Destinezite
Peacor D R, Rouse R C, Coskren T D, Essene E J
Clays and Clay Minerals 47 (1999) 1-11
Destinezite ("diadochite"), Fe2(PO4)(SO4)(OH)*6(H2O):
its crystal structure and role as a soil mineral at Alum Cave Bluff,Tennessee
Locality: Alum Cave Bluff, Tennessee, USA
_database_code_amcsd 0012239
9.570 9.716 7.313 98.74 107.90 63.86 P-1
atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
FeM1 .8951 .3128 .8005 .906 .97 .0125 .0148 .0115 -.0075 .0025 .0009
AlM1 .8951 .3128 .8005 .094 .97 .0125 .0148 .0115 -.0075 .0025 .0009
FeM2 .2380 .2948 .6822 .8665 .91 .0110 .0123 .0115 -.0048 .0028 .0014
AlM2 .2380 .2948 .6822 .1335 .91 .0110 .0123 .0115 -.0048 .0028 .0014
P .0544 .3842 .2426 .94 .0128 .0119 .0100 -.0044 .0025 .0015
S .7016 .2353 .3769 1.35 .0185 .0169 .0174 -.0085 .0074 -.0045
O2 .7363 .3479 .5281 1.6 .021 .021 .018 -.011 -.001 .005
Oh7 .0866 .2194 .7057 1.4 .022 .016 .021 -.010 .011 -.005
Ow1 .3408 .2869 .9787 1.9 .017 .029 .024 -.009 .003 .002
O3 .0260 .2823 .0691 1.4 .021 .013 .017 -.004 .006 -.002
Ow4 .4052 .3673 .6493 1.6 .023 .015 .023 -.009 .009 -.003
Ow5 .9092 .0942 .7935 1.8 .026 .016 .030 -.009 .011 .000
O6 .1673 .2773 .4078 1.4 .018 .015 .013 .000 .003 .003
O8 .8625 .5246 .7987 1.6 .019 .020 .022 -.009 .006 .003
O9 .1041 .5077 .7138 1.5 .018 .019 .019 -.007 .007 .000
Ow10 .6937 .3772 .8963 1.6 .021 .025 .021 -.015 .011 -.002
Ow11 .7226 .0121 .9289 2.5 .030 .024 .037 -.009 .009 -.002
O12 .6188 .3181 .1953 2.3 .033 .046 .018 -.026 -.001 .008
Ow13 .4221 .0824 .6852 1.9 .021 .016 .028 -.006 .000 .001
O14 .4044 .8136 .5710 2.0 .032 .022 .033 -.019 .013 -.004
O15 .1490 .8936 .6358 3.3 .028 .040 .048 -.001 .022 -.009
H1 .4186 .3127 .0234 4.7
H2 .2500 .3610 .0014 4.7
H3 .3625 .4384 .5725 4.7
H4 .4548 .3114 .5731 4.7
H5 .0181 .9930 .2502 4.7
H6 .1648 .9375 .2017 4.7
H7 .0931 .1308 .6328 4.7
H8 .3334 .6197 .9963 4.7
H9 .2869 .5306 .1136 4.7
H10 .2969 .9115 .9752 4.7
H11 .2316 .0852 .0617 4.7
H12 .4766 .9426 .2518 4.7
H13 .4142 .9896 .6657 4.7