American Mineralogist Crystal Structure Database

1 matching records for this search.

Gerhardtite
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Bovio B, Locchi S
 
Journal of Crystallographic and Spectroscopic Research 12 (1982) 507-517
Crystal structure of the orthorhombic basic copper nitrate, Cu2(OH)3NO3
Locality: Kalabi, Jadotville, Katanga
_database_code_amcsd 0013022
6.087 13.813 5.597 90 90 90 P2_12_12_1
atom     x     y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Cu1  .7300 .2473 .5009       .0035  .0014  .0066 -.0001 -.0001 -.0006
Cu2  .4820 .2510 .0083       .0020  .0016  .0071  .0001  .0001 -.0002
O1   .4891 .1372 .6882       .0030  .0012  .0170 -.0011 -.0023 -.0001
O2   .6211 .0040 .5499       .0460  .0032  .0032  .0047  .0087  .0008
O3   .3929 .0008 .8592       .0266  .0029  .0063 -.0003  .0070  .0021
N    .4994 .0455 .6949       .0087  .0023  .0024 -.0005 -.0020 -.0017
O4   .4868 .3225 .3812  .54
O5   .7260 .3101 .8224  .42
O6   .2380 .3121 .8235  .17
H1   .4563 .3855 .4307  .54
H2   .7925 .3703 .7994  .42
H3   .2125 .3798 .8156  .17
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