Carnallite Schlemper E O, Sen Gupta P K, Zoltai T American Mineralogist 70 (1985) 1309-1313 Refinement of the structure of carnallite, Mg(H2O)6KCl3 _database_code_amcsd 0001005 16.119 22.472 9.551 90 90 90 Pnna atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) K1 .25 0 .2486 3.46 .00329 .00181 .00901 -.00006 0 0 K2 .08860 .15668 .74995 3.29 .00350 .00146 .00893 .00004 -.00014 .00012 Mg1 .25657 .25 .25 1.87 .00179 .00107 .00433 0 0 -.00009 Mg2 .42094 .08981 .74770 1.89 .00182 .00110 .00416 -.00000 -.00022 -.00008 Cl1 .23939 .25 .75 2.82 .00265 .00166 .00638 0 0 -.00052 Cl2 .16583 .07525 .98526 2.86 .00282 .00152 .00704 -.00034 .00035 -.00045 Cl3 .16928 .08113 .48834 2.89 .00283 .00158 .00690 -.00027 -.00063 .00045 Cl4 .41462 .08176 .25235 3.04 .00347 .00158 .00627 .00026 -.00065 -.00048 Cl5 .01987 .24957 .97686 2.94 .00260 .00193 .00608 -.00000 -.00037 .00025 O1 .1308 .25 .25 3.54 .00183 .00326 .00575 0 0 .00023 O2 .3834 .25 .25 3.15 .00163 .00267 .00630 0 0 -.00034 O3 .2554 .20704 .4384 3.13 .00443 .00149 .00479 -.00038 .00006 .00017 O4 .2673 .16936 .1506 3.57 .00321 .00156 .01156 .00042 -.00209 -.00177 O5 .4466 .01041 .6500 3.39 .00318 .00145 .01079 .00046 -.00185 -.00166 O6 .2967 .07117 .7349 3.41 .00200 .00282 .00679 -.00041 -.00021 -.00014 O7 .4259 .04662 .9354 3.26 .00469 .00155 .00479 -.00058 -.00053 .00012 O8 .3956 .16912 .8444 3.62 .00289 .00159 .01268 .00044 -.00212 -.00174 O9 .5448 .10769 .7631 3.32 .00205 .00277 .00622 -.00004 -.00030 .00019 O10 .4179 .13155 .5580 3.48 .00510 .00152 .00567 -.00040 -.00073 .00034 H1 .604 .250 .679 4.1 H2 .412 .251 .313 4.6 H13 .737 .173 .543 4.3 H23 .250 .222 .505 4.3 H14 .734 .348 .587 4.4 H24 .303 .345 .335 3.9 H15 .514 .009 .326 5.1 H25 .417 .994 .606 3.2 H16 .768 .072 .345 5.5 H26 .264 .434 .682 9 H17 .399 .490 .568 7.2 H27 .422 .442 .500 2.9 H18 .359 .317 .673 3.5 H28 .429 .311 .623 4.3 H19 .565 .401 .679 2.9 H29 .573 .104 .695 5.3 H110 .438 .160 .561 4.7 H210 .411 .115 .475 8