# CIF generated by HEAS from Alexandria entry agm005276785 data_agm005276785 _cell_length_a 8.19132 _cell_length_b 8.54251 _cell_length_c 9.10312 _cell_angle_alpha 75.30921 _cell_angle_beta 64.44193 _cell_angle_gamma 76.50976 _cell_volume 550.24131 _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 Sc1 Sc 0.04444 0.64954 0.82850 1.00000 Sc2 Sc 0.95556 0.35046 0.17150 1.00000 H1 H 0.93243 0.68144 0.15210 1.00000 H2 H 0.06757 0.31856 0.84790 1.00000 H3 H 0.17399 0.80736 0.49076 1.00000 H4 H 0.82601 0.19264 0.50924 1.00000 H5 H 0.13725 0.94937 0.58767 1.00000 H6 H 0.86275 0.05063 0.41233 1.00000 H7 H 0.85136 0.49373 0.72265 1.00000 H8 H 0.14864 0.50627 0.27735 1.00000 H9 H 0.86502 0.66915 0.60782 1.00000 H10 H 0.13498 0.33085 0.39218 1.00000 H11 H 0.67848 0.80593 0.99863 1.00000 H12 H 0.32152 0.19407 0.00137 1.00000 H13 H 0.77107 0.94674 0.85562 1.00000 H14 H 0.22893 0.05326 0.14438 1.00000 H15 H 0.25294 0.77741 0.94767 1.00000 H16 H 0.74706 0.22259 0.05233 1.00000 H17 H 0.27500 0.89026 0.77242 1.00000 H18 H 0.72500 0.10974 0.22758 1.00000 H19 H 0.42172 0.52296 0.69282 1.00000 H20 H 0.57828 0.47704 0.30718 1.00000 H21 H 0.31932 0.43199 0.63604 1.00000 H22 H 0.68068 0.56801 0.36396 1.00000 I1 I 0.27406 0.17654 0.59116 1.00000 I2 I 0.72594 0.82346 0.40884 1.00000 I3 I 0.64976 0.25932 0.81195 1.00000 I4 I 0.35024 0.74068 0.18805 1.00000 O1 O 0.98202 0.59825 0.08029 1.00000 O2 O 0.01798 0.40175 0.91971 1.00000 O3 O 0.09809 0.84421 0.59785 1.00000 O4 O 0.90191 0.15579 0.40215 1.00000 O5 O 0.91355 0.59110 0.68582 1.00000 O6 O 0.08645 0.40890 0.31418 1.00000 O7 O 0.79695 0.83431 0.91121 1.00000 O8 O 0.20305 0.16569 0.08879 1.00000 O9 O 0.23132 0.78856 0.84635 1.00000 O10 O 0.76868 0.21144 0.15365 1.00000 O11 O 0.31763 0.53906 0.66152 1.00000 O12 O 0.68237 0.46094 0.33848 1.00000