Ba F9 Fe2 Na
Ferey G, Leblanc M, Kozak A, Samouel M, Pannetier J
Journal of Solid State Chemistry 56 (1985) 288-297
Crystal structures of Na Ba Cr2 F9 and Na Ba Fe2 F9 Structural
correlations with other enneafluorides, particularly with KPbCr2F9
_cod_database_code 1000205
_database_code_amcsd 0013535
7.363 17.527 5.484 90 91.50 90 P2_1/n
atom     x     y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na1  .3102 .0408  .7490  .0116  .0161  .0165 -.0028 -.0089 -.0061
Ba1  .0679 .2851  .7260  .0093  .0048  .0135 -.0008 -.0019 -.0008
Fe1  .4080 .6238  .2238  .0071  .0022  .0077 -.0002 -.0035  .0008
Fe2  .2702 .4185  .2629  .0069  .0030  .0093  .0000 -.0013  .0000
F1   .1339 .4181 -.0303  .0235  .0177  .0128 -.0024 -.0122 -.0055
F2   .0022 .9223  .4173  .0124  .0054  .0153  .0007  .0037  .0013
F3   .2843 .3115  .2928  .0223  .0058  .0282 -.0023  .0072  .0017
F4   .4390 .9176  .0470  .0143  .0166  .0157 -.0003  .0051 -.0028
F5   .2754 .1643  .4867  .0136  .0123  .0150 -.0029 -.0032  .0003
F6   .2040 .1640  .0023  .0231  .0091  .0091  .0010  .0029  .0058
F7   .2376 .0307  .2449  .0083  .0025  .0210  .0006  .0013 -.0018
F8   .4352 .2912  .8169  .0168  .0110  .0190 -.0026 -.0055  .0038
F9   .4063 .4303  .5796  .0141  .0106  .0100 -.0018 -.0055  .0014