American Mineralogist Crystal Structure Database

3 matching records for this search.

Bischofite
Download hom/bischofite.pdf
Agron P A, Busing W R
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=41&spage=8
Acta Crystallographica C41 (1985) 8-10
Magnesium dichloride hexahydrate, MgCl2*6H2O, by neutron diffraction
Locality: synthetic
_database_code_amcsd 0010001
9.8607 7.1071 6.0737 90 93.758 90 C2/m
atom      x     y     z Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg        0     0     0  2.0  .0226  .0295  .0245      0  .0018      0
Cl    .3176     0 .6122  2.8  .0312  .0407  .0359      0  .0052      0
O1    .2019     0 .1095  3.5  .0256  .0689  .0379      0 -.0017      0
O2   -.0429 .2067 .2233  3.9  .0453  .0497  .0538 -.0100  .0196 -.0231
H1    .2372     0 .2583  5.0  .0486  .0861  .0527      0 -.0117      0
H2    .2693     0 .0083  7.0  .0448  .1418  .0801      0  .0178      0
H3    .0209 .2997 .2784  4.5  .0661  .0490  .0559 -.0065  .0017 -.0144
H4   -.1161 .1984 .3151  5.9  .0647  .0947  .0702  .0032  .0319 -.0164
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View JMOL 3-D Structure (permalink)
 
Antarcticite
Download hom/antarcticite.pdf
Agron P A, Busing W R
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=42&spage=141
Acta Crystallographica C42 (1986) 141-143
Calcium and strontium dichloride hexahydrates by neutron diffraction
_database_code_amcsd 0010027
7.8759 7.8758 3.9545 90 90 120 P321
atom      x     y      z Biso
Ca        0     0      0 1.41
Cl    .3333 .6667  .4249 2.16
O1    .3114     0      0 2.26
O2   -.2132     0  .5000 1.94
H1    .4326 .0988 -.0926 4.13
H2   -.2330 .1113  .4835 3.58
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
SrCl2*6H2O
 
Agron P A, Busing W R
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=42&spage=141
Acta Crystallographica C42 (1986) 141-143
Calcium and strontium dichloride hexahydrates by neutron diffraction
_database_code_amcsd 0010028
7.9596 7.9596 4.1243 90 90 120 P321
atom      x     y      z Biso
Sr        0     0      0 1.34
Cl    .3333 .6667  .4190 2.44
O1    .3229     0      0 2.57
O2   -.2219     0  .5000 1.94
H1    .4419 .0964 -.0899 4.51
H2   -.2415 .1103  .4887 3.50
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 3
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