Oxammite
Taylor J C, Sabine T M
Acta Crystallographica B28 (1972) 3340-3351
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the
combined use of neutron and X-ray diffraction analyses
Locality: synthetic
Sample: DOX(XR)
_database_code_amcsd 0009460
8.027 10.298 3.816 90 90 90 P2_12_12
atom     x      y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
N    .3867  .2265 .4259       .0080  .0040  .0389 -.0012  .0004 -.0006
H1   .4749  .2657 .2902    4
H2   .4248  .1519 .5425    4
H3   .2912  .2007 .2882    4
H4   .3553  .2935 .5810    4
C    .0929  .0244 .0710       .0059  .0038  .0262 -.0003 -.0011  .0002
O1   .2015 -.0589 .1410       .0058  .0042  .0624  .0005 -.0002  .0053
O2   .1178  .1408 .0018       .0070  .0024  .0642 -.0012 -.0050  .0039
Ow       0     .5 .1877       .0066  .0058  .0518  .0001      0      0
Hw   .0841  .4829 .0467    4