# CIF generated by HEAS from Alexandria entry agm006146972 data_agm006146972 _cell_length_a 2.56766 _cell_length_b 4.07238 _cell_length_c 4.91833 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 51.42844 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy B1 B 0.50000 0.52180 0.27314 1.00000 B2 B 0.50000 0.21929 0.00000 1.00000 B3 B 0.50000 0.52180 0.72686 1.00000 C1 C 0.00000 0.77230 0.25433 1.00000 C2 C 0.00000 0.96657 0.00000 1.00000 C3 C 0.00000 0.77230 0.74567 1.00000 C4 C 0.00000 0.00620 0.50000 1.00000 C5 C 0.50000 0.21976 0.50000 1.00000