Manganogrunerite
Reece J J, Redfern S A T, Welch M D, Henderson C M B, McCammon C A
Physics and Chemistry of Minerals 29 (2002) 562-570
Temperature-dependent Fe-Mn order-disorder behaviour in amphiboles
Sample: BM40798, T = 100 C
Locality: Langban, Sweden
_database_code_amcsd 0008723
9.63541 18.3403 5.34220 90 102.1312 90 C2/m
atom     x      y     z  occ Biso
MnM1     0  .0884    .5 .157  .30
FeM1     0  .0884    .5 .687  .30
MgM1     0  .0884    .5 .156  .30
MnM2     0  .1791     0 .180  .34
FeM2     0  .1791     0 .458  .34
MgM2     0  .1791     0 .362  .34
MnM3     0      0     0 .057 1.36
FeM3     0      0     0 .728 1.36
MgM3     0      0     0 .215 1.36
MnM4     0  .2500    .5 .584  2.6
CaM4     0  .2500    .5 .050  2.6
FeM4     0  .2500    .5 .366  2.6
SiT1 .2809  .0846 .2685 .953  .71
FeT1 .2809  .0846 .2685 .047  .71
SiT2 .3026  .1665 .7851       .53
H1   .2141      0  .728       7.2
O1   .1129  .0890 .2057       .76
O2   .1228  .1733 .7134       .61
O3   .1117      0 .7145       .25
O4   .3730  .2419 .7670       .90
O5   .3490 .12877 .0575       .91
O6   .3451  .1211 .5527       .94
O7   .3362      0 .2720      1.10