4 32.5 7.3
284 6 2 3 41.371 82.741 0.429 3.1 4 44.8 13.8
285 0 3 6 41.383 82.766 0.429 3.1 4 6.6 0.3
286 7 0 -3 41.418 82.836 0.429 3.09 2 13.0 0.6
287 1 4 -3 41.541 83.082 0.43 3.08 4 6.8 0.3
288 5 1 -6 41.547 83.093 0.431 3.08 4 24.2 4.0
289 4 3 4 41.588 83.175 0.431 3.08 4 14.3 1.4
290 4 2 -6 41.598 83.197 0.431 3.08 4 27.9 5.3
291 1 4 3 41.606 83.213 0.431 3.08 4 8.2 0.5
292 3 3 5 41.654 83.308 0.431 3.07 4 0.5 0.0
293 5 2 -5 41.695 83.39 0.432 3.07 4 11.9 1.0
294 1 3 -6 41.771 83.543 0.432 3.06 4 25.2 4.3
295 7 0 3 41.875 83.75 0.433 3.05 2 11.0 0.4
296 1 3 6 41.902 83.803 0.434 3.05 4 25.5 4.4
297 3 4 0 41.95 83.9 0.434 3.04 4 1.8 0.0
298 4 2 6 42.12 84.24 0.435 3.03 4 23.3 3.6
299 4 1 -7 42.183 84.366 0.436 3.02 4 20.9 2.9
300 5 1 6 42.199 84.398 0.436 3.02 4 28.2 5.3
301 5 2 5 42.238 84.477 0.436 3.02 4 3.9 0.1
302 3 4 -1 42.278 84.557 0.437 3.01 4 7.6 0.4
303 2 1 -8 42.29 84.581 0.437 3.01 4 9.8 0.6
304 3 4 1 42.343 84.687 0.437 3.01 4 1.5 0.0
305 6 1 -5 42.56 85.12 0.439 2.99 4 0.7 0.0
306 2 1 8 42.638 85.275 0.44 2.98 4 3.3 0.1
307 7 1 -3 42.772 85.544 0.441 2.97 4 21.7 3.1
308 4 1 7 42.791 85.581 0.441 2.97 4 7.8 0.4
309 5 3 -3 42.801 85.602 0.441 2.97 4 20.6 2.8
310 2 4 -3 42.866 85.733 0.442 2.96 4 24.0 3.8
311 2 4 3 42.996 85.993 0.443 2.95 4 21.2 2.9
312 2 3 -6 43.063 86.126 0.443 2.95 4 4.9 0.2
313 5 3 3 43.126 86.252 0.444 2.94 4 25.8 4.3
314 3 2 -7 43.149 86.298 0.444 2.94 4 1.3 0.0
315 6 1 5 43.21 86.42 0.444 2.94 4 1.4 0.0
316 7 1 3 43.227 86.454 0.445 2.94 4 23.7 3.7
317 2 3 6 43.323 86.646 0.445 2.93 4 11.9 0.9
318 3 4 -2 43.326 86.651 0.445 2.93 4 10.4 0.7
319 6 2 -4 43.438 86.875 0.446 2.92 4 72.3 33.8
320 3 4 2 43.455 86.911 0.446 2.92 4 10.1 0.7
321 3 2 7 43.604 87.208 0.448 2.91 4 4.3 0.1
322 0 4 4 43.643 87.286 0.448 2.91 4 69.2 30.9
323 7 2 0 43.812 87.624 0.449 2.9 4 2.6 0.0
324 6 2 4 43.957 87.914 0.451 2.89 4 73.9 35.0
325 1 4 -4 44.05 88.101 0.451 2.88 4 2.2 0.0
326 7 2 -1 44.095 88.19 0.452 2.88 4 16.7 1.8
327 1 4 4 44.137 88.274 0.452 2.88 4 6.2 0.2
328 7 2 1 44.247 88.493 0.453 2.87 4 1.5 0.0
329 4 3 -5 44.436 88.873 0.454 2.86 4 18.7 2.2
330 3 1 -8 44.46 88.921 0.455 2.86 4 30.8 6.0
331 6 3 0 44.69 89.381 0.457 2.84 4 10.3 0.7
332 0 2 8 44.706 89.412 0.457 2.84 4 30.4 5.8
333 5 0 -7 44.819 89.638 0.458 2.84 2 21.6 1.5
334 4 3 5 44.869 89.737 0.458 2.84 4 10.4 0.7
335 3 1 8 44.979 89.958 0.459 2.83 4 34.3 7.4
336 6 3 -1 44.984 89.969 0.459 2.83 4 4.8 0.1
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 2 9.107 18.214 4.86656 1397.2 100.0 100.0 5.6
2 1 1 0 10.202 20.403 4.34908 753.5 53.9 53.8 5.6
3 2 0 -2 13.657 27.314 3.26242 57.3 4.1 4.1 5.6
4 1 1 -2 13.694 27.388 3.25373 137.9 9.9 9.8 5.6
5 1 1 2 13.788 27.575 3.23205 128.4 9.2 9.1 5.6
6 2 0 2 13.844 27.688 3.21915 77.6 5.6 5.5 5.6
7 3 1 -1 18.431 36.863 2.43629 267.5 19.1 18.9 5.7
8 0 2 1 18.463 36.925 2.4323 202.7 14.5 14.3 5.7
9 3 1 1 18.539 37.078 2.42262 207.0 14.8 14.6 5.7
10 3 1 -2 20.108 40.215 2.2406 109.1 7.8 7.7 5.7
11 0 2 2 20.187 40.373 2.23217 107.4 7.7 7.5 5.7
12 3 1 2 20.308 40.615 2.21945 108.2 7.7 7.6 5.7
13 1 1 -4 21.204 42.409 2.12962 19.1 1.4 1.3 5.7
14 1 1 4 21.332 42.665 2.11745 17.7 1.3 1.2 5.7
15 3 1 -3 22.701 45.402 1.99594 186.1 13.3 13.0 5.7
16 4 0 -2 22.733 45.466 1.99327 18.4 1.3 1.3 5.7
17 2 2 -2 22.768 45.537 1.99035 24.9 1.8 1.7 5.7
18 0 2 3 22.818 45.637 1.98623 173.5 12.4 12.1 5.7
19 3 1 3 22.973 45.946 1.97358 190.6 13.6 13.3 5.7
20 3 1 -4 26.003 52.006 1.75694 198.5 14.2 13.8 5.8
21 0 2 4 26.15 52.3 1.74776 211.7 15.2 14.7 5.8
22 3 1 4 26.331 52.662 1.73661 195.2 14.0 13.5 5.8
23 1 3 0 27.932 55.865 1.64439 31.9 2.3 2.2 5.8
24 4 0 -4 28.178 56.356 1.63121 23.7 1.7 1.6 5.8
25 2 2 -4 28.26 56.52 1.62687 47.8 3.4 3.3 5.8
26 5 1 -1 28.342 56.685 1.62253 18.5 1.3 1.3 5.8
27 2 2 4 28.467 56.934 1.61603 47.8 3.4 3.3 5.8
28 4 0 4 28.591 57.183 1.60957 18.4 1.3 1.3 5.8
29 4 2 -2 29.559 59.118 1.56142 25.1 1.8 1.7 5.8
30 1 3 -2 29.608 59.216 1.55906 14.9 1.1 1.0 5.8
31 4 2 2 29.76 59.52 1.55183 17.4 1.2 1.2 5.8
32 3 3 0 32.096 64.192 1.44969 204.9 14.7 14.0 5.9
33 6 0 0 32.141 64.283 1.44787 104.7 7.5 7.1 5.9
34 3 3 -2 33.6 67.2 1.39192 76.1 5.4 5.2 5.9
35 3 3 2 33.741 67.481 1.38681 60.5 4.3 4.1 5.9
36 6 0 2 33.855 67.71 1.38268 30.2 2.2 2.0 5.9
37 5 1 -4 34.234 68.469 1.36919 74.9 5.4 5.1 5.9
38 0 2 6 34.419 68.839 1.36274 67.0 4.8 4.5 5.9
39 3 1 6 34.642 69.284 1.35506 77.1 5.5 5.2 5.9
40 2 2 6 36.464 72.928 1.29608 17.6 1.3 1.2 6.0
41 6 2 -1 38.186 76.372 1.24597 18.4 1.3 1.2 6.0
42 3 1 -7 39.068 78.135 1.22221 30.9 2.2 2.1 6.0
43 6 2 -2 39.223 78.446 1.21815 17.0 1.2 1.1 6.0
44 0 0 8 39.281 78.561 1.21664 71.8 5.1 4.8 6.0
45 6 2 2 39.487 78.975 1.21131 15.8 1.1 1.0 6.0
46 3 1 7 39.531 79.061 1.2102 26.5 1.9 1.8 6.0
47 2 4 0 39.673 79.346 1.20657 16.6 1.2 1.1 6.0
48 5 3 0 39.705 79.411 1.20575 17.3 1.2 1.1 6.0
49 7 1 0 39.742 79.484 1.20482 16.7 1.2 1.1 6.0
50 6 2 3 41.371 82.741 1.16545 21.1 1.5 1.4 6.1
51 6 2 -4 43.438 86.875 1.1203 34.5 2.5 2.2 6.1
52 0 4 4 43.643 87.286 1.11609 30.9 2.2 2.0 6.2
53 6 2 4 43.957 87.914 1.10973 35.0 2.5 2.3 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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