# CIF generated by HEAS from Alexandria entry agm005225760 data_agm005225760 _cell_length_a 8.99089 _cell_length_b 8.34072 _cell_length_c 9.05344 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 678.92155 _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 0.20576 0.11006 0.39239 1.00000 H2 H 0.70576 0.38994 0.39239 1.00000 H3 H 0.84177 0.00432 0.17727 1.00000 H4 H 0.22544 0.95589 0.99536 1.00000 H5 H 0.77456 0.04411 0.00464 1.00000 H6 H 0.15823 0.49568 0.67727 1.00000 H7 H 0.29424 0.61006 0.60761 1.00000 H8 H 0.34177 0.49568 0.17727 1.00000 H9 H 0.79424 0.38994 0.89239 1.00000 H10 H 0.27456 0.95589 0.49536 1.00000 H11 H 0.79424 0.88994 0.60761 1.00000 H12 H 0.70576 0.88994 0.10761 1.00000 H13 H 0.29424 0.11006 0.89239 1.00000 H14 H 0.72544 0.04411 0.50464 1.00000 H15 H 0.34177 0.99568 0.32273 1.00000 H16 H 0.15823 0.99568 0.82273 1.00000 H17 H 0.72544 0.54411 0.99536 1.00000 H18 H 0.65823 0.50432 0.82273 1.00000 H19 H 0.65823 0.00432 0.67727 1.00000 H20 H 0.22544 0.45589 0.50464 1.00000 H21 H 0.20576 0.61006 0.10761 1.00000 H22 H 0.27456 0.45589 0.00464 1.00000 H23 H 0.77456 0.54411 0.49536 1.00000 H24 H 0.84177 0.50432 0.32273 1.00000 S1 S 0.10842 0.35769 0.18971 1.00000 S2 S 0.89158 0.64231 0.81029 1.00000 S3 S 0.39158 0.85769 0.81029 1.00000 S4 S 0.60842 0.14231 0.18971 1.00000 S5 S 0.39158 0.35769 0.68971 1.00000 S6 S 0.89158 0.14231 0.68971 1.00000 S7 S 0.10842 0.85769 0.31029 1.00000 S8 S 0.60842 0.64231 0.31029 1.00000 N1 N 0.74697 0.50625 0.38943 1.00000 N2 N 0.25303 0.99375 0.88943 1.00000 N3 N 0.24697 0.99375 0.38943 1.00000 N4 N 0.25303 0.49375 0.61057 1.00000 N5 N 0.74697 0.00625 0.11057 1.00000 N6 N 0.75303 0.50625 0.88943 1.00000 N7 N 0.75303 0.00625 0.61057 1.00000 N8 N 0.24697 0.49375 0.11057 1.00000 O1 O 0.97330 0.45258 0.17965 1.00000 O2 O 0.83418 0.66677 0.66094 1.00000 O3 O 0.02670 0.54742 0.82035 1.00000 O4 O 0.11764 0.71971 0.40578 1.00000 O5 O 0.61764 0.28029 0.09422 1.00000 O6 O 0.11764 0.21971 0.09422 1.00000 O7 O 0.83418 0.16677 0.83906 1.00000 O8 O 0.33418 0.83323 0.66094 1.00000 O9 O 0.66582 0.16677 0.33906 1.00000 O10 O 0.52670 0.95258 0.82035 1.00000 O11 O 0.38236 0.71971 0.90578 1.00000 O12 O 0.33418 0.33323 0.83906 1.00000 O13 O 0.47330 0.54742 0.32035 1.00000 O14 O 0.88236 0.28029 0.59422 1.00000 O15 O 0.66582 0.66677 0.16094 1.00000 O16 O 0.61764 0.78029 0.40578 1.00000 O17 O 0.38236 0.21971 0.59422 1.00000 O18 O 0.16582 0.33323 0.33906 1.00000 O19 O 0.97330 0.95258 0.32035 1.00000 O20 O 0.52670 0.45258 0.67965 1.00000 O21 O 0.47330 0.04742 0.17965 1.00000 O22 O 0.02670 0.04742 0.67965 1.00000 O23 O 0.88236 0.78029 0.90578 1.00000 O24 O 0.16582 0.83323 0.16094 1.00000