Wittichenite
Kocman V, Nuffield E W
Acta Crystallographica B29 (1973) 2528-2535
The crystal structure of wittichenite, Cu3BiS3
Locality: Daniel Mine, Wittichen, Baden, Germany
_database_code_amcsd 0009490
7.723 10.395 6.716 90 90 90 P2_12_12_1
atom       x       y       z Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Cu1   .35179  .40167  .13762 2.10 .00852 .00689 .01069  .00346  .00022  .00041
Cu2   .19037  .10470  .07838 2.75 .02433 .00720 .00914  .00590  .00312  .00234
Cu3   .05727  .46445 -.02628 1.87 .00403 .00487 .01552  .00066  .00257 -.00036
Bi    .19716 -.24401  .12860 1.24 .00230 .00314 .00856 -.00020  .00033 -.00002
S1   -.44584  .24619  .10918 1.32 .00433 .00364 .00705  .00008 -.00164  .00025
S2   -.31767  .43669 -.40779 1.47 .00325 .00338 .00752  .00052  .00008 -.00036
S3   -.32136  .06949 -.41380 1.49 .00370 .00276 .00626  .00023  .00002 -.00078