Rathite Engel P, Nowacki W Zeitschrift fur Kristallographie 131 (1970) 356-375 Die kristallstruktur von rathit-II [As25 S56|PbVII6.5 PBIX12] Locality: Lengenbach, Binnatal, Switzerland _database_code_amcsd 0010712 8.371 70.49 7.914 90 90.133 90 P2_1 atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) Pb1 .13554 .99870 .21267 .00998 .00021 .01770 .00047 .00574 .00050 Pb2 .63182 .99939 .20697 .00681 .00016 .01149 .00000 -.00100 -.00002 Pb3 .11552 .96622 .71726 .00994 .00023 .01731 .00050 -.00496 -.00062 Pb4 .62092 .96560 .70593 .00725 .00017 .01080 .00008 .00125 .00007 Pb5 .14054 .04605 .86370 .00910 .00016 .01604 -.00010 -.00065 .00013 Pb6 .90667 .06132 .34847 .75 .00714 .00016 .00979 -.00009 .00029 -.00015 Pb7 .39434 .10004 .00506 .00645 .00010 .00997 -.00007 .00185 -.00011 Pb8 .36401 .14791 .68004 .00920 .00015 .01504 -.00029 -.00440 .00037 Pb9 .87004 .14731 .65736 .00631 .00013 .00910 -.00007 .00056 .00000 Pb10 .37090 .18083 .16632 .00727 .00016 .01618 -.00014 .00387 -.00044 Pb11 .86535 .18065 .16593 .00622 .00013 .01009 -.00010 -.00100 -.00003 Pb12 .34883 .22623 .51024 .00658 .00010 .00755 -.00013 -.00072 .00002 Pb13 .10298 .28494 .35043 .00840 .00018 .01441 .00031 -.00302 -.00027 Pb14 .61251 .28325 .32799 .00626 .00014 .01479 -.00020 .00190 -.00005 Pb15 .11268 .31385 .83312 .00733 .00011 .01303 .00015 .00310 .00023 Pb16 .61231 .31639 .84751 .00587 .00014 .00931 -.00003 -.00025 .00012 Pb17 .14801 .36505 .50129 .00580 .00011 .00886 .00010 -.00098 -.00003 Pb18 .65297 .40321 .15803 .75 .00547 .00010 .00710 .00014 .00036 .00007 Pb19 .89127 .41937 .63697 .00881 .00014 .01336 .00013 .00071 .00005 As1 .43689 .01897 .64064 .00619 .00016 .00667 -.00006 .00090 -.00023 As2 .88474 .01523 .62114 .00432 .00013 .01034 .00002 .00024 -.00001 As3 .37518 .05150 .30960 .00845 .00010 .01281 .00024 .00232 .00036 As4 .94311 .05391 .30961 .25 3.01 As5 .67066 .05002 .93942 .01327 .00012 .02047 .00095 .00476 .00029 As6a .89249 .09168 .97540 .5 3.24 As6b .92119 .09603 .94204 .5 2.33 As7 .20349 .09101 .57092 .00496 .00021 .00562 -.00020 -.00082 -.00017 As8 .61732 .09647 .57672 .00349 .00012 .00848 -.00002 -.00004 .00009 As9 .12863 .13208 .25499 .00433 .00009 .00723 .00004 -.00026 .00005 As10 .68850 .12836 .22977 .00437 .00011 .00733 -.00008 .00002 -.00007 Asl1 .06493 .19920 .73235 .00570 .00008 .00748 .00003 .00035 .00008 As12 .61748 .19563 .74424 .00415 .00007 .00928 -.00006 .00033 .00002 As13 .13223 .23082 .07062 .00523 .00006 .00697 -.00006 .00070 -.00006 As14 .56491 .23550 .08231 .01244 .00012 .01095 .00050 .00432 .00043 As15 .86587 .23633 .44308 .00505 .00009 .00882 .00017 .00017 .00015 As16 .36026 .27047 .77240 .00472 .00005 .01058 .00000 .00022 -.00025 As17 .83431 .26679 .77879 .01509 .00009 .00666 .00054 .00466 .00017 As18 .43324 .33839 .27868 .00346 .00012 .00667 .00009 .00157 -.00016 As19 .87208 .33443 .25038 .00445 .00009 .00810 -.00005 .00016 .00008 As20 .36487 .37000 .92834 .00498 .00009 .00783 -.00001 .00038 .00005 As21 .95422 .37709 .93289 .00608 .00018 .00713 .00022 .00051 -.00018 As22 .66858 .37151 .55690 .00912 .00017 .00995 .00076 .00604 .00052 As23a .43902 .41456 .56570 .5 1.92 As23b .41118 .41702 .54034 .5 2.15 As24 .12134 .41578 .18893 .00532 .00011 .01038 -.00003 -.00127 .00017 As25 .18338 .44799 .86002 .00547 .00012 .00611 .00000 -.00112 -.00015 As26 .62938 .45197 .87804 .00486 .00011 .00926 -.00007 -.00003 .00011 S1 .07675 .00648 .79486 2.18 S2 .66366 .00838 .78727 1.84 S3 .16655 .03701 .43804 2.13 S4 .58237 .03707 .45965 2.09 S5 .39122 .03239 .08183 3.06 S6 .86436 .03455 .10488 2.47 S7 .36749 .07327 .72631 2.32 S8 .87997 .07019 .75052 3.60 S9 .10287 .07825 .11643 2.71 S10 .66190 .07539 .12426 2.51 S11 .40016 .10843 .43098 2.27 S12 .82672 .11041 .41685 1.42 S13 .13139 .11324 .76027 2.43 S14 .62508 .11741 .78892 1.82 S15 .32041 .14006 .07845 1.79 S16 .90965 .13927 .07948 2.20 S17 .12045 .15812 .41293 1.58 S18 .63861 .15406 .38327 2.04 S19 .10954 .17309 .88858 1.42 S20 .62308 .17009 .91248 1.91 S21 .42571 .18604 .57218 1.49 S22 .84028 .18853 .58021 1.40 S23 .12859 .20913 .28572 1.90 S24 .60966 .21121 .26146 1.85 S25 .33726 .21825 .91846 2.25 S26 .91923 .21653 .91651 1.76 S27 .07042 .25133 .57638 2.09 S28 .66856 .25038 .60062 1.75 S29 .39767 .25289 .24217 1.53 S30 .84502 .25515 .21437 2.18 S31 .16492 .27840 .94410 2.03 S32 .58727 .27827 .92995 1.43 S33 .36172 .29613 .60116 2.01 S34 .86025 .29366 .62600 1.71 S35 .38344 .31245 .11850 1.65 S36 .86429 .30715 .09782 1.74 S37 .06603 .32658 .42640 2.13 S38 .65401 .32814 .42704 2.02 S39 .37236 .34896 .71998 2.00 S40 .87032 .35463 .74185 2.45 S41 .14312 .35889 .07451 2.05 S42 .56943 .35619 .08966 1.72 S43 .11924 .39411 .77238 2.17 S44 .62712 .39677 .75208 2.94 S45 .39813 .39161 .37347 2.16 S46 .85862 .38853 .38691 2.49 S47 .14203 .43533 .42148 2.96 S48 .61096 .43272 .39589 1.90 S49 .32912 .42974 .04343 1.63 S50 .90992 .42952 .06502 1.81 S51 .40320 .45901 .71096 1.70 S52 .81918 .46103 .70431 2.13 S53 .13864 .47362 .01178 1.95 S54 .61963 .47769 .04419 2.08 S55 .60541 .49310 .51452 1.90 S56 .12065 .48965 .54350 2.00