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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PICROMERITE
2, syn, f-blodite, g-picromerite
K(2)Mg[SO(4)](2).6H(2)O
Monoclinic P 2(1)/a Z = 2
P2(1)/a
12 .2 .10
Ref.Str.:
Bosi F., Belardi G., Ballirano P. (2009)
* Amer. Mineral., 94, 74-82
R: See U(ij) in the original. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.0954 alpha = 90.0
b = 12.2484 beta = 104.88
c = 6.1335 gamma = 90.0
Unit cell volume (cub. angs.) = 660.38
Molar volume ( cub.cm/mol.) = 198.89
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.0 0.0 0.0 Mg = 1.00
2 0.1313 0.3462 0.3407 0.0 K = 1.00
3 0.4108 0.1361 0.7257 0.0 S = 1.00
4 0.4045 0.2301 0.5727 0.0 O = 1.00
5 0.5558 0.0791 0.7543 0.0 O = 1.00
6 0.2867 0.0607 0.6202 0.0 O = 1.00
7 0.3927 0.174 0.9465 0.0 O = 1.00
8 0.1688 0.1088 0.1656 0.0 H(2)O = 1.00
9 0.8331 0.1134 0.0309 0.0 H(2)O = 1.00
10 0.9942 0.9307 0.2975 0.0 H(2)O = 1.00
11 0.208 0.09 0.284 0.0 H = 1.00
12 0.232 0.124 0.104 0.0 H = 1.00
13 0.755 0.104 0.946 0.0 H = 1.00
14 0.855 0.177 0.997 0.0 H = 1.00
15 0.927 0.934 0.34 0.0 H = 1.00
16 0.027 0.869 0.334 0.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.0 0.0
2 2 0.1313 0.3462 0.3407
3 3 0.4108 0.1361 0.7257
4 4 0.4045 0.2301 0.5727
5 5 0.5558 0.0791 0.7543
6 6 0.2867 0.0607 0.6202
7 7 0.3927 0.174 0.9465
8 8 0.1688 0.1088 0.1656
9 9 0.8331 0.1134 0.0309
10 10 0.9942 0.9307 0.2975
11 11 0.208 0.09 0.284
12 12 0.232 0.124 0.104
13 13 0.755 0.104 0.946
14 14 0.855 0.177 0.997
15 15 0.927 0.934 0.34
16 16 0.027 0.869 0.334
17 2 0.8687 0.6538 0.6593
18 3 0.5892 0.8639 0.2743
19 4 0.5955 0.7699 0.4273
20 5 0.4442 0.9209 0.2457
21 6 0.7133 0.9393 0.3798
22 7 0.6073 0.826 0.0535
23 8 0.8312 0.8913 0.8344
24 9 0.1669 0.8866 0.9692
25 10 0.0058 0.0693 0.7025
26 11 0.792 0.91 0.716
27 12 0.768 0.876 0.896
28 13 0.245 0.896 0.054
29 14 0.145 0.823 0.003
30 15 0.073 0.066 0.66
31 16 0.973 0.131 0.666
32 1 0.5 0.5 0.0
33 2 0.6313 0.1538 0.3407
34 3 0.9108 0.3639 0.7257
35 4 0.9045 0.2699 0.5727
36 5 0.0558 0.4209 0.7543
37 6 0.7867 0.4393 0.6202
38 7 0.8927 0.326 0.9465
39 8 0.6688 0.3913 0.1656
40 9 0.3331 0.3866 0.0309
41 10 0.4942 0.5693 0.2975
42 11 0.708 0.41 0.284
43 12 0.732 0.376 0.104
44 13 0.255 0.396 0.946
45 14 0.355 0.323 0.997
46 15 0.427 0.566 0.34
47 16 0.527 0.631 0.334
48 2 0.3687 0.8462 0.6593
49 3 0.0892 0.6361 0.2743
50 4 0.0955 0.7301 0.4273
51 5 0.9442 0.5791 0.2457
52 6 0.2133 0.5607 0.3798
53 7 0.1073 0.674 0.0535
54 8 0.3312 0.6087 0.8344
55 9 0.6669 0.6134 0.9692
56 10 0.5058 0.4307 0.7025
57 11 0.292 0.59 0.716
58 12 0.268 0.624 0.896
59 13 0.745 0.604 0.054
60 14 0.645 0.677 0.003
61 15 0.573 0.434 0.66
62 16 0.473 0.369 0.666
X-ray density (g/cm cub.) = 2.09
MU (1/cm) = 103.33 Mass attenuation coefficient (cm**2/g) = 49.55
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Mg 2.688 6
2.0885 8
2.1012 9
2.0255 10
2.0885 8
2.1012 9
2.0255 10
2 K 3.396 8
2.8985 4
3.1485 8
2.9436 4
2.9397 5
2.8148 7
3.0027 9
3.2962 5
2.7248 6
3 S 2.148 4
1.4779 4
1.463 5
1.4734 6
1.4802 7
4 O 3.432 5
2.4026 5
2.3879 6
2.4224 7
3.2081 8
2.672 10
5 O 3.432 5
2.4026 4
2.3847 6
2.4173 7
2.6866 9
3.3429 8
6 O 3.432 7
2.3879 4
2.3847 5
2.423 7
2.7811 8
3.2896 10
3.3927 9
2.7305 10
7 O 3.432 5
2.4224 4
2.4173 5
2.423 6
2.8276 8
2.7365 9
8 H(2)O 3.6 8
3.2081 4
2.7811 6
2.8276 7
2.9513 9
2.931 10
3.3429 5
2.9738 9
2.8875 10
9 H(2)O 3.6 8
2.6866 5
2.9513 8
2.9323 10
3.3927 6
2.9738 8
2.9047 10
3.5955 4
2.7365 7
10 H(2)O 3.6 8
3.2896 6
2.931 8
2.9323 9
2.7305 6
2.8875 8
2.9047 9
2.9882 10
2.672 4
11 H 1.8 1
0.7578 8
12 H 1.8 1
0.7874 8
13 H 1.8 1
0.774 9
14 H 1.8 1
0.8434 9
15 H 1.8 1
0.7248 10
16 H 1.8 1
0.8219 10
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 1 0 6.192 12.384 0.07 168.95 4 26.6 109.9
2 0 2 0 7.226 14.451 0.082 123.47 2 12.7 9.2
3 0 0 1 7.466 14.933 0.084 115.49 2 3.6 0.7
4 0 1 1 8.3 16.601 0.094 93.03 4 32.0 87.3
5 1 1 -1 8.66 17.32 0.098 85.28 4 3.8 1.2
6 1 2 0 8.818 17.635 0.1 82.18 4 15.9 19.0
7 2 0 0 10.093 20.187 0.114 62.2 2 46.9 62.6
8 0 2 1 10.419 20.838 0.117 58.24 4 28.3 42.7
9 1 1 1 10.683 21.367 0.12 55.29 4 81.3 335.1
10 1 2 -1 10.71 21.42 0.121 55.01 4 33.1 55.3
11 2 1 0 10.731 21.462 0.121 54.78 4 30.8 47.6
12 2 0 -1 10.923 21.845 0.123 52.81 2 127.6 394.5
13 2 1 -1 11.516 23.032 0.13 47.29 4 26.1 29.5
14 1 3 0 12.006 24.013 0.135 43.34 4 114.9 524.7
15 1 2 1 12.416 24.833 0.14 40.39 4 33.9 42.7
16 2 2 0 12.458 24.915 0.14 40.11 4 11.3 4.7
17 2 2 -1 13.146 26.291 0.148 35.81 4 14.7 7.1
18 0 3 1 13.243 26.486 0.149 35.26 4 46.3 69.3
19 1 3 -1 13.476 26.953 0.151 33.98 4 44.1 60.6
20 2 0 1 14.094 28.187 0.158 30.9 2 121.8 210.2
21 2 1 1 14.566 29.132 0.163 28.8 4 79.5 166.7
22 0 4 0 14.569 29.139 0.163 28.78 2 132.1 230.3
23 1 3 1 14.887 29.774 0.167 27.49 4 57.7 84.0
24 2 3 0 14.922 29.844 0.167 27.35 4 27.0 18.3
25 1 1 -2 15.056 30.112 0.169 26.83 4 109.9 297.4
26 0 0 2 15.063 30.127 0.169 26.8 2 51.4 32.5
27 1 4 0 15.449 30.898 0.173 25.39 4 24.2 13.6
28 0 1 2 15.509 31.018 0.174 25.18 4 8.6 1.7
29 2 3 -1 15.509 31.018 0.174 25.18 4 31.4 22.8
30 3 1 -1 15.609 31.219 0.175 24.83 4 70.1 111.8
31 3 1 0 15.682 31.364 0.175 24.58 4 41.3 38.4
32 2 0 -2 15.879 31.759 0.178 23.93 2 107.1 125.8
33 2 2 1 15.907 31.813 0.178 23.84 4 65.9 94.9
34 2 1 -2 16.305 32.609 0.182 22.6 4 49.9 51.6
35 1 2 -2 16.36 32.721 0.183 22.43 4 74.9 115.3
36 0 4 1 16.447 32.895 0.184 22.18 4 13.6 3.8
37 1 4 -1 16.639 33.279 0.186 21.63 4 47.4 44.5
38 0 2 2 16.781 33.563 0.187 21.23 4 17.6 6.0
39 3 2 -1 16.875 33.751 0.188 20.97 4 44.8 38.6
40 3 2 0 16.943 33.886 0.189 20.79 4 5.6 0.6
41 2 2 -2 17.526 35.052 0.195 19.31 4 14.5 3.7
42 1 1 2 17.545 35.089 0.196 19.27 4 8.0 1.1
43 1 4 1 17.824 35.647 0.199 18.62 4 32.8 18.4
44 2 4 0 17.853 35.707 0.199 18.55 4 21.0 7.5
45 2 3 1 17.941 35.883 0.2 18.35 4 68.8 79.7
46 1 3 -2 18.351 36.701 0.204 17.46 4 51.4 42.4
47 2 4 -1 18.357 36.713 0.204 17.45 4 42.0 28.3
48 1 2 2 18.695 37.389 0.208 16.76 4 29.1 13.0
49 0 3 2 18.732 37.465 0.208 16.69 4 38.4 22.5
50 3 3 -1 18.818 37.635 0.209 16.52 4 128.4 250.0
51 3 3 0 18.879 37.759 0.21 16.4 4 6.2 0.6
52 3 1 -2 18.955 37.911 0.211 16.26 4 2.0 0.1
53 1 5 0 19.052 38.104 0.212 16.08 4 10.0 1.5
54 3 1 1 19.139 38.278 0.213 15.92 4 6.9 0.7
55 2 3 -2 19.412 38.823 0.216 15.43 4 7.2 0.7
56 0 5 1 19.891 39.782 0.221 14.61 4 58.9 46.5
57 4 0 -1 19.944 39.888 0.221 14.53 2 0.9 0.0
58 3 2 -2 20.036 40.072 0.222 14.38 4 46.2 28.1
59 1 5 -1 20.054 40.109 0.223 14.35 4 10.5 1.4
60 3 2 1 20.211 40.422 0.224 14.1 4 14.3 2.6
61 4 1 -1 20.295 40.59 0.225 13.97 4 38.4 18.9
62 2 0 2 20.413 40.825 0.226 13.79 2 30.2 5.8
63 1 3 2 20.488 40.976 0.227 13.68 4 15.2 2.9
64 2 4 1 20.494 40.988 0.227 13.67 4 102.4 131.4
65 4 0 0 20.519 41.037 0.228 13.64 2 75.6 35.7
66 2 1 2 20.757 41.514 0.23 13.29 4 40.4 19.9
67 1 4 -2 20.86 41.721 0.231 13.14 4 11.7 1.7
68 4 1 0 20.861 41.723 0.231 13.14 4 37.3 16.8
69 1 5 1 21.073 42.147 0.233 12.85 4 21.6 5.5
70 2 5 0 21.099 42.198 0.234 12.81 4 12.0 1.7
71 0 4 2 21.204 42.408 0.235 12.67 4 79.9 74.1
72 3 4 -1 21.281 42.562 0.236 12.57 4 39.2 17.7
73 4 2 -1 21.318 42.637 0.236 12.52 4 42.4 20.6
74 3 4 0 21.337 42.674 0.236 12.49 4 44.1 22.3
75 2 5 -1 21.538 43.076 0.238 12.23 4 51.8 30.1
76 3 3 -2 21.737 43.474 0.24 11.98 4 2.6 0.1
77 2 2 2 21.763 43.526 0.241 11.95 4 29.5 9.6
78 2 4 -2 21.819 43.638 0.241 11.88 4 71.2 55.3
79 4 2 0 21.863 43.727 0.242 11.83 4 84.5 77.4
80 3 3 1 21.901 43.802 0.242 11.78 4 30.7 10.2
81 0 6 0 22.168 44.337 0.245 11.46 2 11.7 0.7
82 4 0 -2 22.27 44.539 0.246 11.35 2 15.2 1.2
83 1 1 -3 22.468 44.937 0.248 11.12 4 22.6 5.2
84 4 1 -2 22.591 45.182 0.249 10.99 4 13.1 1.7
85 2 0 -3 22.593 45.186 0.249 10.98 2 45.6 10.5
86 1 6 0 22.791 45.582 0.251 10.77 4 22.3 4.9
87 1 4 2 22.802 45.604 0.252 10.76 4 26.7 7.0
88 2 1 -3 22.91 45.821 0.253 10.64 4 14.8 2.1
89 4 3 -1 22.942 45.884 0.253 10.61 4 27.6 7.4
90 0 0 3 22.944 45.888 0.253 10.61 2 119.9 69.9
91 0 1 3 23.258 46.516 0.256 10.29 4 15.3 2.2
92 2 3 2 23.362 46.724 0.257 10.18 4 23.8 5.3
93 1 2 -3 23.415 46.831 0.258 10.13 4 22.6 4.8
94 2 5 1 23.435 46.87 0.258 10.11 4 65.6 39.9
95 4 3 0 23.457 46.914 0.258 10.09 4 26.6 6.6
96 0 6 1 23.521 47.041 0.259 10.03 4 20.8 4.0
97 4 2 -2 23.534 47.068 0.259 10.02 4 27.3 6.8
98 1 6 -1 23.663 47.327 0.261 9.89 4 10.3 1.0
99 1 5 -2 23.765 47.53 0.262 9.8 4 31.1 8.7
100 4 0 1 23.822 47.644 0.262 9.74 2 28.6 3.7
101 2 2 -3 23.844 47.687 0.262 9.72 4 5.3 0.3
102 3 4 -2 23.954 47.908 0.264 9.62 4 42.6 16.0
103 0 5 2 24.075 48.151 0.265 9.51 4 70.9 43.9
104 3 4 1 24.106 48.213 0.265 9.48 4 48.6 20.6
105 4 1 1 24.127 48.255 0.265 9.46 4 8.5 0.6
106 3 5 -1 24.145 48.29 0.266 9.45 4 41.6 15.0
107 0 2 3 24.181 48.362 0.266 9.42 4 10.5 0.9
108 3 5 0 24.196 48.391 0.266 9.4 4 54.0 25.1
109 3 1 -3 24.532 49.065 0.27 9.11 4 71.9 43.2
110 1 6 1 24.562 49.124 0.27 9.09 4 35.7 10.6
111 2 6 0 24.585 49.17 0.27 9.07 4 10.9 1.0
112 2 5 -2 24.634 49.268 0.271 9.03 4 4.3 0.2
113 3 1 2 24.781 49.563 0.272 8.91 4 12.0 1.2
114 1 3 -3 24.932 49.864 0.274 8.78 4 66.2 35.4
115 2 6 -1 24.976 49.951 0.274 8.75 4 81.1 52.8
116 4 2 1 25.026 50.052 0.275 8.71 4 24.6 4.8
117 4 3 -2 25.045 50.09 0.275 8.69 4 0.5 0.0
118 4 4 -1 25.076 50.153 0.275 8.67 4 17.0 2.3
119 1 1 3 25.189 50.379 0.276 8.58 4 16.8 2.2
120 2 3 -3 25.341 50.682 0.278 8.47 4 73.0 41.4
121 5 1 -1 25.369 50.738 0.278 8.44 4 39.4 12.0
122 3 2 -3 25.42 50.841 0.279 8.4 4 5.4 0.2
123 2 4 2 25.47 50.939 0.279 8.37 4 24.9 4.8
124 1 5 2 25.533 51.066 0.28 8.32 4 0.8 0.0
125 4 4 0 25.559 51.117 0.28 8.3 4 76.2 44.2
126 3 2 2 25.663 51.326 0.281 8.23 4 37.9 10.9
127 0 3 3 25.663 51.327 0.281 8.22 4 61.4 28.4
128 1 2 3 26.061 52.122 0.285 7.94 4 57.9 24.5
129 5 2 -1 26.236 52.473 0.287 7.82 4 3.8 0.1
130 5 1 0 26.272 52.543 0.287 7.8 4 83.0 49.3
131 4 3 1 26.474 52.948 0.289 7.66 4 43.7 13.4
132 3 5 -2 26.596 53.192 0.291 7.58 4 31.3 6.8
133 1 7 0 26.67 53.34 0.291 7.53 4 30.7 6.5
134 2 6 1 26.685 53.369 0.292 7.53 4 23.8 3.9
135 3 5 1 26.737 53.475 0.292 7.49 4 50.5 17.6
136 3 3 -3 26.853 53.706 0.293 7.42 4 19.8 2.7
137 4 0 -3 26.896 53.793 0.294 7.39 2 20.3 1.4
138 5 1 -2 26.92 53.84 0.294 7.38 4 31.3 6.6
139 1 4 -3 26.948 53.897 0.294 7.36 4 25.7 4.4
140 1 6 -2 26.985 53.971 0.295 7.34 4 53.7 19.4
141 4 4 -2 27.056 54.111 0.295 7.29 4 13.0 1.1
142 3 3 2 27.087 54.173 0.296 7.27 4 63.2 26.6
143 5 2 0 27.119 54.237 0.296 7.25 4 40.5 10.9
144 4 1 -3 27.176 54.353 0.296 7.22 4 2.1 0.0
145 0 6 2 27.269 54.538 0.297 7.16 4 16.7 1.8
146 0 7 1 27.322 54.645 0.298 7.13 4 8.7 0.5
147 3 6 -1 27.333 54.666 0.298 7.13 4 6.4 0.3
148 2 4 -3 27.336 54.672 0.298 7.12 4 41.6 11.3
149 3 6 0 27.379 54.758 0.299 7.1 4 14.8 1.4
150 1 7 -1 27.451 54.901 0.299 7.06 4 7.6 0.4
151 1 3 3 27.47 54.94 0.299 7.04 4 64.9 27.2
152 5 3 -1 27.639 55.278 0.301 6.95 4 0.2 0.0
153 4 5 -1 27.64 55.281 0.301 6.95 4 8.5 0.5
154 0 4 3 27.642 55.284 0.301 6.95 4 41.8 11.1
155 5 2 -2 27.753 55.507 0.302 6.88 4 11.3 0.8
156 2 6 -2 27.781 55.562 0.303 6.87 4 12.9 1.0
157 2 0 3 27.818 55.635 0.303 6.85 2 10.7 0.4
158 4 2 -3 28.004 56.009 0.305 6.74 4 42.1 11.0
159 2 5 2 28.008 56.016 0.305 6.74 4 14.2 1.2
160 2 1 3 28.091 56.182 0.306 6.7 4 15.5 1.5
161 4 5 0 28.092 56.183 0.306 6.7 4 53.2 17.4
162 1 7 1 28.262 56.524 0.307 6.6 4 63.5 24.4
163 2 7 0 28.283 56.565 0.308 6.59 4 16.5 1.7
164 4 4 1 28.413 56.827 0.309 6.53 4 22.0 2.9
165 5 3 0 28.492 56.983 0.31 6.48 4 71.1 30.1
166 1 6 2 28.61 57.22 0.311 6.42 4 19.1 2.1
167 2 7 -1 28.637 57.275 0.311 6.41 4 49.4 14.4
168 3 4 -3 28.775 57.55 0.312 6.34 4 8.7 0.4
169 2 2 3 28.902 57.804 0.314 6.28 4 28.0 4.5
170 3 4 2 28.998 57.997 0.315 6.23 4 34.1 6.6
171 5 3 -2 29.107 58.213 0.316 6.18 4 63.8 23.1
172 4 0 2 29.145 58.289 0.316 6.16 2 17.6 0.9
173 4 3 -3 29.35 58.7 0.318 6.06 4 43.5 10.5
174 1 4 3 29.365 58.731 0.318 6.06 4 12.8 0.9
175 1 5 -3 29.399 58.798 0.319 6.04 4 2.5 0.0
176 4 1 2 29.41 58.82 0.319 6.04 4 45.6 11.5
177 5 1 1 29.471 58.942 0.319 6.01 4 12.8 0.9
178 4 5 -2 29.5 59.001 0.32 6.0 4 17.3 1.7
179 5 4 -1 29.527 59.054 0.32 5.98 4 9.3 0.5
180 3 6 -2 29.597 59.194 0.321 5.95 4 7.1 0.3
181 3 6 1 29.729 59.458 0.322 5.89 4 9.7 0.5
182 2 5 -3 29.766 59.531 0.322 5.88 4 28.2 4.3
183 0 5 3 30.056 60.111 0.325 5.75 4 36.4 7.0
184 4 2 2 30.198 60.396 0.327 5.69 4 3.2 0.1
185 2 7 1 30.204 60.408 0.327 5.69 4 7.6 0.3
186 0 8 0 30.206 60.411 0.327 5.69 2 30.7 2.5
187 2 3 3 30.222 60.444 0.327 5.68 4 17.6 1.6
188 5 2 1 30.258 60.516 0.327 5.66 4 37.1 7.1
189 2 0 -4 30.27 60.54 0.327 5.66 2 88.4 20.3
190 5 4 0 30.346 60.691 0.328 5.63 4 31.3 5.0
191 1 7 -2 30.482 60.963 0.329 5.57 4 68.8 24.2
192 2 1 -4 30.53 61.059 0.33 5.55 4 33.8 5.8
193 6 0 -1 30.541 61.083 0.33 5.55 2 15.8 0.6
194 1 1 -4 30.553 61.106 0.33 5.54 4 32.7 5.4
195 4 6 -1 30.574 61.148 0.33 5.53 4 62.0 19.5
196 5 1 -3 30.668 61.336 0.331 5.5 4 42.8 9.2
197 1 8 0 30.709 61.418 0.331 5.48 4 20.5 2.1
198 0 7 2 30.744 61.489 0.332 5.47 4 48.6 11.8
199 4 5 1 30.788 61.577 0.332 5.45 4 8.6 0.4
200 6 1 -1 30.8 61.599 0.332 5.44 4 23.2 2.7
201 3 7 -1 30.803 61.607 0.332 5.44 4 58.6 17.1
202 3 7 0 30.846 61.693 0.333 5.43 4 26.1 3.4
203 2 6 2 30.92 61.839 0.334 5.4 4 54.2 14.6
204 5 4 -2 30.938 61.875 0.334 5.39 4 18.9 1.8
205 4 6 0 30.998 61.996 0.334 5.37 4 52.5 13.6
206 3 5 -3 31.133 62.266 0.336 5.32 4 15.4 1.2
207 4 4 -3 31.172 62.345 0.336 5.3 4 74.9 27.3
208 2 7 -2 31.22 62.439 0.336 5.28 4 2.5 0.0
209 2 2 -4 31.301 62.602 0.337 5.25 4 17.8 1.5
210 0 8 1 31.306 62.613 0.337 5.25 4 21.1 2.2
211 0 0 4 31.317 62.634 0.337 5.25 2 23.6 1.3
212 1 2 -4 31.324 62.648 0.337 5.25 4 15.8 1.2
213 3 5 2 31.346 62.692 0.338 5.24 4 21.0 2.1
214 1 8 -1 31.424 62.849 0.338 5.21 4 50.2 12.0
215 5 2 -3 31.437 62.875 0.339 5.2 4 24.1 2.8
216 4 3 2 31.485 62.971 0.339 5.19 4 42.8 8.7
217 3 1 -4 31.503 63.006 0.339 5.18 4 42.6 8.6
218 5 3 1 31.544 63.087 0.34 5.17 4 38.1 6.9
219 6 0 -2 31.551 63.101 0.34 5.16 2 54.7 7.1
220 6 2 -1 31.567 63.134 0.34 5.16 4 27.8 3.6
221 0 1 4 31.572 63.143 0.34 5.16 4 6.0 0.2
222 1 5 3 31.696 63.393 0.341 5.11 4 12.6 0.7
223 6 0 0 31.72 63.44 0.341 5.1 2 0.7 0.0
224 3 1 3 31.799 63.597 0.342 5.08 4 45.0 9.4
225 6 1 -2 31.804 63.608 0.342 5.07 4 19.5 1.8
226 5 5 -1 31.851 63.702 0.343 5.06 4 11.6 0.6
227 6 1 0 31.973 63.945 0.344 5.02 4 7.4 0.3
228 1 7 2 31.993 63.986 0.344 5.01 4 45.8 9.7
229 2 4 3 32.015 64.03 0.344 5.0 4 28.3 3.7
230 1 8 1 32.173 64.345 0.346 4.95 4 7.4 0.3
231 2 8 0 32.192 64.384 0.346 4.94 4 7.0 0.2
232 1 6 -3 32.233 64.466 0.346 4.93 4 3.0 0.0
233 3 2 -4 32.261 64.522 0.346 4.92 4 36.0 5.8
234 0 2 4 32.329 64.657 0.347 4.9 4 21.5 2.1
235 4 6 -2 32.329 64.658 0.347 4.9 4 51.4 11.9
236 2 8 -1 32.521 65.041 0.349 4.83 4 31.6 4.4
237 3 2 3 32.553 65.106 0.349 4.82 4 14.7 1.0
238 6 2 -2 32.558 65.117 0.349 4.82 4 4.0 0.1
239 2 3 -4 32.563 65.126 0.349 4.82 4 1.1 0.0
240 2 6 -3 32.581 65.162 0.35 4.81 4 2.7 0.0
241 1 3 -4 32.586 65.171 0.35 4.81 4 64.2 18.2
242 5 5 0 32.636 65.271 0.35 4.8 4 1.1 0.0
243 5 3 -3 32.697 65.393 0.351 4.78 4 49.2 10.6
244 6 2 0 32.725 65.449 0.351 4.77 4 39.2 6.7
245 6 3 -1 32.823 65.647 0.352 4.74 4 7.0 0.2
246 0 6 3 32.856 65.713 0.352 4.73 4 53.8 12.5
247 3 7 -2 32.92 65.839 0.353 4.71 4 25.2 2.7
248 3 7 1 33.044 66.087 0.354 4.67 4 69.6 20.8
249 4 0 -4 33.177 66.353 0.355 4.63 2 44.5 4.2
250 5 5 -2 33.205 66.409 0.355 4.62 4 43.4 8.0
251 4 4 2 33.24 66.48 0.356 4.61 4 17.1 1.2
252 5 4 1 33.296 66.593 0.356 4.6 4 11.6 0.6
253 4 1 -4 33.424 66.847 0.358 4.56 4 20.5 1.8
254 4 5 -3 33.431 66.861 0.358 4.56 4 5.2 0.1
255 3 3 -4 33.503 67.007 0.358 4.54 4 71.6 21.3
256 1 1 4 33.535 67.069 0.359 4.53 4 39.1 6.3
257 4 6 1 33.555 67.109 0.359 4.52 4 4.7 0.1
258 0 3 4 33.57 67.14 0.359 4.52 4 26.6 2.9
259 3 3 3 33.79 67.58 0.361 4.46 4 12.1 0.6
260 6 3 -2 33.795 67.59 0.361 4.45 4 41.4 7.0
261 4 7 -1 33.842 67.684 0.361 4.44 4 1.9 0.0
262 3 6 -3 33.884 67.768 0.362 4.43 4 3.5 0.1
263 6 3 0 33.958 67.917 0.363 4.41 4 8.3 0.3
264 2 8 1 33.982 67.965 0.363 4.4 4 45.3 8.3
265 3 6 2 34.088 68.175 0.364 4.38 4 69.9 19.6
266 4 2 -4 34.159 68.318 0.364 4.36 4 13.3 0.7
267 2 7 2 34.169 68.339 0.365 4.35 4 4.3 0.1
268 1 8 -2 34.243 68.486 0.365 4.33 4 11.4 0.5
269 2 5 3 34.243 68.487 0.365 4.33 4 4.2 0.1
270 4 7 0 34.244 68.488 0.365 4.33 4 8.2 0.3
271 1 2 4 34.269 68.538 0.366 4.33 4 4.5 0.1
272 2 4 -4 34.288 68.577 0.366 4.32 4 42.6 7.2
273 1 4 -4 34.31 68.621 0.366 4.32 4 28.3 3.2
274 5 4 -3 34.419 68.837 0.367 4.29 4 35.4 4.9
275 1 6 3 34.423 68.847 0.367 4.29 4 67.8 18.1
276 0 8 2 34.49 68.98 0.368 4.27 4 4.6 0.1
277 6 4 -1 34.542 69.084 0.368 4.26 4 41.5 6.7
278 3 8 -1 34.546 69.092 0.368 4.26 4 5.4 0.1
279 5 1 2 34.569 69.138 0.368 4.25 4 7.3 0.2
280 5 6 -1 34.572 69.144 0.368 4.25 4 10.0 0.4
281 3 8 0 34.586 69.173 0.368 4.25 4 3.0 0.0
282 6 0 -3 34.642 69.284 0.369 4.23 2 23.1 1.0
283 6 1 -3 34.884 69.768 0.371 4.17 4 30.5 3.6
284 2 8 -2 34.938 69.877 0.372 4.16 4 0.2 0.0
285 1 9 0 34.941 69.883 0.372 4.16 4 37.5 5.4
286 6 0 1 34.964 69.928 0.372 4.15 2 81.9 12.8
287 6 1 1 35.205 70.41 0.374 4.1 4 70.1 18.5
288 3 4 -4 35.206 70.412 0.374 4.1 4 2.2 0.0
289 0 4 4 35.271 70.542 0.375 4.08 4 6.9 0.2
290 5 2 2 35.293 70.586 0.375 4.08 4 6.8 0.2
291 5 6 0 35.326 70.651 0.375 4.07 4 22.2 1.8
292 4 3 -4 35.368 70.737 0.376 4.06 4 6.6 0.2
293 1 7 -3 35.42 70.84 0.376 4.05 4 5.5 0.1
294 4 5 2 35.43 70.859 0.376 4.04 4 67.9 17.1
295 1 3 4 35.477 70.953 0.377 4.03 4 25.9 2.5
296 5 5 1 35.485 70.969 0.377 4.03 4 1.8 0.0
297 3 4 3 35.486 70.972 0.377 4.03 4 0.1 0.0
298 6 4 -2 35.491 70.983 0.377 4.03 4 47.2 8.2
299 0 9 1 35.501 71.002 0.377 4.03 4 10.6 0.4
300 4 7 -2 35.511 71.023 0.377 4.03 4 60.7 13.6
301 6 2 -3 35.605 71.21 0.378 4.01 4 41.3 6.3
302 1 9 -1 35.612 71.224 0.378 4.0 4 62.0 14.1
303 6 4 0 35.651 71.302 0.378 3.99 4 7.2 0.2
304 1 8 2 35.67 71.341 0.379 3.99 4 33.1 4.0
305 2 7 -3 35.752 71.504 0.379 3.97 4 30.7 3.4
306 5 6 -2 35.874 71.748 0.38 3.95 4 12.5 0.6
307 6 2 1 35.923 71.847 0.381 3.94 4 5.3 0.1
308 4 0 3 35.97 71.941 0.381 3.93 2 23.9 1.0
309 0 7 3 36.016 72.032 0.382 3.92 4 23.4 2.0
310 4 6 -3 36.092 72.185 0.382 3.9 4 68.6 16.8
311 2 0 4 36.131 72.261 0.383 3.89 2 20.6 0.8
312 4 1 3 36.208 72.417 0.383 3.88 4 0.5 0.0
313 5 1 -4 36.218 72.437 0.384 3.87 4 63.6 14.4
314 1 9 1 36.317 72.634 0.384 3.85 4 0.6 0.0
315 2 9 0 36.335 72.67 0.385 3.85 4 14.5 0.7
316 2 1 4 36.368 72.737 0.385 3.84 4 53.4 10.1
317 2 5 -4 36.449 72.898 0.386 3.83 4 61.8 13.4
318 1 5 -4 36.471 72.941 0.386 3.82 4 45.8 7.3
319 5 3 2 36.486 72.972 0.386 3.82 4 2.2 0.0
320 3 8 -2 36.552 73.103 0.387 3.81 4 5.6 0.1
321 5 5 -3 36.576 73.152 0.387 3.8 4 12.3 0.5
322 7 1 -1 36.64 73.28 0.387 3.79 4 52.8 9.7
323 2 9 -1 36.646 73.292 0.387 3.79 4 2.2 0.0
324 3 8 1 36.67 73.34 0.388 3.78 4 58.6 11.9
325 4 7 1 36.686 73.373 0.388 3.78 4 34.2 4.1
326 6 5 -1 36.697 73.393 0.388 3.78 4 18.5 1.2
327 6 3 -3 36.794 73.588 0.389 3.76 4 3.9 0.1
328 2 6 3 36.879 73.757 0.39 3.74 4 23.9 2.0
329 4 2 3 36.919 73.838 0.39 3.74 4 44.1 6.7
330 5 2 -4 36.929 73.858 0.39 3.73 4 8.6 0.3
331 3 7 -3 37.003 74.006 0.391 3.72 4 61.0 12.7
332 4 4 -4 37.033 74.066 0.391 3.71 4 21.8 1.6
333 2 2 4 37.078 74.155 0.391 3.71 4 39.7 5.4
334 6 3 1 37.108 74.216 0.392 3.7 4 38.3 5.0
335 1 4 4 37.139 74.278 0.392 3.69 4 46.2 7.2
336 3 7 2 37.199 74.399 0.392 3.68 4 26.9 2.4
337 7 1 -2 37.22 74.44 0.393 3.68 4 13.0 0.6
338 3 5 -4 37.344 74.689 0.394 3.66 4 24.6 2.0
339 7 2 -1 37.347 74.695 0.394 3.66 4 49.3 8.1
340 0 5 4 37.408 74.816 0.394 3.65 4 1.0 0.0
341 4 8 -1 37.433 74.867 0.395 3.64 4 68.1 15.5
342 1 7 3 37.523 75.046 0.395 3.63 4 59.1 11.6
343 3 5 3 37.618 75.236 0.396 3.61 4 26.5 2.3
344 6 5 -2 37.623 75.246 0.396 3.61 4 26.4 2.3
345 5 7 -1 37.667 75.333 0.397 3.6 4 15.6 0.8
346 2 8 2 37.747 75.494 0.397 3.59 4 29.4 2.9
347 6 5 0 37.779 75.558 0.398 3.58 4 24.8 2.0
348 4 8 0 37.819 75.638 0.398 3.57 4 32.3 3.4
349 7 2 -2 37.923 75.846 0.399 3.56 4 60.5 11.9
350 4 6 2 38.031 76.062 0.4 3.54 4 34.6 3.9
351 2 9 1 38.036 76.072 0.4 3.54 4 3.0 0.0
352 7 1 0 38.069 76.138 0.4 3.53 4 47.5 7.3
353 5 6 1 38.084 76.169 0.4 3.53 4 8.3 0.2
354 4 3 3 38.092 76.184 0.4 3.53 4 5.4 0.1
355 5 3 -4 38.102 76.203 0.401 3.53 4 21.7 1.5
356 5 4 2 38.131 76.263 0.401 3.52 4 36.2 4.2
357 2 3 4 38.249 76.498 0.402 3.5 4 38.8 4.8
358 1 9 -2 38.285 76.57 0.402 3.5 4 2.5 0.0
359 5 7 0 38.396 76.792 0.403 3.48 4 52.5 8.8
360 6 4 -3 38.434 76.869 0.404 3.47 4 13.5 0.6
361 7 3 -1 38.516 77.032 0.404 3.46 4 52.0 8.6
362 0 9 2 38.522 77.043 0.404 3.46 4 13.1 0.5
363 3 9 -1 38.575 77.15 0.405 3.45 4 8.1 0.2
364 3 9 0 38.614 77.227 0.405 3.45 4 49.4 7.7
365 6 4 1 38.744 77.488 0.406 3.43 4 24.5 1.9
366 7 2 0 38.767 77.534 0.406 3.42 4 21.9 1.5
367 2 0 -5 38.902 77.803 0.408 3.4 2 41.1 2.6
368 5 7 -2 38.928 77.856 0.408 3.4 4 42.0 5.5
369 2 9 -2 38.951 77.903 0.408 3.4 4 19.6 1.2
370 1 8 -3 38.952 77.903 0.408 3.4 4 8.4 0.2
371 0 10 0 38.968 77.935 0.408 3.39 2 40.8 2.6
372 2 6 -4 39.025 78.05 0.409 3.39 4 60.2 11.2
373 4 8 -2 39.04 78.08 0.409 3.38 4 16.4 0.8
374 1 6 -4 39.046 78.092 0.409 3.38 4 4.9 0.1
375 7 3 -2 39.086 78.172 0.409 3.38 4 28.1 2.4
376 2 1 -5 39.133 78.266 0.41 3.37 4 14.0 0.6
377 4 5 -4 39.134 78.267 0.41 3.37 4 15.1 0.7
378 4 7 -3 39.14 78.28 0.41 3.37 4 25.5 2.0
379 5 6 -3 39.149 78.298 0.41 3.37 4 0.5 0.0
380 1 5 4 39.238 78.476 0.411 3.36 4 14.7 0.7
381 6 6 -1 39.267 78.534 0.411 3.35 4 34.3 3.6
382 2 8 -3 39.273 78.546 0.411 3.35 4 22.4 1.5
383 1 10 0 39.417 78.834 0.412 3.33 4 13.1 0.5
384 1 1 -5 39.496 78.992 0.413 3.32 4 18.9 1.1
385 0 8 3 39.528 79.057 0.413 3.32 4 6.7 0.1
386 6 0 -4 39.596 79.192 0.414 3.31 2 52.3 4.1
387 1 9 2 39.656 79.311 0.414 3.3 4 31.1 2.9
388 3 1 -5 39.668 79.336 0.414 3.3 4 13.8 0.6
389 4 4 3 39.715 79.43 0.415 3.29 4 31.9 3.1
390 5 4 -4 39.725 79.449 0.415 3.29 4 12.7 0.5
391 7 1 -3 39.778 79.556 0.415 3.28 4 1.9 0.0
392 2 2 -5 39.826 79.652 0.416 3.28 4 16.8 0.8
393 6 1 -4 39.826 79.653 0.416 3.28 4 24.2 1.8
394 2 4 4 39.87 79.74 0.416 3.27 4 32.2 3.1
395 3 6 -4 39.901 79.802 0.416 3.27 4 15.2 0.7
396 2 7 3 39.906 79.812 0.416 3.27 4 30.5 2.8
397 7 3 0 39.923 79.845 0.417 3.26 4 25.2 1.9
398 0 10 1 39.954 79.907 0.417 3.26 4 59.0 10.4
399 0 6 4 39.963 79.926 0.417 3.26 4 0.8 0.0
400 3 1 4 40.013 80.026 0.417 3.25 4 22.9 1.6
401 6 0 2 40.056 80.113 0.418 3.25 2 4.8 0.0
402 1 10 -1 40.06 80.12 0.418 3.25 4 44.8 6.0
403 7 4 -1 40.134 80.268 0.418 3.24 4 9.0 0.2
404 3 6 3 40.169 80.338 0.419 3.23 4 9.6 0.3
405 6 6 -2 40.174 80.348 0.419 3.23 4 49.5 7.3
406 4 8 1 40.179 80.358 0.419 3.23 4 1.2 0.0
407 1 2 -5 40.187 80.374 0.419 3.23 4 60.1 10.7
408 5 5 2 40.214 80.428 0.419 3.23 4 41.0 5.0
409 6 1 2 40.286 80.573 0.42 3.22 4 4.1 0.0
410 6 6 0 40.327 80.654 0.42 3.21 4 4.6 0.1
411 3 2 -5 40.358 80.716 0.42 3.21 4 3.5 0.0
412 7 2 -3 40.468 80.936 0.421 3.2 4 39.0 4.5
413 3 8 -3 40.487 80.974 0.421 3.2 4 21.4 1.3
414 3 9 -2 40.507 81.015 0.422 3.19 4 25.2 1.9
415 6 5 -3 40.513 81.026 0.422 3.19 4 6.5 0.1
416 6 2 -4 40.516 81.032 0.422 3.19 4 25.6 1.9
417 0 0 5 40.52 81.04 0.422 3.19 2 4.1 0.0
418 3 9 1 40.622 81.244 0.423 3.18 4 8.0 0.2
419 3 8 2 40.678 81.356 0.423 3.17 4 36.6 3.9
420 7 4 -2 40.698 81.396 0.423 3.17 4 14.5 0.6
421 3 2 4 40.702 81.404 0.423 3.17 4 47.0 6.4
422 1 10 1 40.739 81.478 0.424 3.17 4 12.5 0.5
423 0 1 5 40.749 81.499 0.424 3.17 4 68.2 13.5
424 2 10 0 40.756 81.513 0.424 3.16 4 0.3 0.0
425 6 5 1 40.818 81.637 0.424 3.16 4 61.3 10.9
426 4 0 -5 40.862 81.724 0.425 3.15 2 64.7 6.0
427 2 3 -5 40.974 81.947 0.426 3.14 4 24.9 1.8
428 6 2 2 40.974 81.948 0.426 3.14 4 35.4 3.6
429 1 8 3 40.994 81.987 0.426 3.14 4 22.4 1.4
430 4 7 2 41.032 82.065 0.426 3.13 4 20.8 1.2
431 2 10 -1 41.057 82.114 0.426 3.13 4 45.9 6.0
432 5 7 1 41.085 82.17 0.427 3.13 4 2.3 0.0
433 4 1 -5 41.091 82.182 0.427 3.13 4 40.6 4.7
434 5 8 -1 41.134 82.267 0.427 3.12 4 21.7 1.3
435 5 1 3 41.3 82.601 0.428 3.11 4 32.9 3.1
436 1 3 -5 41.332 82.665 0.429 3.1 4 10.7 0.3
437 4 9 -1 41.363 82.727 0.429 3.1 4 4.1 0.0
438 0 2 5 41.436 82.871 0.43 3.09 4 13.8 0.5
439 7 1 1 41.44 82.88 0.43 3.09 4 19.6 1.1
440 3 3 -5 41.503 83.005 0.43 3.09 4 38.1 4.1
441 7 4 0 41.527 83.054 0.43 3.08 4 8.3 0.2
442 7 3 -3 41.612 83.224 0.431 3.08 4 42.9 5.2
443 4 6 -4 41.66 83.319 0.431 3.07 4 24.8 1.7
444 6 3 -4 41.66 83.32 0.431 3.07 4 22.1 1.4
445 2 9 2 41.669 83.338 0.432 3.07 4 32.1 2.9
446 4 9 0 41.739 83.478 0.432 3.06 4 42.0 5.0
447 1 6 4 41.762 83.525 0.432 3.06 4 33.8 3.2
448 4 2 -5 41.776 83.552 0.432 3.06 4 4.4 0.1
449 4 5 3 41.777 83.555 0.432 3.06 4 43.0 5.2
450 5 5 -4 41.787 83.574 0.433 3.06 4 13.1 0.5
451 3 3 4 41.845 83.69 0.433 3.05 4 10.0 0.3
452 5 8 0 41.847 83.694 0.433 3.05 4 42.2 5.0
453 2 5 4 41.931 83.862 0.434 3.04 4 67.5 12.7
454 5 2 3 41.985 83.97 0.434 3.04 4 86.4 20.8
455 2 7 -4 42.009 84.017 0.434 3.04 4 9.1 0.2
456 1 7 -4 42.029 84.058 0.435 3.04 4 28.6 2.3
457 6 3 2 42.115 84.231 0.435 3.03 4 0.9 0.0
458 7 2 1 42.124 84.248 0.435 3.03 4 80.1 17.8
459 5 7 -3 42.131 84.261 0.435 3.03 4 71.6 14.2
460 7 5 -1 42.192 84.384 0.436 3.02 4 3.1 0.0
461 6 7 -1 42.247 84.493 0.436 3.02 4 43.0 5.1
462 5 8 -2 42.369 84.737 0.437 3.01 4 2.2 0.0
463 2 10 1 42.406 84.812 0.438 3.0 4 48.7 6.5
464 2 4 -5 42.57 85.141 0.439 2.99 4 55.6 8.5
465 0 3 5 42.575 85.15 0.439 2.99 4 17.5 0.8
466 4 8 -3 42.577 85.154 0.439 2.99 4 21.9 1.3
467 1 10 -2 42.649 85.298 0.44 2.98 4 4.3 0.1
468 5 6 2 42.727 85.453 0.44 2.98 4 2.6 0.0
469 7 5 -2 42.751 85.502 0.441 2.97 4 29.1 2.3
470 8 0 -1 42.794 85.587 0.441 2.97 2 44.9 2.7
471 1 9 -3 42.847 85.693 0.441 2.97 4 36.8 3.7
472 3 7 -4 42.872 85.743 0.442 2.96 4 33.3 3.0
473 1 1 5 42.878 85.757 0.442 2.96 4 18.3 0.9
474 0 10 2 42.88 85.76 0.442 2.96 4 45.2 5.5
475 4 3 -5 42.914 85.828 0.442 2.96 4 11.9 0.4
476 1 4 -5 42.927 85.854 0.442 2.96 4 29.9 2.4
477 3 10 -1 42.932 85.864 0.442 2.96 4 20.9 1.2
478 0 7 4 42.933 85.866 0.442 2.96 4 1.9 0.0
479 4 9 -2 42.933 85.867 0.442 2.96 4 30.1 2.5
480 3 10 0 42.97 85.94 0.442 2.96 4 41.9 4.8
481 8 0 -2 43.016 86.032 0.443 2.95 2 28.5 1.1
482 8 1 -1 43.021 86.042 0.443 2.95 4 41.2 4.6
483 6 6 -3 43.022 86.044 0.443 2.95 4 15.4 0.6
484 3 4 -5 43.096 86.192 0.443 2.95 4 42.6 4.9
485 5 3 3 43.122 86.244 0.444 2.94 4 5.0 0.1
486 3 7 3 43.136 86.273 0.444 2.94 4 7.7 0.2
487 6 7 -2 43.141 86.283 0.444 2.94 4 23.1 1.4
488 2 9 -3 43.162 86.324 0.444 2.94 4 20.4 1.1
489 7 4 -3 43.205 86.409 0.444 2.94 4 14.0 0.5
490 8 1 -2 43.243 86.486 0.445 2.94 4 8.9 0.2
491 6 4 -4 43.252 86.505 0.445 2.94 4 71.6 13.8
492 7 3 1 43.261 86.522 0.445 2.93 4 32.8 2.9
493 6 7 0 43.293 86.585 0.445 2.93 4 21.1 1.2
494 2 10 -2 43.301 86.601 0.445 2.93 4 65.1 11.4
495 6 6 1 43.325 86.65 0.445 2.93 4 15.8 0.7
496 2 8 3 43.331 86.662 0.445 2.93 4 49.4 6.6
497 5 1 -5 43.386 86.772 0.446 2.93 4 13.4 0.5
498 0 9 3 43.413 86.826 0.446 2.92 4 18.9 1.0
499 3 4 4 43.437 86.873 0.446 2.92 4 35.9 3.5
500 1 2 5 43.56 87.119 0.447 2.91 4 55.4 8.2
501 7 5 0 43.574 87.148 0.447 2.91 4 22.3 1.3
502 8 2 -1 43.702 87.404 0.448 2.9 4 12.3 0.4
503 6 4 2 43.706 87.412 0.449 2.9 4 0.8 0.0
504 8 2 -2 43.924 87.848 0.45 2.89 4 18.4 0.9
505 1 10 2 43.992 87.984 0.451 2.88 4 51.6 7.0
506 4 9 1 44.054 88.107 0.451 2.88 4 23.5 1.5
507 5 2 -5 44.067 88.133 0.451 2.88 4 42.0 4.7
508 0 4 5 44.164 88.328 0.452 2.87 4 38.5 3.9
509 1 11 0 44.211 88.421 0.453 2.87 4 44.6 5.2
510 4 0 4 44.232 88.463 0.453 2.87 2 6.4 0.1
511 7 1 -4 44.234 88.467 0.453 2.87 4 41.7 4.6
512 4 6 3 44.277 88.554 0.453 2.87 4 19.5 1.0
513 5 6 -4 44.286 88.573 0.453 2.87 4 21.1 1.2
514 3 9 -3 44.358 88.715 0.454 2.86 4 19.5 1.0
515 2 6 4 44.429 88.859 0.454 2.86 4 52.7 7.3
516 4 8 2 44.444 88.888 0.455 2.86 4 62.5 10.2
517 4 1 4 44.458 88.916 0.455 2.86 4 17.7 0.8
518 5 8 1 44.496 88.992 0.455 2.85 4 14.4 0.5
519 4 4 -5 44.502 89.004 0.455 2.85 4 33.5 2.9
520 8 0 0 44.509 89.018 0.455 2.85 2 31.6 1.3
521 3 9 2 44.547 89.093 0.455 2.85 4 12.6 0.4
522 2 5 -5 44.613 89.225 0.456 2.85 4 10.8 0.3
523 4 7 -4 44.613 89.226 0.456 2.85 4 10.7 0.3
524 7 6 -1 44.689 89.379 0.456 2.84 4 7.9 0.2
525 1 3 5 44.693 89.386 0.457 2.84 4 20.4 1.1
526 5 4 3 44.71 89.419 0.457 2.84 4 11.8 0.4
527 1 7 4 44.715 89.43 0.457 2.84 4 41.2 4.4
528 8 1 0 44.736 89.471 0.457 2.84 4 54.2 7.7
529 0 11 1 44.738 89.476 0.457 2.84 4 9.5 0.2
530 3 10 -2 44.831 89.662 0.458 2.84 4 27.0 1.9
531 8 3 -1 44.835 89.67 0.458 2.84 4 14.9 0.6
532 1 11 -1 44.843 89.686 0.458 2.84 4 22.2 1.3
533 7 4 1 44.848 89.696 0.458 2.84 4 10.6 0.3
534 1 9 3 44.859 89.718 0.458 2.84 4 18.0 0.8
535 7 2 -4 44.913 89.827 0.458 2.83 4 6.2 0.1
536 3 10 1 44.944 89.889 0.459 2.83 4 33.8 3.0
537 1 5 -5 44.968 89.936 0.459 2.83 4 15.0 0.6
538 5 9 -1 44.998 89.995 0.459 2.83 4 19.7 1.0
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 1 1 0 6.192 12.384 7.14156 109.9 20.9 21.1 5.6
2 0 2 0 7.226 14.451 6.1242 9.2 1.7 1.8 5.6
3 0 1 1 8.3 16.601 5.33578 87.3 16.6 16.7 5.6
4 1 2 0 8.818 17.635 5.02494 19.0 3.6 3.6 5.6
5 2 0 0 10.093 20.187 4.3952 62.6 11.9 12.0 5.6
6 0 2 1 10.419 20.838 4.25933 42.7 8.1 8.2 5.6
7 1 1 1 10.683 21.367 4.15508 390.5 74.4 74.6 5.6
8 2 1 0 10.731 21.462 4.13691 47.6 9.1 9.1 5.6
9 2 0 -1 10.923 21.845 4.06519 394.5 75.2 75.3 5.6
10 2 1 -1 11.516 23.032 3.85824 29.5 5.6 5.6 5.6
11 1 3 0 12.006 24.013 3.70289 524.7 100.0 100.0 5.6
12 1 2 1 12.416 24.833 3.58244 42.7 8.1 8.1 5.6
13 2 2 -1 13.146 26.291 3.38693 7.1 1.4 1.4 5.6
14 0 3 1 13.243 26.486 3.36243 69.3 13.2 13.2 5.6
15 1 3 -1 13.476 26.953 3.30528 60.6 11.6 11.5 5.6
16 2 0 1 14.094 28.187 3.16328 210.2 40.1 39.9 5.6
17 0 4 0 14.569 29.139 3.0621 397.0 75.7 75.4 5.6
18 1 3 1 14.887 29.774 2.99817 84.0 16.0 15.9 5.6
19 2 3 0 14.922 29.844 2.99132 18.3 3.5 3.5 5.6
20 1 1 -2 15.056 30.112 2.96528 329.9 62.9 62.6 5.6
21 1 4 0 15.449 30.898 2.89168 13.6 2.6 2.6 5.6
22 2 3 -1 15.509 31.018 2.88073 24.5 4.7 4.6 5.6
23 3 1 -1 15.609 31.219 2.86266 111.8 21.3 21.2 5.6
24 3 1 0 15.682 31.364 2.84972 38.4 7.3 7.3 5.6
25 2 0 -2 15.879 31.759 2.81524 220.7 42.1 41.8 5.6
26 2 1 -2 16.305 32.609 2.7437 51.6 9.8 9.8 5.6
27 1 2 -2 16.36 32.721 2.7346 115.3 22.0 21.8 5.6
28 1 4 -1 16.639 33.279 2.69002 44.5 8.5 8.4 5.6
29 0 2 2 16.781 33.563 2.66789 6.0 1.1 1.1 5.7
30 3 2 -1 16.875 33.751 2.65349 38.6 7.4 7.3 5.7
31 1 4 1 17.824 35.647 2.51652 18.4 3.5 3.5 5.7
32 2 4 0 17.853 35.707 2.51247 7.5 1.4 1.4 5.7
33 2 3 1 17.941 35.883 2.50057 79.7 15.2 15.0 5.7
34 1 3 -2 18.351 36.701 2.44666 70.7 13.5 13.3 5.7
35 1 2 2 18.695 37.389 2.40319 13.0 2.5 2.5 5.7
36 0 3 2 18.732 37.465 2.39853 22.5 4.3 4.2 5.7
37 3 3 -1 18.818 37.635 2.38805 250.0 47.6 47.1 5.7
38 0 5 1 19.891 39.782 2.26398 46.5 8.9 8.7 5.7
39 3 2 -2 20.036 40.072 2.24829 29.6 5.6 5.6 5.7
40 4 1 -1 20.295 40.59 2.22078 18.9 3.6 3.6 5.7
41 2 0 2 20.413 40.825 2.2085 5.8 1.1 1.1 5.7
42 2 4 1 20.494 40.988 2.20013 170.0 32.4 31.9 5.7
43 2 1 2 20.757 41.514 2.17345 19.9 3.8 3.7 5.7
44 4 1 0 20.861 41.723 2.16306 18.4 3.5 3.5 5.7
45 1 5 1 21.073 42.147 2.14227 7.2 1.4 1.3 5.7
46 0 4 2 21.204 42.408 2.12967 74.1 14.1 13.9 5.7
47 3 4 -1 21.281 42.562 2.12232 17.7 3.4 3.3 5.7
48 3 4 0 21.337 42.674 2.11703 42.9 8.2 8.0 5.7
49 2 5 -1 21.538 43.076 2.09817 30.1 5.7 5.6 5.7
50 2 2 2 21.763 43.526 2.07754 9.6 1.8 1.8 5.7
51 2 4 -2 21.819 43.638 2.07246 55.3 10.5 10.4 5.7
52 4 2 0 21.863 43.727 2.06846 77.4 14.8 14.5 5.7
53 3 3 1 21.901 43.802 2.06508 10.2 1.9 1.9 5.7
54 2 0 -3 22.593 45.186 2.005 12.2 2.3 2.3 5.7
55 1 4 2 22.802 45.604 1.98757 11.9 2.3 2.2 5.7
56 0 0 3 22.944 45.888 1.97594 77.3 14.7 14.4 5.7
57 2 3 2 23.362 46.724 1.94252 5.3 1.0 1.0 5.7
58 2 5 1 23.435 46.87 1.93682 51.3 9.8 9.6 5.7
59 4 2 -2 23.534 47.068 1.92912 10.8 2.1 2.0 5.7
60 1 5 -2 23.765 47.53 1.91144 8.7 1.7 1.6 5.7
61 3 4 -2 23.954 47.908 1.89723 16.0 3.0 3.0 5.7
62 0 5 2 24.075 48.151 1.88822 43.9 8.4 8.2 5.7
63 3 4 1 24.106 48.213 1.88595 21.2 4.0 3.9 5.7
64 3 5 -1 24.145 48.29 1.8831 15.0 2.9 2.8 5.7
65 3 5 0 24.196 48.391 1.8794 25.1 4.8 4.7 5.7
66 3 1 -3 24.532 49.065 1.85517 43.2 8.2 8.0 5.7
67 1 6 1 24.562 49.124 1.85306 11.6 2.2 2.2 5.7
68 1 3 -3 24.932 49.864 1.8273 35.4 6.7 6.6 5.7
69 2 6 -1 24.976 49.951 1.8243 52.8 10.1 9.8 5.7
70 2 3 -3 25.341 50.682 1.7997 53.4 10.2 9.9 5.8
71 4 4 0 25.559 51.117 1.78539 44.2 8.4 8.2 5.8
72 0 3 3 25.663 51.327 1.77859 39.3 7.5 7.3 5.8
73 1 2 3 26.061 52.122 1.75331 24.5 4.7 4.5 5.8
74 5 1 0 26.272 52.543 1.74024 49.3 9.4 9.1 5.8
75 4 3 1 26.474 52.948 1.7279 13.4 2.6 2.5 5.8
76 3 5 -2 26.596 53.192 1.72054 6.8 1.3 1.3 5.8
77 1 7 0 26.67 53.34 1.7161 10.5 2.0 1.9 5.8
78 3 5 1 26.737 53.475 1.71211 17.6 3.3 3.2 5.8
79 5 1 -2 26.92 53.84 1.70135 12.5 2.4 2.3 5.8
80 1 6 -2 26.985 53.971 1.69754 19.4 3.7 3.6 5.8
81 3 3 2 27.087 54.173 1.69167 26.6 5.1 4.9 5.8
82 5 2 0 27.119 54.237 1.68983 10.9 2.1 2.0 5.8
83 2 4 -3 27.336 54.672 1.67741 11.3 2.2 2.1 5.8
84 1 3 3 27.47 54.94 1.66986 27.2 5.2 5.0 5.8
85 0 4 3 27.642 55.284 1.66028 11.1 2.1 2.1 5.8
86 4 2 -3 28.004 56.009 1.6405 12.2 2.3 2.3 5.8
87 4 5 0 28.092 56.183 1.63582 18.8 3.6 3.5 5.8
88 1 7 1 28.262 56.524 1.62678 26.1 5.0 4.8 5.8
89 5 3 0 28.492 56.983 1.61474 30.1 5.7 5.5 5.8
90 2 7 -1 28.637 57.275 1.60721 16.5 3.1 3.0 5.8
91 3 4 2 28.998 57.997 1.58891 6.6 1.3 1.2 5.8
92 5 3 -2 29.107 58.213 1.58352 23.1 4.4 4.2 5.8
93 4 3 -3 29.35 58.7 1.57153 11.5 2.2 2.1 5.8
94 4 1 2 29.41 58.82 1.56861 11.5 2.2 2.1 5.8
95 0 5 3 30.056 60.111 1.53798 7.0 1.3 1.3 5.8
96 2 0 -4 30.27 60.54 1.5281 27.4 5.2 5.0 5.8
97 1 7 -2 30.482 60.963 1.5185 24.2 4.6 4.4 5.8
98 2 1 -4 30.53 61.059 1.51634 11.9 2.3 2.2 5.8
99 4 6 -1 30.574 61.148 1.51435 19.5 3.7 3.6 5.8
100 5 1 -3 30.668 61.336 1.51016 9.2 1.8 1.7 5.8
101 0 7 2 30.744 61.489 1.50679 11.8 2.3 2.2 5.8
102 3 7 -1 30.803 61.607 1.50418 19.8 3.8 3.6 5.8
103 2 6 2 30.92 61.839 1.49908 16.3 3.1 3.0 5.8
104 4 6 0 30.998 61.996 1.49566 13.6 2.6 2.5 5.8
105 4 4 -3 31.172 62.345 1.48813 27.3 5.2 5.0 5.8
106 0 8 1 31.306 62.613 1.4824 6.2 1.2 1.1 5.8
107 1 8 -1 31.424 62.849 1.4774 14.8 2.8 2.7 5.9
108 4 3 2 31.485 62.971 1.47484 17.3 3.3 3.2 5.9
109 6 0 -2 31.551 63.101 1.4721 17.8 3.4 3.3 5.9
110 3 1 3 31.799 63.597 1.46181 11.2 2.1 2.0 5.9
111 1 7 2 31.993 63.986 1.45386 13.3 2.5 2.4 5.9
112 3 2 -4 32.261 64.522 1.44308 5.8 1.1 1.1 5.9
113 4 6 -2 32.329 64.658 1.44036 13.9 2.7 2.5 5.9
114 1 3 -4 32.586 65.171 1.43026 18.2 3.5 3.3 5.9
115 5 3 -3 32.697 65.393 1.42594 17.3 3.3 3.2 5.9
116 0 6 3 32.856 65.713 1.41978 12.5 2.4 2.3 5.9
117 3 7 1 33.044 66.087 1.41264 20.8 4.0 3.8 5.9
118 5 5 -2 33.205 66.409 1.40657 12.2 2.3 2.2 5.9
119 3 3 -4 33.503 67.007 1.39547 21.3 4.1 3.9 5.9
120 1 1 4 33.535 67.069 1.39432 6.4 1.2 1.2 5.9
121 6 3 -2 33.795 67.59 1.38483 7.0 1.3 1.3 5.9
122 2 8 1 33.982 67.965 1.37811 8.3 1.6 1.5 5.9
123 3 6 2 34.088 68.175 1.37437 19.6 3.7 3.5 5.9
124 2 4 -4 34.288 68.577 1.3673 10.4 2.0 1.9 5.9
125 1 6 3 34.423 68.847 1.3626 23.0 4.4 4.2 5.9
126 6 4 -1 34.542 69.084 1.35849 7.1 1.3 1.3 5.9
127 6 0 1 34.964 69.928 1.34414 18.2 3.5 3.3 5.9
128 6 1 1 35.205 70.41 1.33612 18.5 3.5 3.3 5.9
129 4 5 2 35.43 70.859 1.32875 17.1 3.3 3.1 5.9
130 4 7 -2 35.511 71.023 1.32609 24.7 4.7 4.5 5.9
131 1 9 -1 35.612 71.224 1.32284 20.4 3.9 3.7 5.9
132 4 6 -3 36.092 72.185 1.30758 16.8 3.2 3.0 5.9
133 5 1 -4 36.218 72.437 1.30365 14.4 2.7 2.6 5.9
134 2 1 4 36.368 72.737 1.29901 10.1 1.9 1.8 6.0
135 2 5 -4 36.449 72.898 1.29653 20.7 4.0 3.7 6.0
136 3 8 1 36.67 73.34 1.28981 26.9 5.1 4.8 6.0
137 4 2 3 36.919 73.838 1.28234 6.9 1.3 1.2 6.0
138 3 7 -3 37.003 74.006 1.27984 14.3 2.7 2.6 6.0
139 2 2 4 37.078 74.155 1.27764 5.4 1.0 1.0 6.0
140 1 4 4 37.139 74.278 1.27583 7.2 1.4 1.3 6.0
141 7 2 -1 37.347 74.695 1.26974 10.2 1.9 1.8 6.0
142 4 8 -1 37.433 74.867 1.26725 15.5 2.9 2.8 6.0
143 1 7 3 37.523 75.046 1.26466 11.6 2.2 2.1 6.0
144 7 2 -2 37.923 75.846 1.25329 11.9 2.3 2.1 6.0
145 7 1 0 38.069 76.138 1.24922 7.6 1.5 1.4 6.0
146 5 4 2 38.131 76.263 1.24748 5.8 1.1 1.0 6.0
147 5 7 0 38.396 76.792 1.2402 8.8 1.7 1.6 6.0
148 7 3 -1 38.516 77.032 1.23694 9.1 1.7 1.6 6.0
149 3 9 0 38.614 77.227 1.2343 7.7 1.5 1.4 6.0
150 5 7 -2 38.928 77.856 1.22589 8.1 1.6 1.4 6.0
151 2 6 -4 39.025 78.05 1.22333 12.1 2.3 2.2 6.0
152 0 10 1 39.954 79.907 1.1995 10.4 2.0 1.8 6.0
153 1 10 -1 40.06 80.12 1.19685 6.0 1.1 1.1 6.0
154 1 2 -5 40.187 80.374 1.19371 22.9 4.4 4.0 6.0
155 7 2 -3 40.468 80.936 1.18683 5.8 1.1 1.0 6.1
156 3 2 4 40.702 81.404 1.18118 10.9 2.1 1.9 6.1
157 0 1 5 40.749 81.499 1.18005 13.5 2.6 2.4 6.1
158 6 5 1 40.818 81.637 1.17841 10.9 2.1 1.9 6.1
159 4 0 -5 40.862 81.724 1.17737 6.0 1.2 1.1 6.1
160 6 2 2 40.974 81.948 1.17471 6.8 1.3 1.2 6.1
161 2 10 -1 41.057 82.114 1.17276 7.3 1.4 1.3 6.1
162 2 9 2 41.669 83.338 1.15861 6.0 1.1 1.1 6.1
163 4 9 0 41.739 83.478 1.15703 8.2 1.6 1.4 6.1
164 4 5 3 41.777 83.555 1.15616 5.7 1.1 1.0 6.1
165 2 5 4 41.931 83.862 1.15271 12.7 2.4 2.2 6.1
166 5 2 3 41.985 83.97 1.1515 21.1 4.0 3.7 6.1
167 7 2 1 42.124 84.248 1.1484 32.0 6.1 5.6 6.1
168 2 10 1 42.406 84.812 1.1422 6.5 1.2 1.1 6.1
169 2 4 -5 42.57 85.141 1.13864 10.6 2.0 1.9 6.1
170 1 9 -3 42.847 85.693 1.1327 6.7 1.3 1.2 6.1
171 0 10 2 42.88 85.76 1.13199 5.5 1.1 1.0 6.1
172 4 9 -2 42.933 85.867 1.13086 6.1 1.2 1.1 6.1
173 8 1 -1 43.021 86.042 1.12901 6.3 1.2 1.1 6.1
174 6 4 -4 43.252 86.505 1.12415 16.7 3.2 2.9 6.1
175 2 10 -2 43.301 86.601 1.12314 19.2 3.7 3.3 6.1
176 1 2 5 43.56 87.119 1.11779 9.5 1.8 1.7 6.1
177 1 10 2 43.992 87.984 1.10902 7.0 1.3 1.2 6.2
178 5 2 -5 44.067 88.133 1.10753 6.1 1.2 1.1 6.2
179 1 11 0 44.211 88.421 1.10466 9.9 1.9 1.7 6.2
180 4 8 2 44.444 88.888 1.10007 18.4 3.5 3.2 6.2
181 8 1 0 44.736 89.471 1.0944 13.8 2.6 2.4 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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