Szenicsite
Stolz J, Armbruster T
Neues Jahrbuch fur Mineralogie, Monatshefte 1998 (1998) 278-288
X-ray single-crystal structure refinement of szenicsite, Cu3MoO4(OH)4,
and its relation to the structure of antlerite, Cu3SO4(OH)4
Locality: Jardinera No. 1, Inca de Oro, Atacama, Chile
_database_code_amcsd 0014897
12.559 8.518 6.072 90 90 90 Pnnm
atom      x      y      z  Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu1  .36739 .23160 .24939  1.44  .0168  .0196  .0185 -.0012  .0006  .0003
Cu2      .5     .5     .5  1.47  .0173  .0217  .0167 -.0027      0      0
Cu3      .5     .5      0  1.52  .0177  .0230  .0170 -.0030      0      0
Mo   .13090 .37588      0 1.333  .0145  .0178  .0183  .0008      0      0
O4    .2314  .2332      0  1.92   .018   .027   .027   .002      0      0
O5    .1423  .4915  .2377  2.02   .031   .022   .024   .003  -.001   .000
O6    .0077  .2775      0  2.05   .022   .027   .029  -.001      0      0
O1    .4626  .2267      0  1.55   .018   .022   .019   .000      0      0
H1     .506   .126      0   5.1
O2    .2751  .2423     .5  1.65   .016   .027   .020   .004      0      0
H2     .256   .347     .5   4.7
O3    .3992  .4711  .2505  1.57   .017   .022   .020   .000  -.001   .000
H3     .336   .533    .26   4.9