KBSi3O8
Kimata M
Mineralogical Magazine 57 (1993) 157-164
Crystal structure of KBSi3O8 isostructural with danburite
_database_code_amcsd 0014498
8.683 9.253 8.272 90 90 90 Pnam
atom     x     y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
K    .4002 .0760    .25      1.71  .0054  .0048  .0068 -.0004      0      0
BT1  .2818 .4071  .4231 .441 1.09  .0038  .0030  .0040  .0004  .0001  .0012
SiT1 .2818 .4071  .4231 .559 1.09  .0038  .0030  .0040  .0004  .0001  .0012
BT2  .0759 .1916 -.0662 .059  .91  .0033  .0030  .0026  .0003  .0001  .0005
SiT2 .0759 .1916 -.0662 .941  .91  .0033  .0030  .0026  .0003  .0001  .0005
O1   .1998 .0667 -.0288      1.28  .0048  .0023  .0058 -.0008 -.0011  .0002
O2   .1528 .3457 -.0373      1.17  .0030  .0044  .0040  .0002 -.0016 -.0001
O3   .4302 .3215  .0535      1.28  .0047  .0048  .0028  .0000 -.0007  .0006
O4   .4847 .6796    .25      1.00  .0026  .0047  .0021  .0007      0      0
O5   .2224 .3863    .25      1.47  .0023  .0055  .0066 -.0017      0      0