Frondelite
Redhammer G J, Roth G, Tippelt G, Bernroider M,
Lottermoser W, Amthauer G, Hochleitner R
Acta Crystallographica C62 (2006) i24-i28
Manganoan rockbridgeite Fe4.32Mn0.62Zn0.06(PO4)3(OH)5:
structure analysis and 57Fe Mossbauer spectroscopy
Locality: Hagendorf pegmatite, Bavaria, Germany
_database_code_amcsd 0017679
5.1761 13.9774 16.8689 90 90 90 Cmcm
atom     x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe1      0      0      0     .0113  .0125  .0104  .0110   .000   .000 -.0003
Fe2      0 .06813 .15645 .66 .0165  .0240  .0134  .0122   .000   .000 -.0003
Mn2      0 .06813 .15645 .31 .0165  .0240  .0134  .0122   .000   .000 -.0003
Zn2      0 .06813 .15645 .03 .0165  .0240  .0134  .0122   .000   .000 -.0003
Fe3  .2305 .32125 .13886 .50 .0093  .0109  .0092  .0077  .0020 -.0002 -.0009
P1      .5 .14322 .04337     .0098  .0143  .0083  .0068   .000   .000 -.0008
P2       0 .48232    .25     .0120  .0160  .0104  .0095   .000   .000   .000
O1   .2438  .5456    .25     .0209   .026   .020   .017  -.009   .000   .000
O2   .2572  .0811 .05719     .0143  .0134  .0141  .0154 -.0046 -.0011 -.0032
Oh3  .3793  .3127  .2500 .50 .0140   .014   .018   .009   .004   .000   .000
O4      .5  .1822 -.0401     .0229   .043   .016   .009   .000   .000  .0026
OH5      0  .2175  .1760     .0215   .041   .013   .010   .000   .000  .0015
Oh6     .5  .4233  .1045     .0136   .016   .009   .016   .000   .000  .0014
O7       0  .4204  .1748     .0159   .022   .017  .0089   .000   .000 -.0020
O8      .5  .2220  .1068     .0115   .014   .010   .011   .000   .000 -.0017
H3      .5   .243  .2500       .05
H6      .5  .4045  .0650       .07