data_global
_chemical_name_mineral 'Olenite'
loop_
_publ_author_name
'Ertl A'
'Giester G'
'Ludwig T'
'Meyer H P'
'Rossman G R'
_journal_name_full 'American Mineralogist'
_journal_volume 97 
_journal_year 2012
_journal_page_first 1591
_journal_page_last 1597
_publ_section_title
;
 Synthetic B-rich olenite: Correlations of single-crystal structural data
 Note: sample ElbK-11
;
_database_code_amcsd 0019527
_chemical_compound_source 'synthetic at 400 C'
_chemical_formula_sum 'Na.76 Al8.64 Li.36 B4.2 Si4.8 H3 O31'
_cell_length_a 15.723
_cell_length_b 15.723
_cell_length_c 7.068
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 1513.206
_exptl_crystal_density_diffrn      3.069
_symmetry_space_group_name_H-M 'R 3 m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '2/3+x,1/3+y,1/3+z'
  '1/3+x,2/3+y,2/3+z'
  'x,x-y,z'
  '2/3+x,1/3+x-y,1/3+z'
  '1/3+x,2/3+x-y,2/3+z'
  '-y,-x,z'
  '2/3-y,1/3-x,1/3+z'
  '1/3-y,2/3-x,2/3+z'
  '-x+y,y,z'
  '2/3-x+y,1/3+y,1/3+z'
  '1/3-x+y,2/3+y,2/3+z'
  '-y,x-y,z'
  '2/3-y,1/3+x-y,1/3+z'
  '1/3-y,2/3+x-y,2/3+z'
  '-x+y,-x,z'
  '2/3-x+y,1/3-x,1/3+z'
  '1/3-x+y,2/3-x,2/3+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
NaX   0.00000   0.00000   0.24320   0.76000   0.03900
AlY   0.12201   0.06101  -0.34110   0.88000   0.01020
LiY   0.12201   0.06101  -0.34110   0.12000   0.01020
AlZ   0.29718   0.26055  -0.37280   1.00000   0.00650
B   0.10880   0.21760   0.47300   1.00000   0.00780
SiT   0.19084   0.18941   0.01968   0.80000   0.00600
BT   0.19084   0.18941   0.01968   0.20000   0.00600
H3   0.25200   0.12600   0.43000   1.00000   0.03000
O1   0.00000   0.00000  -0.20490   1.00000   0.01850
O2   0.06004   0.12008   0.51160   1.00000   0.01210
O3   0.26060   0.13030  -0.47170   1.00000   0.01220
O4   0.09390   0.18780   0.09170   1.00000   0.01440
O5   0.18580   0.09290   0.11460   1.00000   0.01650
O6   0.19430   0.18390  -0.20470   1.00000   0.00900
O7   0.28510   0.28520   0.09360   1.00000   0.00870
O8   0.20940   0.26970   0.45700   1.00000   0.00790