Villamaninite
Marcos C, Paniagua A, Moreiras D B, Garcia-Granda S, Diaz M R
Acta Crystallographica B52 (1996) 899-904
Villamaninite, a case of noncubic pyrite-type structure
Locality: Villamanin, Leon, Spain
Sample: 2
Note: anisoU's from ICSD
_database_code_amcsd 0009900
5.704 5.703 5.704 90 89.99 90 P2_1
atom     x     y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CuM1 .7475  .100 .4975 .53 .0095  .0096  .0098  .0091  .0004 -.0001  .0009
NiM1 .7475  .100 .4975 .27 .0095  .0096  .0098  .0091  .0004 -.0001  .0009
CoM1 .7475  .100 .4975 .13 .0095  .0096  .0098  .0091  .0004 -.0001  .0009
FeM1 .7475  .100 .4975 .07 .0095  .0096  .0098  .0091  .0004 -.0001  .0009
CuM2 .2483  .103 .0019 .53 .0093  .0091  .0094  .0096 -.0002 -.0010  .0002
NiM2 .2483  .103 .0019 .27 .0093  .0091  .0094  .0096 -.0002 -.0010  .0002
CoM2 .2483  .103 .0019 .13 .0093  .0091  .0094  .0096 -.0002 -.0010  .0002
FeM2 .2483  .103 .0019 .07 .0093  .0091  .0094  .0096 -.0002 -.0010  .0002
S1    .853 -.002  .106      .011   .009   .013   .012   .005  -.003   .001
S2    .137 -.007  .606      .010   .005   .013   .012  -.002   .004  -.001
S3    .644  .208  .896      .007   .009   .007   .005  -.001  -.001   .002
S4   .3471  .204  .397     .0059   .007   .005   .006  -.003   .000   .003