Bafertisite
Guan Y S, Simonov V I, Belov N V
Doklady Akademii Nauk SSSR 149 (1963) 1416-1419
The crystal structure of bafertisite BaFe2TiO[Si2O7](OH)2
_database_code_amcsd 0012443
10.6 13.64 12.47 90 119.5 90 Cm
atom    x    y    z Biso
Ba1  .116    0 .462   .8
Ba2  .616    0 .462   .8
Ba3  .404 .244 .525   .8
Fe1  .005    0 .983   .8
Fe2  .505    0 .983   .8
Fe3  .255 .125 .996   .8
Fe4  .755 .125 .996   .8
Fe5  .005 .246 .988   .8
Ti1  .008    0 .707   .8
Ti2  .508    0 .707   .8
Ti3  .006 .224 .274   .8
Si1  .232 .110 .242   .8
Si2  .732 .110 .242   .8
Si3  .284 .139 .748   .8
Si4  .784 .139 .748   .8
O1   .272    0 .277   .8
O2   .772    0 .277   .8
O3   .156 .124 .093   .8
O4   .393 .174 .310   .8
O5   .157 .132 .308   .8
O6   .656 .124 .093   .8
O7   .893 .174 .310   .8
O8   .657 .132 .308   .8
O9   .208  .25 .715   .8
O10  .123 .095 .677   .8
O11  .371 .124 .683   .8
O12  .364 .132 .895   .8
O13  .623 .095 .677   .8
O14  .871 .124 .683   .8
O15  .864 .132 .895   .8
O16  .104    0 .875   .8
O17  .604    0 .875   .8
O18  .392  .25 .113   .8
OH19 .901    0 .517   .8
OH20 .401    0 .517   .8
OH21 .147 .224 .472   .8
OH22 .392    0 .072   .8
OH23 .892    0 .072   .8
OH24 .115  .25 .913   .8