# CIF generated by HEAS from Alexandria entry agm005448639 data_agm005448639 _cell_length_a 6.86139 _cell_length_b 6.86139 _cell_length_c 2.54883 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 113.02774 _cell_volume 110.43406 _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 As1 As 0.04305 0.95695 0.00000 1.00000 C1 C 0.20521 0.79479 0.00000 1.00000 C2 C 0.71601 0.28399 0.00000 1.00000 C3 C 0.38592 0.61408 0.50000 1.00000 C4 C 0.71583 0.28417 0.50000 1.00000 C5 C 0.26731 0.73269 0.50000 1.00000