Hopeite
Herschke L, Enkelmann V, Lieberwirth I, Wenger G
Chemistry - A European Journal 10 (2004) 2795-2803
The role of hydrogen bonding in the crystal structures of zinc phosphate hydrates
Note: beta-hopeite
Locality: synthetic
_database_code_amcsd 0019556
5.0266 10.6060 18.2946 90 90 90 Pbnm
atom      x      y        z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Zn1  .20746 .35707  -.00075 .0133  .0130  .0146  .0123 -.0005 -.0007 .00042
Zn2  .42690 .73637     -.25 .0158  .0155  .0157  .0161 -.0012      0      0
P1    .2747 .60280  -.09423 .0124  .0130  .0171  .0071 -.0003 -.0007 -.0010
O1    .1438  .4748  -.07816 .0213   .036  .0153  .0122 -.0028 -.0049  .0006
O2    .3584  .1986  -.03994 .0163  .0160  .0159  .0171  .0027 -.0058 -.0038
O3    .4277  .3995    .0800 .0295   .015   .057  .0165  .0071 -.0043 -.0119
O4    .2154  .6400   -.1725 .0204  .0187   .033  .0089 -.0053 -.0019  .0066
O5     .742  .6065 -.249833 .0230   .020   .024   .025   .004      0      0
O6    .1515  .8861     -.25 .0270  .0500  .0500  .0500      0      0      0
O7    .6657  .8363   -.3306 .0277   .023   .019   .039   .004      0      0
H1     .722  .4990 -.250167   .05
H2   -.0279  .8612     -.25   .05
H3    .2224  .9842     -.25   .05
H4    .5559  .9045   -.3525   .05
H5    .6313  .7738   -.3621   .05