Roxbyite Mumme W G, Gable R W, Petricek V The Canadian Mineralogist 50 (2012) 423-430 The crystal structure of roxbyite, Cu58S32 Locality: Olympic Dam, Roxby Downs, Australia _database_code_amcsd 0019199 13.4090 13.4051 15.4852 90.022 90.021 90.020 P-1 atom x y z Uiso Cu1 .0328 .1474 .3739 .0213 Cu2 .0225 -.4368 .8817 .0262 Cu3 .0332 .3117 .9668 .028 Cu4 .0377 -.6735 .4932 .0274 Cu5 .0398 .3203 .2612 .0204 Cu6 .0306 .3211 .7703 .0175 Cu7 .0338 .1377 .8773 .0195 Cu8 .0242 -.4295 .3645 .031 Cu9 .0467 .1038 .1297 .0180 Cu10 .0394 -.8931 .6241 .0194 Cu11 .1406 -.2565 .6229 .028 Cu12 .1067 .9937 .9990 .028 Cu13 .1180 -.5059 .7365 .034 Cu14 .1319 -.5078 .0100 .036 Cu15 .1444 -.2548 .1285 .025 Cu16 .1288 -.0048 .2509 .0195 Cu17 .1112 .9946 .7519 .019 Cu18 .1196 -.2543 .8722 .021 Cu19 .1055 -.0052 .5010 .032 Cu20 .2153 .3053 .7139 .034 Cu21 .2231 -.6203 .4746 .0258 Cu22 .2139 -.1957 .4665 .039 Cu23 .2114 -.4469 .1668 .029 Cu24 .2190 -.8986 .3772 .046 Cu25 .2120 -.1930 .2839 .031 Cu26 .2219 .3066 .0359 .041 Cu27 .2349 .3745 .2912 .0329 Cu28 .2176 -.4398 .3797 .036 Cu29 .2090 .5529 .5797 .037 Cu30 .2934 .6941 .9688 .034 Cu31 .2853 -.5775 .8785 .045 Cu32 .2904 -.3062 .7823 .037 Cu33 .2862 -.7983 .2086 .032 Cu34 .2804 -.8019 .5386 .031 Cu35 .2949 -.0535 .0856 .0260 Cu36 .2693 .1278 -.0383 .048 Cu37 .2735 .8795 .2252 .039 Cu38 .2906 -.0526 -.3323 .035 Cu39 .2860 -.0575 -.1287 .074 Cu40 .3674 -.2399 .6282 .0150 Cu41 .3703 -.2396 .1226 .024 Cu42 .3836 -.2442 .3745 .030 Cu43 .3738 -.4994 .0060 .029 Cu44 .3920 -.4949 .2511 .028 Cu45 .3887 .5042 .5009 .028 Cu46 .3856 .5043 .7513 .025 Cu47 .3736 .0091 .5079 .026 Cu48 .3672 .0091 .2397 .0236 Cu49 .4651 -.8156 .9696 .0303 Cu50 .4706 .1860 .2827 .0288 Cu51 .4562 .1793 .7502 .0300 Cu52 .4679 -.8064 .4590 .0156 Cu53 .4681 -.0872 .8646 .0108 Cu54 .4711 -.0761 .3660 .0253 Cu55 .4630 .3803 .3737 .0258 Cu56 .4510 -.6307 .6290 .0322 Cu57 .4662 .3746 .8686 .036 Cu58 .4598 -.6304 .1217 .0320 S1 .1217 .1669 .0075 .017 S2 .3718 .5873 .6277 .008 S3 .1208 .4183 .8745 .003 S4 .3611 .1012 .1170 .0014 S5 .1226 .9073 .8717 .010 S6 .3871 .0783 .3744 .024 S7 .3730 -.4111 .1283 .005 S8 .1252 -.0932 .3729 .008 S9 .3611 .1013 .6268 .0067 S10 .3725 -.1622 .2518 .008 S11 .3716 .5823 .8689 .020 S12 .1416 -.5887 .1380 .023 S13 .1134 .1703 .7437 .010 S14 .3983 .0801 .8731 .024 S15 .3672 -.1627 .7594 .005 S16 .3832 .5819 .3685 .019 S17 .1384 .4126 .6098 .021 S18 .3693 .1573 .0066 .017 S19 .3833 .3380 .4953 .016 S20 .3818 .3369 .9935 .018 S21 .1239 .1713 .2464 .006 S22 .3731 .8446 .4987 .011 S23 .1322 -.3378 .2582 .013 S24 .1241 .1645 .5033 .027 S25 .3845 .3310 .2525 .008 S26 .1311 -.0928 -.3710 .024 S27 .3693 .3348 .7550 .005 S28 .1294 .6539 .4985 .025 S29 .1136 -.5836 .3740 .008 S30 .1281 .6621 .7485 .022 S31 .1362 .9078 .1293 .020 S32 .1316 -.3410 .0042 .016