data_3000450
loop_
_publ_author_name
'Sasaki, Toshiyuki'
'Nakane, Takanori'
'Kawamoto, Akihiro'
'Zhao, Yakai'
'Fujimoto, Yushi'
'Nishizawa, Tomohiro'
'Ito, Fuyuki'
'Ramamurty, Upadrasta'
'Thakuria, Ranjit'
'Kurisu, Genji'
_journal_name_full               'To be published'
_chemical_formula_sum            'C13 H10 N2 O3'
_space_group_name_Hall           'P 2c -2n'
_space_group_name_H-M_alt        'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   23.456
_cell_length_b                   3.811
_cell_length_c                   24.879
_cell_measurement_temperature    79
_cell_volume                     2223.954
_diffrn_ambient_temperature      79
_diffrn_radiation_type           electrons
_diffrn_radiation_wavelength     0.02508
_refine_ls_goodness_of_fit_ref   0.902
_refine_ls_R_factor_all          0.1925
_refine_ls_R_factor_gt           0.1215
_refine_ls_wR_factor_gt          0.2878
_refine_ls_wR_factor_ref         0.3097
_cod_database_code               3000450
_cod_hold_until_date             2024-06-07
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?