Oxy-schorl
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S
American Mineralogist 90 (2005) 1784-1792
Crystal chemistry of the elbaite-schorl series
Locality: Cruziero pegmatite, Minas Gerais, Brazil
Sample: L1v
_database_code_amcsd 0003960
15.9825 15.9825 7.1596 90 90 120 R3m
atom       x      y      z   occ   Uiso
CaX        0      0 .22594  .048  .0209
NaX        0      0 .22594  .647  .0209
KX         0      0 .22594  .010  .0209
TiY   .12452 .06226 .62843 .0107 .00786
AlY   .12452 .06226 .62843 .2883 .00786
Fe3+Y .12452 .06226 .62843 .2427 .00786
Fe2+Y .12452 .06226 .62843 .3623 .00786
MnY   .12452 .06226 .62843 .0107 .00786
MgY   .12452 .06226 .62843  .063 .00786
ZnY   .12452 .06226 .62843 .0087 .00786
LiY   .12452 .06226 .62843 .0133 .00786
AlZ   .29850 .26164 .61093 .9538  .0048
Fe3Z  .29850 .26164 .61093  .032  .0048
FeZ   .29850 .26164 .61093 .0038  .0048
MgZ   .29850 .26164 .61093 .0103  .0048
B     .11030 .22060 .45479        .0049
SiT   .19200 .18999      0 .9718 .00399
AlT   .19200 .18999      0 .0282 .00399
F1W        0      0 .78131  .201   .042
OH1W       0      0 .78131  .367   .042
O1         0      0 .78131  .432   .042
O2    .06154 .12308 .48544        .0145
O3V   .26866 .13433 .50964        .0109
O4    .09317 .18634 .06864        .0088
O5    .18676 .09338 .09128        .0089
O6    .19794 .18748 .77573        .0070
O7    .28533 .28579 .07946        .0064
O8    .20979 .27061 .44096        .0078
H3      .261  .1305   .394          .03