Klebelsbergite
Manchetti S, Sabelli C
American Mineralogist 65 (1980) 931-935
The crystal structure of klebelsbergite Sb4O4(OH)2SO4
_database_code_amcsd 0000795
5.766 11.274 14.887 90 90 90 Pca2_1
atom     x     y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Sb1  .4789 .3596   .25      0.0059 0.0029 0.0014 0.0005 0.0004 0.0001
Sb2  .3917 .0874 .0914      0.0060 0.0019 0.0009 0.0004 0.0000 0.0000
Sb3  .1526 .4078 .4322      0.0056 0.0020 0.0009 0.0005 -.0002 0.0001
Sb4  .0483 .1412 .2673      0.0071 0.0026 0.0013 0.0008 0.0006 -.0002
S    .6780 .2595 .5083      0.0064 0.0034 0.0011 -.0001 -.0007 0.0002
O1   .8525 .2505 .4312      0.0191 0.0065 0.0006 0.0004 0.0015 0.0013
O2   .6400 .3877 .5285      0.0288 0.0017 0.0024 -.0002 -.0032 -.0001
O3   .4627 .2026 .4849      0.0137 0.0149 0.0025 -.0106 0.0002 -.0035
O4   .7742 .2015 .5899      0.0128 0.0125 0.0009 0.0077 0.0015 0.0028
O5   .2856 .4627 .1823      0.0166 0.0020 0.0015 0.0044 0.0001 0.0006
O6   .3077 .2026 .1821      0.0077 0.0026 0.0008 -.0017 0.0022 0.0001
O7   .4238 .4919 .3657      0.0053 0.0061 0.0005 -.0041 0.0013 -.0012
O8   .1178 .0069 .1642      0.0026 0.0018 0.0010 0.0006 -.0013 0.0005
O9   .2723 .0515 .3413      0.0268 0.0036 0.0014 -.0026 -.0058 0.0001
O10  .1994 .3088 .3213      0.0098 0.0016 0.0011 -.0019 0.0021 -.0013
H1   .3010 .5130 .1290   4.
H2   .3370 .1010 .3890   4.