Yoshimuraite
McDonald A M, Grice J D, Chao G Y
The Canadian Mineralogist 38 (2000) 649-656
The crystal structure of yoshimuraite, a layered Ba-Mn-Ti silicophosphate,
with comments on five-coordinated Ti
_database_code_amcsd 0005651
6.999 14.748 5.386 93.62 89.98 95.50 P-1
atom       x       y       z occ
Ba1   .33664  .32839  .22065
Ba2   .82198  .39244 -.26926
Mn1        0       0       0
Mn2   .24817 -.00484  .49933
Mn3        0      .5       0
Ti    .79479  .20281  .19897 .78
Fe    .79479  .20281  .19897 .22
Si1   .06444  .18813 -.30518
Si2   .51303  .18517  .69546
P     .71812  .52290  .25371 .46
S     .71812  .52290  .25371 .34
Si    .71812  .52290  .25371 .17
O1    .68966  .41905  .23644
O2    .60802  .23223  .45759
O3   -.00953  .23529 -.04731
O4   -.00825  .23654  .45609
O5    .60787  .23087 -.04905
O6    .82858  .55356  .03761
O7    .17183  .44764  .51800
O8    .48855 -.07530  .32539
O9   -.22796  .08182  .18342
O10   .29597  .21492  .69743
OH11  .26219  .06656  .17306
O12   .01737  .07821 -.32642
O13   .53965  .57034  .26244