Na3SbS4*9H2O
Mereiter K, Preisinger A, Guth H, Heger G, Hiebl K, Mikenda W
Zeitschrift fur Kristallographie 150 (1979) 215-229
Hydrogen bonds in Schlippe's salt, Na3SbS4*9H2O and Na3SbS4*9D2O:
Diffraction and spectroscopic studies in the temperature range of
75K to 295 K
Note: sample at T = 105 K
_database_code_amcsd 0010815
11.878 11.878 11.878 90 90 90 P2_13
atom       x      y      z Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na1   .29175 .29175 .29175  .72  .0091  .0091  .0091      0      0      0
Na2   .44977 .44977 .44977  .66  .0083  .0083  .0083      0      0      0
Na3   .60484 .60484 .60484  .66  .0084  .0084  .0084      0      0      0
Sb    .03840 .03840 .03840  .52  .0066  .0066  .0066      0      0      0
S1    .92520 .92520 .92520  .79  .0100  .0100  .0100      0      0      0
S2    .15051 .15032 .92169  .58  .0042  .0101  .0078  .0009  .0015  .0004
O1   -.02558 .36670 .92586  .65  .0097  .0070  .0081  .0009  .0011 -.0010
O2    .18500 .69551 .99234  .74  .0091  .0095  .0095 -.0011  .0000 -.0026
O3    .10095 .25624 .33022  .82  .0083  .0093  .0137  .0012  .0007  .0006
D1    .02305 .30139 .92029 1.73  .0242  .0170  .0247  .0073  .0010 -.0036
D2   -.07450 .36616 .86074 1.54  .0208  .0216  .0160 -.0003 -.0055 -.0018
D3    .25285 .66112 .02037 1.81  .0185  .0247  .0255  .0033 -.0055 -.0005
D4    .16960 .75891 .04109 1.75  .0259  .0192  .0213  .0009  .0001 -.0057
D5    .04849 .22898 .27438 2.17  .0227  .0306  .0292 -.0043 -.0081  .0050
D6    .05965 .30799 .37455 2.84  .0363  .0207  .0509  .0055  .0206 -.0061