# CIF generated by HEAS from Alexandria entry agm005228964 data_agm005228964 _cell_length_a 6.84961 _cell_length_b 8.69020 _cell_length_c 9.38382 _cell_angle_alpha 88.32108 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 558.32774 _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 H1 H 0.14671 0.88858 0.58848 1.00000 H2 H 0.72010 0.10223 0.96985 1.00000 H3 H 0.84877 0.15084 0.80646 1.00000 H4 H 0.60338 0.33740 0.61557 1.00000 H5 H 0.04824 0.72399 0.50179 1.00000 H6 H 0.27990 0.89777 0.03015 1.00000 H7 H 0.63787 0.46000 0.88193 1.00000 H8 H 0.35329 0.38858 0.58848 1.00000 H9 H 0.15123 0.84916 0.19354 1.00000 H10 H 0.85329 0.11142 0.41152 1.00000 H11 H 0.65123 0.65084 0.80646 1.00000 H12 H 0.77990 0.60223 0.96985 1.00000 H13 H 0.45176 0.22399 0.50179 1.00000 H14 H 0.22010 0.39777 0.03015 1.00000 H15 H 0.86213 0.96000 0.88193 1.00000 H16 H 0.89662 0.83740 0.61557 1.00000 H17 H 0.64671 0.61142 0.41152 1.00000 H18 H 0.36213 0.54000 0.11807 1.00000 H19 H 0.10338 0.16260 0.38443 1.00000 H20 H 0.54824 0.77601 0.49821 1.00000 H21 H 0.39662 0.66260 0.38443 1.00000 H22 H 0.34877 0.34916 0.19354 1.00000 H23 H 0.95176 0.27601 0.49821 1.00000 H24 H 0.13787 0.04000 0.11807 1.00000 C1 C 0.04379 0.79165 0.59858 1.00000 C2 C 0.73271 0.56128 0.86592 1.00000 C3 C 0.45621 0.29165 0.59858 1.00000 C4 C 0.95621 0.20835 0.40142 1.00000 C5 C 0.54379 0.70835 0.40142 1.00000 C6 C 0.23271 0.93872 0.13408 1.00000 C7 C 0.26729 0.43872 0.13408 1.00000 C8 C 0.76729 0.06128 0.86592 1.00000 S1 S 0.55881 0.99443 0.76515 1.00000 S2 S 0.37263 0.17732 0.75200 1.00000 S3 S 0.94119 0.49443 0.76515 1.00000 S4 S 0.05881 0.50557 0.23485 1.00000 S5 S 0.87263 0.32268 0.24800 1.00000 S6 S 0.62737 0.82268 0.24800 1.00000 S7 S 0.12737 0.67732 0.75200 1.00000 S8 S 0.44119 0.00557 0.23485 1.00000