Rebulite
Balic-Zunic T, Scavnicar S, Engel P
Zeitschrift fur Kristallographie 160 (1982) 109-125
The crystal structure of rebulite, Tl5Sb5As8S22
Locality: Allchar, Macedonia, Yugoslavia
_database_code_amcsd 0010849
17.441 7.363 32.052 90 105.03 90 P2_1/c
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Tl1 .30905 .2987 .45738 .00275 .0115 .00081 -.0001 .00032 -.00015
Tl2 .69251 .1470 .28730 .00287 .0155 .00083 -.0004 .00018 -.00045
Tl3 .12171 .4011 .06272 .00274 .0143 .00064 .0004 .00025 .0001
Tl4 .89889 .3259 .18642 .00219 .0074 .00064 -.00015 .0001 .00005
Tl5 .47617 .3655 .11055 .00271 .0106 .00083 -.0003 .00068 .0000
Sb1 .6896 .3257 .43188 .00126 .0087 .00050 .00065 .00035 .00045
Sb2 .3068 .0979 .31611 .00117 .0062 .00038 -.00005 .00018 .0002
Sb3 .0852 .1893 .42811 .00133 .0095 .00051 .0008 .00012 .0001
Sb4 .9206 .1884 .32652 .00163 .0071 .00050 -.0001 .00021 -.00035
Sb5 .8993 .4529 .4251 .45 .0007 .0086 .00074 .00055 .0001 .0002
As5' .9138 .4467 .4212 .55 .0005 .0081 .00059 .0006 .00005 .0004
As1 .2960 .0691 .1679 .0011 .0081 .00034 -.0001 .0001 -.0003
As2 .7020 .3425 .0860 .0012 .0054 .00034 -.00025 .00005 -.00015
As3 .8799 .1950 .0469 .0012 .0079 .00034 .0002 .0000 -.00015
As4 .1234 .1976 .2118 .0011 .0075 .00039 .0003 .0002 -.0001
As5 .5362 .2525 .4893 .0010 .0087 .00033 -.00045 .0001 .00015
As6 .4727 .1767 .2609 .0008 .0071 .00029 -.0002 .00015 .00005
As7 .4826 .4159 .3614 .0013 .0070 .00040 -.0003 .0000 -.00005
As8 .1162 .3688 .3161 .0012 .0049 .00044 .00045 .00015 -.00005
S1 -.0065 .4698 .1170 .0016 .005 .00058 -.0006 -.00005 .0003
S2 .1824 -.0182 .0079 .0013 .010 .00057 .00015 .0002 -.0004
S3 .8165 .240 .3842 .0018 .010 .00062 .0004 .00015 -.0005
S4 .8314 .473 .0234 .0016 .011 .00055 -.0007 .00005 .00075
S5 .1949 .285 .1647 .0020 .012 .00045 .00105 .00045 .00065
S6 .8166 .4430 .2611 .0016 .006 .00063 -.0005 .0002 -.0004
S7 .8047 .134 .0942 .0018 .008 .00053 .0001 .0002 .00035
S8 .1829 .4101 .2634 .0018 .010 .00034 -.00015 .0006 .0002
S9 .1935 .1641 .3596 .0014 .008 .00063 .0004 .0001 .0002
S10 .9937 .248 .4715 .0012 .011 .00055 .00005 .00025 -.0003
S11 .9832 .4522 .3666 .0018 .006 .00044 -.0003 .0001 -.00005
S12 .4131 -.0090 .0424 .0013 .008 .00038 -.00015 .00035 -.0004
S13 .5884 .2443 .3559 .0013 .008 .00041 .0000 .00025 -.0002
S14 .3863 .535 .0213 .0036 .007 .00068 -.0017 .00045 -.00035
S15 .4056 .257 .1922 .0014 .011 .00055 -.00215 -.0001 .0006
S16 .5910 .4379 .2219 .0017 .005 .00058 -.0002 .00015 .00005
S17 .5932 .1617 .0608 .0012 .008 .00059 -.0008 .0001 -.00005
S18 .4134 .4084 .2891 .0017 .008 .00050 .00035 .00015 .00045
S19 .4083 .199 .3854 .0010 .011 .00049 -.00045 .0000 -.0005
S20 .0154 .1931 .2784 .0015 .008 .00042 -.00005 .00015 -.0001
S21 .2931 .1401 .0974 .0015 .007 .00050 .0003 .0002 .00025
S22 .6935 .2836 .1550 .0018 .007 .00056 -.0006 .0003 .00005
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