Ghiaraite
Leclaire A, Borel M M
Acta Crystallographica B35 (1979) 585-588
Liaisons hydrogene et coordination du calcium dans les cristaux de CaCl2*4H2O alpha
Locality: synthetic
_database_code_amcsd 0019787
6.5932 6.3673 8.5606 97.83 93.50 110.58 P-1
atom       x       y      z B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Ca    .11886 -.01387 .26140 .00833 .00946 .00713  .00332  .00043 -.00038
Cl1   .29090 -.27763 .05027 .01266 .01313 .00608  .00566  .00188  .00069
Cl2  -.24963 -.23938 .41330 .01049 .01329 .00679  .00174  .00103 -.00018
O1   -.18298 -.18677 .04402 .01105 .01409  .1064  .00382  .00096 -.00139
O2   -.01529  .28903 .27183 .01607 .01302 .00819  .00682 -.00123  .00094
O3    .47923  .24134 .26680 .01368 .01644 .00748 -.00048  .00314 -.00130
O4    .24816 -.25291 .41486 .01593 .01666 .00703  .00845  .00049  .00085
H11   -.3047  -.1928  .0754
H12   -.2071  -.3242  .0171
H21    .0677   .4132  .3157
H22   -.0842   .3082  .1940
H31    .5429   .3751  .3055
H32    .5449   .3751  .1934
H41    .3803  -.2372  .4052
H42    .2391  -.2334  .5101