Mumme W G, Watts J A
The Canadian Mineralogist 14 (1976) 322-333
Pekoite, CuPbBi11S18, a new member of the bismuthinite-alkinite mineral series:
its crystal structure and relationship with naturally- and synthetically-formed members
Note: x-coordinate of S18 changed in order to generate reported bond lengths.
_database_code_amcsd 0005123
11.472 33.744 4.016 90 90 90 P2_1am
atom x y z occ Biso
BiM1 .4685 .9752 .5 .81
BiM2 .3368 .0710 0 1.92
BiM3 .0191 .1408 0 1.56
BiM4 .4891 .3077 .5 4.00
BiM5 .3430 .4060 0 5.90
BiM6 .1582 .2389 .5 1.50
BiM7 .1535 .9049 .5 .24
BiM8 .0255 .8082 0 2.80
BiM9 .4868 .6411 .5 1.74
BiM10 .1718 .5717 .5 1.93
BiM11 .0098 .4748 0 1.20
BiM12 .3326 .7521 0 .3 3.00
PbM12 .3326 .7521 0 .7 3.00
Cu .2455 .6525 0 .7 5.00
S1 .2754 .0179 .5 .83 1.05
Se1 .2754 .0179 .5 .17 1.05
S2 .1150 .1018 .5 .83 2.15
Se2 .1150 .1018 .5 .17 2.15
S3 .0500 .2958 0 .83 1.65
Se3 .0500 .2958 0 .17 1.65
S4 .0454 .9600 0 .83 2.00
Se4 .0454 .9600 0 .17 2.00
S5 .4546 .1291 .5 .83 1.35
Se5 .4546 .1291 .5 .17 1.35
S6 .3700 .9370 0 .83 1.80
Se6 .3700 .9370 0 .17 1.80
S7 .2854 .3515 .5 .83 2.15
Se7 .2854 .3515 .5 .17 2.15
S8 .3705 .2684 0 .83 .95
Se8 .3705 .2684 0 .17 .95
S9 .2200 .1849 0 .83 1.06
Se9 .2200 .1849 0 .17 1.06
S10 .2056 .5179 0 .83 1.85
Se10 .2056 .5179 0 .17 1.85
S11 .3795 .6018 0 .83 2.14
Se11 .3795 .6018 0 .17 2.14
S12 .4549 .7958 .5 .83 1.44
Se12 .4549 .7958 .5 .17 1.44
S13 .4546 .4624 .5 .83 1.85
Se13 .4546 .4624 .5 .17 1.85
S14 .0550 .6291 0 .83 1.65
Se14 .0550 .6291 0 .17 1.65
S15 .1205 .4351 .5 .83 .85
Se15 .1205 .4351 .5 .17 .85
S16 .2146 .8520 0 .83 1.05
Se16 .2146 .8520 0 .17 1.05
S17 .1205 .7684 .5 .83 1.15
Se17 .1205 .7684 .5 .17 1.15
S18 .2854 .6849 .5 .83 2.56
Se18 .2854 .6849 .5 .17 2.56
Makovicky E, Mumme W G, Watts J A
The Canadian Mineralogist 15 (1977) 339-348
The crystal structure of synthetic pavonite, AgBi3S5, and
the definition of the pavonite homologous series
_database_code_amcsd 0005141
13.305 4.042 16.417 90 94.02 90 C2/m
atom x y z Biso
Bi1 .2369 .5 .1110 1.85
Bi2 .4722 0 .2169 2.07
Bi3 .2192 0 .3891 2.17
Ag1 0 0 0 2.51
Ag2 0 .5 .5 2.43
S1 .3688 0 .0534 1.20
S2 .0979 0 .1479 2.20
S3 .3386 .5 .2612 .99
S4 .0772 .5 .3603 1.38
S5 .3439 .5 .4664 1.50
Acta Crystallographica B36 (1980) 1300-1304
HgBi2S4: Crystal structure and relationship with the pavonite homologous series
Locality: synthetic
_database_code_amcsd 0009710
14.17 4.06 13.99 90 118.27 90 C2/m
Hg1 0 0 0 2.3
Hg2 0 0 .5 2.4
Bi1 .2260 0 .3679 1.8
Bi2 .3499 0 .1379 1.7
S1 .1859 .5 .0648 1.3
S2 .4991 .5 .1701 .8
S3 .1244 .5 .4280 1.0
S4 .3432 .5 .3243 2.4
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