# CIF generated by HEAS from Alexandria entry agm002076331 data_agm002076331 _cell_length_a 2.91552 _cell_length_b 2.91578 _cell_length_c 4.86788 _cell_angle_alpha 91.57689 _cell_angle_beta 94.36670 _cell_angle_gamma 120.00267 _cell_volume 35.62960 _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 P1 P 0.63402 0.54962 0.72650 1.00000 H1 H 0.04827 0.27491 0.12073 1.00000 C1 C 0.00059 0.24053 0.89287 1.00000