Organova N I, Drits V A, Dmitrik A L
Soviet Physics - Crystallography 17 (1973) 667-671
Structural study of tochilinite. Part I. The isometric variety
Note: M-site reported bond lengths are inconsistent with reported structure
_database_code_amcsd 0015560
5.37 15.65 10.72 90 95 90 C1
atom x y z occ
Fe1 0 0 0
Fe2 .0117 .1656 0
Fe3 .4801 .1647 0
Fe4 .4864 0 0
Fe5 .5117 .3344 0
Fe6 .9801 .3353 0
MgM1 .1701 .1001 .5 .71
FeM1 .1701 .1001 .5 .29
MgM2 .6617 0 .5 .71
FeM2 .6617 0 .5 .29
MgM3 .658 .1985 .5 .71
FeM3 .658 .1985 .5 .29
MgM4 .6701 .3999 .5 .71
FeM4 .6701 .3999 .5 .29
MgM5 .158 .3015 .5 .71
FeM5 .158 .3015 .5 .29
S1 .260 .088 .129
S2 .741 .080 -.129
S3 .237 .243 -.129
S4 .737 .257 .129
S5 .241 .420 .129
S6 .760 .412 -.129
OH1 .027 0 .598
OH2 .008 .208 .598
OH3 .362 0 .402
OH4 .299 .196 .402
OH5 .466 .095 .598
OH6 .838 .102 .402
OH7 .508 .292 .598
OH8 .996 .405 .598
OH9 .799 .304 .402
OH10 .338 .398 .402
Soviet Physics - Crystallography 18 (1974) 606-609
Structural study of tochilinite. II. Acicular variety: Unusual diffraction patterns
Note: sulfide layer portion of structure only
Note: corrections to Fe5 from ICSD
_database_code_amcsd 0015564
8.34 8.54 10.74 87.33 94.5 92 P1
atom x y z Biso
Fe1 .29 .092 0 .2
Fe2 .582 .206 0 .2
Fe3 .906 .287 0 .2
Fe4 .226 .411 0 .2
Fe5 .710 .908 0 .2
Fe6 .418 .794 0 .2
Fe7 .094 .713 0 .2
Fe8 .774 .589 0 .2
S1 .5 0 .129 .2
S2 .790 .107 -.129 .2
S3 .093 .201 .129 .2
S4 .386 .307 -.129 .2
S5 .692 .387 .129 .2
S6 0 .5 -.129 .2
S7 .210 .893 -.129 .2
S8 .907 .799 .129 .2
S9 .614 .693 -.129 .2
S10 .308 .611 .129 .2
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