# CIF generated by HEAS from Alexandria entry agm005279840 data_agm005279840 _cell_length_a 6.93107 _cell_length_b 6.93107 _cell_length_c 6.16280 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 256.39489 _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 Ca1 Ca 0.00000 0.00000 0.50000 1.00000 Ti1 Ti 0.00000 0.00000 0.00000 1.00000 H1 H 0.24992 0.49984 0.25962 1.00000 H2 H 0.50016 0.75008 0.25962 1.00000 H3 H 0.49984 0.24992 0.74038 1.00000 H4 H 0.24992 0.75008 0.25962 1.00000 H5 H 0.75008 0.50016 0.74038 1.00000 H6 H 0.75008 0.24992 0.74038 1.00000 O1 O 0.33333 0.66667 0.30193 1.00000 O2 O 0.66667 0.33333 0.69807 1.00000 F1 F 0.13251 0.86752 0.23217 1.00000 F2 F 0.13248 0.26499 0.23217 1.00000 F3 F 0.86752 0.13251 0.76783 1.00000 F4 F 0.73501 0.86749 0.23217 1.00000 F5 F 0.26499 0.13248 0.76783 1.00000 F6 F 0.86749 0.73501 0.76783 1.00000