# CIF generated by HEAS from Alexandria entry agm001954792 data_agm001954792 _cell_length_a 3.37669 _cell_length_b 3.37669 _cell_length_c 7.89679 _cell_angle_alpha 77.65477 _cell_angle_beta 77.65477 _cell_angle_gamma 60.00000 _cell_volume 75.56301 _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 C1 C 0.50000 0.50000 0.50000 1.00000 Pa1 Pa 0.23143 0.23143 0.30571 1.00000 Pa2 Pa 0.76857 0.76857 0.69429 1.00000 Cl1 Cl 0.00000 0.00000 0.00000 1.00000