Man L I
Soviet Physics Crystallography 15 (1970) 399-403
Determination of the structure of Tl2S by the electron diffraction method
Locality: synthetic
12.20 12.20 18.17 90 90 120 R3
atom x y z Biso
Tl1 .119 .191 .957 .84
Tl2 .122 .201 .321 .84
Tl3 .118 .209 .656 .84
Tl4 .233 .103 .140 .84
Tl5 .227 .093 .474 .84
Tl6 .233 .096 .808 .84
S1 0 0 .195 .84
S2 0 0 .519 .84
S3 0 0 .853 .84
S4 .665 .657 .226 .84
S5 .333 .337 .195 .84
Giester G, Lengauer C L, Tillmanns E, Zemann J
Journal of Solid State Chemistry 168 (2002) 322-330
Tl2S: Re-determination of crystal structure and stereochemical discussion
12.150 12.150 18.190 90 90 120 R3
atom x y z Uiso
Tl1 .1257 .2030 -.0781 .0457
Tl2 .4685 .9065 -.0969 .0452
Tl3 .8065 .5719 -.0992 .0449
Tl4 .2407 .1060 .1046 .0451
Tl5 .5399 .7488 .0846 .0453
Tl6 .8712 .4124 .0850 .0457
S1 0 0 .0365 .047
S2 1/3 2/3 -.0255 .047
S3 2/3 1/3 -.0261 .048
S4 .0025 .6630 .0269 .041
S5 .9992 .3234 -.0200 .047
Sample: hypothetical idealized structure
atom x y z
Tl1 1/9 2/9 -.0914
Tl2 4/9 8/9 -.0914
Tl3 7/9 5/9 -.0914
Tl4 2/9 1/9 .0914
Tl5 5/9 7/9 .0914
Tl6 8/9 4/9 .0914
S1 0 0 0
S2 1/3 2/3 0
S3 2/3 1/3 0
S4 0 2/3 0
S5 0 1/3 0
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