Whitlockite Tait K T, Barkley M C, Thompson R M, Origlieri M J, Evans S H, Prewitt C T, Yang H The Canadian Mineralogist 49 (2011) 1065-1078 Bobdownsite, a new mineral species from Big Fish River, Yukon, Canada, and its structural relationship with whitlockite-type compounds Locality: Palermo #1 quarry, New Hampshire, USA _database_code_amcsd 0018920 10.3590 10.3590 37.0857 90 90 120 R3c atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Ca1 .29278 .15662 .67220 .02062 .03638 .01881 .01595 .02075 -.01259 -.00863 Ca2 .28035 .14623 .56520 .00930 .01040 .00952 .00875 .00556 -.00041 -.00112 Ca3 .38769 .18008 .76765 .00975 .01074 .00889 .00949 .00482 -.00238 -.00091 Mg 0 0 -.00028 .62 .00842 .00824 .00824 .00880 .00412 0 0 Fe 0 0 -.00028 .35 .00842 .00824 .00824 .00880 .00412 0 0 Mn 0 0 -.00028 .02 .00842 .00824 .00824 .00880 .00412 0 0 Al 0 0 -.00028 .02 .00842 .00824 .00824 .00880 .00412 0 0 P1A 0 0 .75326 .85 .01108 .00742 .00742 .01842 .00371 0 0 P1B 0 0 .73176 .15 .00001 .00001 .00001 .00001 .00000 0 0 P2 .31690 .14343 .86428 .00802 .00854 .00890 .00737 .00493 .00116 .00122 P3 .35083 .15788 .96718 .00818 .00864 .00901 .00704 .00453 .00001 .00041 O1 .27579 .09357 .82513 .01713 .02506 .02073 .00765 .01299 .00020 -.00054 O2 .24620 .23279 .87771 .01379 .01576 .01741 .01485 .01328 .00271 .00169 O3 .27237 .00161 .88627 .01107 .01098 .00806 .01155 .00280 .00214 .00168 O4 .48768 .24153 .86884 .01190 .00960 .00745 .01702 .00306 .00308 .00117 O5 .40292 .19613 .00664 .01408 .02107 .01642 .00747 .01140 -.00222 -.00219 O6 .39991 .04894 .95358 .01285 .01482 .01564 .01260 .01099 -.00076 -.00297 O7 .41667 .30451 .94644 .01458 .01473 .01139 .01331 .00330 .00211 .00459 O8 .17933 .07942 .96326 .01118 .00748 .00978 .01400 .00260 .00045 -.00039 OH9 0 0 .79758 .85 .03592 .03017 .03017 .04742 .01508 0 0 OH9B 0 0 .68932 .15 .02042 .01484 .01484 .03158 .00742 0 0 O10 -.01931 .12946 .74202 .01738 .01831 .00950 .02690 .00887 .00857 .00398