data_30000102
loop_
_publ_author_name
'Mariela M. Nolasco'
'Pedro D. Vaz'
'Paulo Ribeiro-Claro'
_journal_name_full               'To be published in Frontiers in Chemistry'
_chemical_formula_sum            'C10 H10 O5'
_space_group_name_Hall           'P 1'
_space_group_name_H-M_alt        'P 1'
_cell_angle_alpha                70.4510
_cell_angle_beta                 123.7198
_cell_angle_gamma                90.2376
_cell_length_a                   22.8125
_cell_length_b                   5.8852
_cell_length_c                   4.6962
_cell_volume                     480.743
_tcod_database_code              30000102
_cod_hold_until_date             2023-03-02
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?
