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: L1z
_database_code_amcsd 0003961
15.9842 15.9842 7.1581 90 90 120 R3m
atom       x      y      z   occ   Uiso
CaX        0      0 .22528  .071  .0203
NaX        0      0 .22528  .629  .0203
KX         0      0 .22528  .007  .0203
TiY   .12454 .06227 .62850 .0113 .00805
AlY   .12454 .06227 .62850 .3087 .00805
Fe3+Y .12454 .06227 .62850  .188 .00805
Fe2+Y .12454 .06227 .62850 .4093 .00805
MnY   .12454 .06227 .62850  .012 .00805
MgY   .12454 .06227 .62850 .0433 .00805
ZnY   .12454 .06227 .62850 .0103 .00805
LiY   .12454 .06227 .62850 .0167 .00805
AlZ   .29848 .26167 .61089 .9352  .0049
Fe3Z  .29848 .26167 .61089 .0158  .0049
FeZ   .29848 .26167 .61089 .0213  .0049
MgZ   .29848 .26167 .61089 .0277  .0049
B     .11022 .22044 .45450        .0054
SiT   .19198 .18997      0  .972 .00428
AlT   .19198 .18997      0  .028 .00428
F1W        0      0 .78150  .249   .040
OH1W       0      0 .78150  .321   .040
O1         0      0 .78150  .430   .040
O2    .06159 .12318 .48544        .0139
O3V   .26860 .13430 .50965        .0108
O4    .09318 .18636 .06852        .0088
O5    .18686 .09343 .09141        .0093
O6    .19789 .18751 .77579        .0070
O7    .28532 .28577 .07937        .0067
O8    .20975 .27057 .44099        .0080
H3      .259  .1295   .396          .07