Nickelboussingaultite
Treushnikov E N, Kuskov V I, Soboleva L V, Belov N V
Soviet Physics Crystallography 23 (1978) 30-41
Distribution of electron density in nickel ammonium sulphate hexahydrate
[Ni*6H2O](NH4)2(SO4)2 from x-ray diffraction data
Locality: synthetic
_database_code_amcsd 0015578
6.243 9.484 12.467 90 90 112.067 P2_1/n
atom       x       y      z Biso B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
N     .77845  .13556 .34633      .01744 .00669 .00446 .00289  .00074  .00047
H7      .634    .087   .356  1.8
H8      .808    .213   .305  1.3
H9      .841    .071   .338  1.8
H10     .831    .175   .416  2.3
Ni        .5      .5     .5      .01062 .00301 .00187 .00177  .00017  .00034
S     .16861 -.09238 .36337      .01283 .00372 .00222 .00244  .00039  .00004
O1   -.06436 -.11650 .32312      .01600 .00999 .00349 .00563  .00098 -.00046
O2    .32473 -.08593 .27243      .01744 .01064 .00330 .00535  .00119  .00196
O3    .26179  .04864 .42481      .03448 .00512 .00525 .00339 -.00133 -.00258
O4    .15884 -.22062 .43327      .01869 .00551 .00351 .00330  .00136 -.00033
O5    .29735 -.00195 .06649      .01410 .00688 .00301 .00351  .00025 -.00033
O6    .00597  .16859 .10708      .01785 .00595 .00349 .00461 -.00115  -.0009
O7    .30469  .33931 .38990      .01772 .00530 .00293 .00217 -.00031 -.00033
H1      .415    .086   .072  1.7
H2      .789    .471   .362  1.9
H3      .902    .213   .090  1.6
H4      .145    .241   .125   .6
H5      .371    .364   .322  1.9
H6      .291    .243   .408  1.6