data_3000024
loop_
_publ_author_name
'Kim Rijpstra'
'Stefaan Cottenier'
'Michel Waroquier'
'Veronique Van Speybroeck'
_publ_section_title
;

 Crystal structure prediction for supersaturated AZO: the case of Zn3Al2O6

;
_journal_name_full               'To be published'
_chemical_formula_sum            'Al2 O6 Zn3'
_cell_length_a                   7.651867
_cell_length_b                   5.447268
_cell_length_c                   3.241884
_cell_angle_alpha                90.000000
_cell_angle_beta                 90.000000
_cell_angle_gamma                109.709100
_cell_volume                     127.211
_cod_hold_until_date             2013-07-04
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?