Cu4Bi4S9
Takeuchi Y, Ozawa T
Zeitschrift fur Kristallographie 141 (1975) 217-232
The structure of Cu4Bi4S9 and its relation to the structures of covellite,
CuS and bismuthinite, Bi2S3
_database_code_amcsd 0010774
11.589 32.05 3.951 90 90 90 Pbnm
atom      x      y   z Biso B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3) B(2,3)
Cu1   .3832  .1359 .75  3.2 .00537 .00098 .05672 -.00022      0      0
Cu2   .3363  .1911 .25  3.7 .00579 .00126 .06569 -.00062      0      0
Cu3   .4247  .3042 .25  3.2 .00610 .00082 .05304 -.00007      0      0
Cu4   .3936  .4827 .25  7.2 .02290 .00109 .12522  .00037      0      0
Bi1  .36697 .02775 .75  2.2 .00418 .00060 .03737  .00007      0      0
Bi2  .09953 .09028 .25  2.3 .00407 .00062 .03774 -.00005      0      0
Bi3  .13895 .27871 .25  2.1 .00387 .00056 .03496  .00003      0      0
Bi4  .23286 .39072 .75  2.1 .00404 .00055 .03538  .00010      0      0
S1    .1327  .0205 .75  1.8 .00347 .00045 .03039 -.00018      0      0
S2    .3254  .0987 .25  1.2 .00233 .00032 .02069  .00022      0      0
S3    .0926  .1543 .75  1.7 .00310 .00046 .02669  .00004      0      0
S4    .2424  .1909 .75  1.3 .00221 .00037 .02268 -.00018      0      0
S5    .4851  .2351 .25  1.3 .00279 .00033 .02390 -.00021      0      0
S6    .3158  .3143 .75  1.4 .00306 .00032 .02389 -.00003      0      0
S7    .0747  .3564 .25  1.8 .00282 .00058 .03278  .00037      0      0
S8    .3882  .4125 .25  1.3 .00162 .00055 .02477  .00023      0      0
S9    .1195  .4708 .25  1.5 .00134 .00078 .02953 -.00021      0      0