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 = 500 C
Locality: Langban, Sweden
_database_code_amcsd 0008729
9.68020 18.3852 5.34547 90 101.9161 90 C2/m
atom     x     y     z  occ Biso
MnM1     0 .0880    .5 .198 1.30
FeM1     0 .0880    .5 .651 1.30
MgM1     0 .0880    .5 .151 1.30
MnM2     0 .1793     0 .225  .47
FeM2     0 .1793     0 .397  .47
MgM2     0 .1793     0 .378  .47
MnM3     0     0     0 .114 2.75
FeM3     0     0     0 .692 2.75
MgM3     0     0     0 .194 2.75
MnM4     0 .2570    .5 .469  4.6
CaM4     0 .2570    .5 .050  4.6
FeM4     0 .2570    .5 .481  4.6
SiT1 .2813 .0841 .2669 .953 1.14
FeT1 .2813 .0841 .2669 .047 1.14
SiT2 .3010 .1659 .7849      1.04
H1   .1988     0  .706      11.8
O1   .1126 .0883 .2090      1.49
O2   .1241 .1737 .7099      1.44
O3   .1148     0 .7146      1.37
O4   .3762 .2404 .7670      1.80
O5   .3465 .1272 .0543      1.84
O6   .3471 .1208 .5529      1.79
O7   .3345     0 .2691      1.71