# CIF generated by HEAS from Alexandria entry agm079232177 data_agm079232177 _cell_length_a 4.80116 _cell_length_b 4.37916 _cell_length_c 6.36921 _cell_angle_alpha 59.86875 _cell_angle_beta 47.33824 _cell_angle_gamma 70.72513 _cell_volume 85.15807 _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 Ba1 Ba 0.80782 0.77615 0.80489 1.00000 H1 H 0.28245 0.26547 0.12090 1.00000 H2 H 0.50397 0.46513 0.47294 1.00000 H3 H 0.02191 0.70933 0.25819 1.00000 H4 H 0.50495 0.09509 0.43704 1.00000 H5 H 0.29138 0.30013 0.98480 1.00000 H6 H 0.03335 0.85907 0.11605 1.00000 C1 C 0.30416 0.27963 0.55519 1.00000