data_IRMOF-3 _audit_creation_method RASPA-1.0 _audit_creation_date 2011-3-7 _audit_author_name 'Tina Duren/Houston Frost/Randall Snurr/David Dubbeldam' _citation_author_name 'M. Eddaoudi, J. Kim, N. Rosi, D. Vodak, J. Wachter, M. O’Keeffe, and O.M. Yaghi', _citation_title 'Systematic design of pore size and functionality in isoreticular MOFs and their application in methane storage' _citation_journal_abbrev 'Science' _citation_journal_volume 295 _citation_journal_number 5554 _citation_page_first 469 _citation_page_last 472 _citation_year 2002 _cell_length_a 25.7465 _cell_length_b 25.7465 _cell_length_c 25.7465 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 17066.9 _symmetry_cell_setting triclinic _symmetry_space_group_name_Hall 'P 1' _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 _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_charge _atom_site_polarization _atom_site_anisotropic_displacement _atom_site_anisotropic_type _atom_site_print_to_pdb Zn1 Zn 0.29342 0.20658 0.20658 0 0 0 absolute yes O1 O 0.28066 0.21934 0.134 0 0 0 absolute yes O2 O 0.25 0.25 0.25 0 0 0 absolute yes C8 C 0.25 0.25 0.11052 0 0 0 absolute yes C3 C 0.25 0.25 0.05568 0 0 0 absolute yes C4 C 0.28097 0.21903 0.02662 0 0 0 absolute yes Zn1 Zn 0.70658 0.79342 0.20658 0 0 0 absolute yes O1 O 0.71934 0.78066 0.134 0 0 0 absolute yes O2 O 0.75 0.75 0.25 0 0 0 absolute yes C8 C 0.75 0.75 0.11052 0 0 0 absolute yes C3 C 0.75 0.75 0.05568 0 0 0 absolute yes C2 C 0.71903 0.78097 0.02662 0 0 0 absolute yes Zn1 Zn 0.70658 0.20658 0.79342 0 0 0 absolute yes O1 O 0.71934 0.21934 0.866 0 0 0 absolute yes O2 O 0.75 0.25 0.75 0 0 0 absolute yes C7 C 0.75 0.25 0.88948 0 0 0 absolute yes C6 C 0.75 0.25 0.94432 0 0 0 absolute yes C5 C 0.71903 0.21903 0.97338 0 0 0 absolute yes Zn1 Zn 0.29342 0.79342 0.79342 0 0 0 absolute yes O3 O 0.28066 0.78066 0.866 0 0 0 absolute yes O2 O 0.25 0.75 0.75 0 0 0 absolute yes C7 C 0.25 0.75 0.88948 0 0 0 absolute yes C6 C 0.25 0.75 0.94432 0 0 0 absolute yes C1 C 0.28097 0.78097 0.97338 0 0 0 absolute yes N1 N 0.31768 0.81768 0.95261 0 0 0 absolute yes Zn1 Zn 0.20658 0.29342 0.20658 0 0 0 absolute yes O1 O 0.134 0.28066 0.21934 0 0 0 absolute yes C8 C 0.11052 0.25 0.25 0 0 0 absolute yes C3 C 0.05568 0.25 0.25 0 0 0 absolute yes C2 C 0.02662 0.28097 0.21903 0 0 0 absolute yes Zn1 Zn 0.20658 0.70658 0.79342 0 0 0 absolute yes O1 O 0.134 0.71934 0.78066 0 0 0 absolute yes C8 C 0.11052 0.75 0.75 0 0 0 absolute yes C3 C 0.05568 0.75 0.75 0 0 0 absolute yes C4 C 0.02662 0.71903 0.78097 0 0 0 absolute yes Zn1 Zn 0.79342 0.70658 0.20658 0 0 0 absolute yes O1 O 0.866 0.71934 0.21934 0 0 0 absolute yes C7 C 0.88948 0.75 0.25 0 0 0 absolute yes C6 C 0.94432 0.75 0.25 0 0 0 absolute yes C5 C 0.97338 0.71903 0.21903 0 0 0 absolute yes Zn1 Zn 0.79342 0.29342 0.79342 0 0 0 absolute yes O3 O 0.866 0.28066 0.78066 0 0 0 absolute yes C7 C 0.88948 0.25 0.75 0 0 0 absolute yes C6 C 0.94432 0.25 0.75 0 0 0 absolute yes C1 C 0.97338 0.28097 0.78097 0 0 0 absolute yes N1 N 0.95261 0.31768 0.81768 0 0 0 absolute yes Zn1 Zn 0.20658 0.20658 0.29342 0 0 0 absolute yes O3 O 0.21934 0.134 0.28066 0 0 0 absolute yes C7 C 0.25 0.11052 0.25 0 0 0 absolute yes C6 C 0.25 0.05568 0.25 0 0 0 absolute yes C1 C 0.21903 0.02662 0.28097 0 0 0 absolute yes N1 N 0.18232 0.04739 0.31768 0 0 0 absolute yes Zn1 Zn 0.79342 0.20658 0.70658 0 0 0 absolute yes O1 O 0.78066 0.134 0.71934 0 0 0 absolute yes C7 C 0.75 0.11052 0.75 0 0 0 absolute yes C6 C 0.75 0.05568 0.75 0 0 0 absolute yes C5 C 0.78097 0.02662 0.71903 0 0 0 absolute yes Zn1 Zn 0.20658 0.79342 0.70658 0 0 0 absolute yes O1 O 0.21934 0.866 0.71934 0 0 0 absolute yes C8 C 0.25 0.88948 0.75 0 0 0 absolute yes C3 C 0.25 0.94432 0.75 0 0 0 absolute yes C2 C 0.21903 0.97338 0.71903 0 0 0 absolute yes Zn1 Zn 0.79342 0.79342 0.29342 0 0 0 absolute yes O1 O 0.78066 0.866 0.28066 0 0 0 absolute yes C8 C 0.75 0.88948 0.25 0 0 0 absolute yes C3 C 0.75 0.94432 0.25 0 0 0 absolute yes C4 C 0.78097 0.97338 0.28097 0 0 0 absolute yes Zn1 Zn 0.20658 0.29342 0.79342 0 0 0 absolute yes O3 O 0.21934 0.28066 0.866 0 0 0 absolute yes O2 O 0.25 0.25 0.75 0 0 0 absolute yes C7 C 0.25 0.25 0.88948 0 0 0 absolute yes C6 C 0.25 0.25 0.94432 0 0 0 absolute yes C1 C 0.21903 0.28097 0.97338 0 0 0 absolute yes N1 N 0.18232 0.31768 0.95261 0 0 0 absolute yes Zn1 Zn 0.79342 0.70658 0.79342 0 0 0 absolute yes O1 O 0.78066 0.71934 0.866 0 0 0 absolute yes O2 O 0.75 0.75 0.75 0 0 0 absolute yes C7 C 0.75 0.75 0.88948 0 0 0 absolute yes C6 C 0.75 0.75 0.94432 0 0 0 absolute yes C5 C 0.78097 0.71903 0.97338 0 0 0 absolute yes Zn1 Zn 0.20658 0.70658 0.20658 0 0 0 absolute yes O1 O 0.21934 0.71934 0.134 0 0 0 absolute yes O2 O 0.25 0.75 0.25 0 0 0 absolute yes C8 C 0.25 0.75 0.11052 0 0 0 absolute yes C3 C 0.25 0.75 0.05568 0 0 0 absolute yes C4 C 0.21903 0.71903 0.02662 0 0 0 absolute yes Zn1 Zn 0.79342 0.29342 0.20658 0 0 0 absolute yes O1 O 0.78066 0.28066 0.134 0 0 0 absolute yes O2 O 0.75 0.25 0.25 0 0 0 absolute yes C8 C 0.75 0.25 0.11052 0 0 0 absolute yes C3 C 0.75 0.25 0.05568 0 0 0 absolute yes C2 C 0.78097 0.28097 0.02662 0 0 0 absolute yes Zn1 Zn 0.29342 0.20658 0.79342 0 0 0 absolute yes O1 O 0.28066 0.134 0.78066 0 0 0 absolute yes C7 C 0.25 0.11052 0.75 0 0 0 absolute yes C6 C 0.25 0.05568 0.75 0 0 0 absolute yes C5 C 0.28097 0.02662 0.78097 0 0 0 absolute yes Zn1 Zn 0.70658 0.20658 0.20658 0 0 0 absolute yes O3 O 0.71934 0.134 0.21934 0 0 0 absolute yes C7 C 0.75 0.11052 0.25 0 0 0 absolute yes C6 C 0.75 0.05568 0.25 0 0 0 absolute yes C1 C 0.71903 0.02662 0.21903 0 0 0 absolute yes N1 N 0.68232 0.04739 0.18232 0 0 0 absolute yes Zn1 Zn 0.70658 0.79342 0.79342 0 0 0 absolute yes O1 O 0.71934 0.866 0.78066 0 0 0 absolute yes C8 C 0.75 0.88948 0.75 0 0 0 absolute yes C3 C 0.75 0.94432 0.75 0 0 0 absolute yes C2 C 0.71903 0.97338 0.78097 0 0 0 absolute yes Zn1 Zn 0.29342 0.79342 0.20658 0 0 0 absolute yes O1 O 0.28066 0.866 0.21934 0 0 0 absolute yes C8 C 0.25 0.88948 0.25 0 0 0 absolute yes C3 C 0.25 0.94432 0.25 0 0 0 absolute yes C4 C 0.28097 0.97338 0.21903 0 0 0 absolute yes Zn1 Zn 0.20658 0.20658 0.70658 0 0 0 absolute yes O1 O 0.134 0.21934 0.71934 0 0 0 absolute yes C8 C 0.11052 0.25 0.75 0 0 0 absolute yes C3 C 0.05568 0.25 0.75 0 0 0 absolute yes C4 C 0.02662 0.21903 0.71903 0 0 0 absolute yes Zn1 Zn 0.20658 0.79342 0.29342 0 0 0 absolute yes O1 O 0.134 0.78066 0.28066 0 0 0 absolute yes C8 C 0.11052 0.75 0.25 0 0 0 absolute yes C3 C 0.05568 0.75 0.25 0 0 0 absolute yes C2 C 0.02662 0.78097 0.28097 0 0 0 absolute yes Zn1 Zn 0.79342 0.20658 0.29342 0 0 0 absolute yes O1 O 0.866 0.21934 0.28066 0 0 0 absolute yes C7 C 0.88948 0.25 0.25 0 0 0 absolute yes C6 C 0.94432 0.25 0.25 0 0 0 absolute yes C5 C 0.97338 0.21903 0.28097 0 0 0 absolute yes Zn1 Zn 0.79342 0.79342 0.70658 0 0 0 absolute yes O3 O 0.866 0.78066 0.71934 0 0 0 absolute yes C7 C 0.88948 0.75 0.75 0 0 0 absolute yes C6 C 0.94432 0.75 0.75 0 0 0 absolute yes C1 C 0.97338 0.78097 0.71903 0 0 0 absolute yes N1 N 0.95261 0.81768 0.68232 0 0 0 absolute yes O3 O 0.71934 0.78066 0.866 0 0 0 absolute yes C1 C 0.71903 0.78097 0.97338 0 0 0 absolute yes N1 N 0.68232 0.81768 0.95261 0 0 0 absolute yes O1 O 0.28066 0.21934 0.866 0 0 0 absolute yes C5 C 0.28097 0.21903 0.97338 0 0 0 absolute yes O1 O 0.28066 0.78066 0.134 0 0 0 absolute yes C2 C 0.28097 0.78097 0.02662 0 0 0 absolute yes O1 O 0.71934 0.21934 0.134 0 0 0 absolute yes C4 C 0.71903 0.21903 0.02662 0 0 0 absolute yes O1 O 0.866 0.71934 0.78066 0 0 0 absolute yes C5 C 0.97338 0.71903 0.78097 0 0 0 absolute yes O3 O 0.866 0.28066 0.21934 0 0 0 absolute yes C1 C 0.97338 0.28097 0.21903 0 0 0 absolute yes N1 N 0.95261 0.31768 0.18232 0 0 0 absolute yes O1 O 0.134 0.28066 0.78066 0 0 0 absolute yes C2 C 0.02662 0.28097 0.78097 0 0 0 absolute yes O1 O 0.134 0.71934 0.21934 0 0 0 absolute yes C4 C 0.02662 0.71903 0.21903 0 0 0 absolute yes O1 O 0.78066 0.866 0.71934 0 0 0 absolute yes C4 C 0.78097 0.97338 0.71903 0 0 0 absolute yes O1 O 0.21934 0.866 0.28066 0 0 0 absolute yes C2 C 0.21903 0.97338 0.28097 0 0 0 absolute yes O1 O 0.78066 0.134 0.28066 0 0 0 absolute yes C5 C 0.78097 0.02662 0.28097 0 0 0 absolute yes O3 O 0.21934 0.134 0.71934 0 0 0 absolute yes C1 C 0.21903 0.02662 0.71903 0 0 0 absolute yes N1 N 0.18232 0.04739 0.68232 0 0 0 absolute yes O1 O 0.78066 0.71934 0.134 0 0 0 absolute yes C4 C 0.78097 0.71903 0.02662 0 0 0 absolute yes O1 O 0.21934 0.28066 0.134 0 0 0 absolute yes C2 C 0.21903 0.28097 0.02662 0 0 0 absolute yes O3 O 0.78066 0.28066 0.866 0 0 0 absolute yes C1 C 0.78097 0.28097 0.97338 0 0 0 absolute yes N1 N 0.81768 0.31768 0.95261 0 0 0 absolute yes O1 O 0.21934 0.71934 0.866 0 0 0 absolute yes C5 C 0.21903 0.71903 0.97338 0 0 0 absolute yes O1 O 0.71934 0.866 0.21934 0 0 0 absolute yes C2 C 0.71903 0.97338 0.21903 0 0 0 absolute yes O1 O 0.28066 0.866 0.78066 0 0 0 absolute yes C4 C 0.28097 0.97338 0.78097 0 0 0 absolute yes O1 O 0.28066 0.134 0.21934 0 0 0 absolute yes C5 C 0.28097 0.02662 0.21903 0 0 0 absolute yes O3 O 0.71934 0.134 0.78066 0 0 0 absolute yes C1 C 0.71903 0.02662 0.78097 0 0 0 absolute yes N1 N 0.68232 0.04739 0.81768 0 0 0 absolute yes O3 O 0.866 0.78066 0.28066 0 0 0 absolute yes C1 C 0.97338 0.78097 0.28097 0 0 0 absolute yes N1 N 0.95261 0.81768 0.31768 0 0 0 absolute yes O1 O 0.866 0.21934 0.71934 0 0 0 absolute yes C5 C 0.97338 0.21903 0.71903 0 0 0 absolute yes O1 O 0.134 0.78066 0.71934 0 0 0 absolute yes C2 C 0.02662 0.78097 0.71903 0 0 0 absolute yes O1 O 0.134 0.21934 0.28066 0 0 0 absolute yes C4 C 0.02662 0.21903 0.28097 0 0 0 absolute yes Zn1 Zn 0.29342 0.70658 0.70658 0 0 0 absolute yes O1 O 0.28066 0.71934 0.634 0 0 0 absolute yes C8 C 0.25 0.75 0.61052 0 0 0 absolute yes C3 C 0.25 0.75 0.55568 0 0 0 absolute yes C4 C 0.28097 0.71903 0.52662 0 0 0 absolute yes Zn1 Zn 0.70658 0.29342 0.70658 0 0 0 absolute yes O1 O 0.71934 0.28066 0.634 0 0 0 absolute yes C8 C 0.75 0.25 0.61052 0 0 0 absolute yes C3 C 0.75 0.25 0.55568 0 0 0 absolute yes C2 C 0.71903 0.28097 0.52662 0 0 0 absolute yes Zn1 Zn 0.70658 0.70658 0.29342 0 0 0 absolute yes O1 O 0.71934 0.71934 0.366 0 0 0 absolute yes C7 C 0.75 0.75 0.38948 0 0 0 absolute yes C6 C 0.75 0.75 0.44432 0 0 0 absolute yes C5 C 0.71903 0.71903 0.47338 0 0 0 absolute yes Zn1 Zn 0.29342 0.29342 0.29342 0 0 0 absolute yes O3 O 0.28066 0.28066 0.366 0 0 0 absolute yes C7 C 0.25 0.25 0.38948 0 0 0 absolute yes C6 C 0.25 0.25 0.44432 0 0 0 absolute yes C1 C 0.28097 0.28097 0.47338 0 0 0 absolute yes N1 N 0.31768 0.31768 0.45261 0 0 0 absolute yes O3 O 0.21934 0.634 0.78066 0 0 0 absolute yes C7 C 0.25 0.61052 0.75 0 0 0 absolute yes C6 C 0.25 0.55568 0.75 0 0 0 absolute yes C1 C 0.21903 0.52662 0.78097 0 0 0 absolute yes N1 N 0.18232 0.54739 0.81768 0 0 0 absolute yes O1 O 0.78066 0.634 0.21934 0 0 0 absolute yes C7 C 0.75 0.61052 0.25 0 0 0 absolute yes C6 C 0.75 0.55568 0.25 0 0 0 absolute yes C5 C 0.78097 0.52662 0.21903 0 0 0 absolute yes O1 O 0.21934 0.366 0.21934 0 0 0 absolute yes C8 C 0.25 0.38948 0.25 0 0 0 absolute yes C3 C 0.25 0.44432 0.25 0 0 0 absolute yes C2 C 0.21903 0.47338 0.21903 0 0 0 absolute yes O1 O 0.78066 0.366 0.78066 0 0 0 absolute yes C8 C 0.75 0.38948 0.75 0 0 0 absolute yes C3 C 0.75 0.44432 0.75 0 0 0 absolute yes C4 C 0.78097 0.47338 0.78097 0 0 0 absolute yes O3 O 0.21934 0.78066 0.366 0 0 0 absolute yes C7 C 0.25 0.75 0.38948 0 0 0 absolute yes C6 C 0.25 0.75 0.44432 0 0 0 absolute yes C1 C 0.21903 0.78097 0.47338 0 0 0 absolute yes N1 N 0.18232 0.81768 0.45261 0 0 0 absolute yes O1 O 0.78066 0.21934 0.366 0 0 0 absolute yes C7 C 0.75 0.25 0.38948 0 0 0 absolute yes C6 C 0.75 0.25 0.44432 0 0 0 absolute yes C5 C 0.78097 0.21903 0.47338 0 0 0 absolute yes O1 O 0.21934 0.21934 0.634 0 0 0 absolute yes C8 C 0.25 0.25 0.61052 0 0 0 absolute yes C3 C 0.25 0.25 0.55568 0 0 0 absolute yes C4 C 0.21903 0.21903 0.52662 0 0 0 absolute yes O1 O 0.78066 0.78066 0.634 0 0 0 absolute yes C8 C 0.75 0.75 0.61052 0 0 0 absolute yes C3 C 0.75 0.75 0.55568 0 0 0 absolute yes C2 C 0.78097 0.78097 0.52662 0 0 0 absolute yes Zn1 Zn 0.29342 0.70658 0.29342 0 0 0 absolute yes O1 O 0.28066 0.634 0.28066 0 0 0 absolute yes C7 C 0.25 0.61052 0.25 0 0 0 absolute yes C6 C 0.25 0.55568 0.25 0 0 0 absolute yes C5 C 0.28097 0.52662 0.28097 0 0 0 absolute yes Zn1 Zn 0.70658 0.70658 0.70658 0 0 0 absolute yes O3 O 0.71934 0.634 0.71934 0 0 0 absolute yes C7 C 0.75 0.61052 0.75 0 0 0 absolute yes C6 C 0.75 0.55568 0.75 0 0 0 absolute yes C1 C 0.71903 0.52662 0.71903 0 0 0 absolute yes N1 N 0.68232 0.54739 0.68232 0 0 0 absolute yes Zn1 Zn 0.70658 0.29342 0.29342 0 0 0 absolute yes O1 O 0.71934 0.366 0.28066 0 0 0 absolute yes C8 C 0.75 0.38948 0.25 0 0 0 absolute yes C3 C 0.75 0.44432 0.25 0 0 0 absolute yes C2 C 0.71903 0.47338 0.28097 0 0 0 absolute yes Zn1 Zn 0.29342 0.29342 0.70658 0 0 0 absolute yes O1 O 0.28066 0.366 0.71934 0 0 0 absolute yes C8 C 0.25 0.38948 0.75 0 0 0 absolute yes C3 C 0.25 0.44432 0.75 0 0 0 absolute yes C4 C 0.28097 0.47338 0.71903 0 0 0 absolute yes O3 O 0.71934 0.28066 0.366 0 0 0 absolute yes C1 C 0.71903 0.28097 0.47338 0 0 0 absolute yes N1 N 0.68232 0.31768 0.45261 0 0 0 absolute yes O1 O 0.28066 0.71934 0.366 0 0 0 absolute yes C5 C 0.28097 0.71903 0.47338 0 0 0 absolute yes O1 O 0.28066 0.28066 0.634 0 0 0 absolute yes C2 C 0.28097 0.28097 0.52662 0 0 0 absolute yes O1 O 0.71934 0.71934 0.634 0 0 0 absolute yes C4 C 0.71903 0.71903 0.52662 0 0 0 absolute yes O1 O 0.78066 0.366 0.21934 0 0 0 absolute yes C4 C 0.78097 0.47338 0.21903 0 0 0 absolute yes O1 O 0.21934 0.366 0.78066 0 0 0 absolute yes C2 C 0.21903 0.47338 0.78097 0 0 0 absolute yes O1 O 0.78066 0.634 0.78066 0 0 0 absolute yes C5 C 0.78097 0.52662 0.78097 0 0 0 absolute yes O3 O 0.21934 0.634 0.21934 0 0 0 absolute yes C1 C 0.21903 0.52662 0.21903 0 0 0 absolute yes N1 N 0.18232 0.54739 0.18232 0 0 0 absolute yes O1 O 0.78066 0.21934 0.634 0 0 0 absolute yes C4 C 0.78097 0.21903 0.52662 0 0 0 absolute yes O1 O 0.21934 0.78066 0.634 0 0 0 absolute yes C2 C 0.21903 0.78097 0.52662 0 0 0 absolute yes O3 O 0.78066 0.78066 0.366 0 0 0 absolute yes C1 C 0.78097 0.78097 0.47338 0 0 0 absolute yes N1 N 0.81768 0.81768 0.45261 0 0 0 absolute yes O1 O 0.21934 0.21934 0.366 0 0 0 absolute yes C5 C 0.21903 0.21903 0.47338 0 0 0 absolute yes O1 O 0.71934 0.366 0.71934 0 0 0 absolute yes C2 C 0.71903 0.47338 0.71903 0 0 0 absolute yes O1 O 0.28066 0.366 0.28066 0 0 0 absolute yes C4 C 0.28097 0.47338 0.28097 0 0 0 absolute yes O1 O 0.28066 0.634 0.71934 0 0 0 absolute yes C5 C 0.28097 0.52662 0.71903 0 0 0 absolute yes O3 O 0.71934 0.634 0.28066 0 0 0 absolute yes C1 C 0.71903 0.52662 0.28097 0 0 0 absolute yes N1 N 0.68232 0.54739 0.31768 0 0 0 absolute yes O1 O 0.634 0.28066 0.71934 0 0 0 absolute yes C8 C 0.61052 0.25 0.75 0 0 0 absolute yes C3 C 0.55568 0.25 0.75 0 0 0 absolute yes C2 C 0.52662 0.28097 0.71903 0 0 0 absolute yes O1 O 0.634 0.71934 0.28066 0 0 0 absolute yes C8 C 0.61052 0.75 0.25 0 0 0 absolute yes C3 C 0.55568 0.75 0.25 0 0 0 absolute yes C4 C 0.52662 0.71903 0.28097 0 0 0 absolute yes O1 O 0.366 0.71934 0.71934 0 0 0 absolute yes C7 C 0.38948 0.75 0.75 0 0 0 absolute yes C6 C 0.44432 0.75 0.75 0 0 0 absolute yes C5 C 0.47338 0.71903 0.71903 0 0 0 absolute yes O3 O 0.366 0.28066 0.28066 0 0 0 absolute yes C7 C 0.38948 0.25 0.25 0 0 0 absolute yes C6 C 0.44432 0.25 0.25 0 0 0 absolute yes C1 C 0.47338 0.28097 0.28097 0 0 0 absolute yes N1 N 0.45261 0.31768 0.31768 0 0 0 absolute yes O1 O 0.634 0.21934 0.21934 0 0 0 absolute yes C8 C 0.61052 0.25 0.25 0 0 0 absolute yes C3 C 0.55568 0.25 0.25 0 0 0 absolute yes C4 C 0.52662 0.21903 0.21903 0 0 0 absolute yes O1 O 0.634 0.78066 0.78066 0 0 0 absolute yes C8 C 0.61052 0.75 0.75 0 0 0 absolute yes C3 C 0.55568 0.75 0.75 0 0 0 absolute yes C2 C 0.52662 0.78097 0.78097 0 0 0 absolute yes O1 O 0.366 0.21934 0.78066 0 0 0 absolute yes C7 C 0.38948 0.25 0.75 0 0 0 absolute yes C6 C 0.44432 0.25 0.75 0 0 0 absolute yes C5 C 0.47338 0.21903 0.78097 0 0 0 absolute yes O3 O 0.366 0.78066 0.21934 0 0 0 absolute yes C7 C 0.38948 0.75 0.25 0 0 0 absolute yes C6 C 0.44432 0.75 0.25 0 0 0 absolute yes C1 C 0.47338 0.78097 0.21903 0 0 0 absolute yes N1 N 0.45261 0.81768 0.18232 0 0 0 absolute yes O1 O 0.366 0.71934 0.28066 0 0 0 absolute yes C5 C 0.47338 0.71903 0.28097 0 0 0 absolute yes O3 O 0.366 0.28066 0.71934 0 0 0 absolute yes C1 C 0.47338 0.28097 0.71903 0 0 0 absolute yes N1 N 0.45261 0.31768 0.68232 0 0 0 absolute yes O1 O 0.634 0.28066 0.28066 0 0 0 absolute yes C2 C 0.52662 0.28097 0.28097 0 0 0 absolute yes O1 O 0.634 0.71934 0.71934 0 0 0 absolute yes C4 C 0.52662 0.71903 0.71903 0 0 0 absolute yes O3 O 0.366 0.78066 0.78066 0 0 0 absolute yes C1 C 0.47338 0.78097 0.78097 0 0 0 absolute yes N1 N 0.45261 0.81768 0.81768 0 0 0 absolute yes O1 O 0.366 0.21934 0.21934 0 0 0 absolute yes C5 C 0.47338 0.21903 0.21903 0 0 0 absolute yes O1 O 0.634 0.78066 0.21934 0 0 0 absolute yes C2 C 0.52662 0.78097 0.21903 0 0 0 absolute yes O1 O 0.634 0.21934 0.78066 0 0 0 absolute yes C4 C 0.52662 0.21903 0.78097 0 0 0 absolute yes H3 H 0.80357 0.54507 0.80357 0 0 0 absolute yes H2 H 0.80434 0.45696 0.80434 0 0 0 absolute yes H1 H 0.69566 0.45696 0.69566 0 0 0 absolute yes H1 H 0.69566 0.45696 0.30434 0 0 0 absolute yes H2 H 0.80357 0.45493 0.19643 0 0 0 absolute yes H3 H 0.80434 0.54304 0.19566 0 0 0 absolute yes H2 H 0.54507 0.69643 0.69643 0 0 0 absolute yes H1 H 0.54304 0.80434 0.80434 0 0 0 absolute yes H3 H 0.45696 0.69566 0.69566 0 0 0 absolute yes H2 H 0.54304 0.69566 0.30434 0 0 0 absolute yes H3 H 0.45493 0.69643 0.30357 0 0 0 absolute yes H1 H 0.54304 0.80434 0.19566 0 0 0 absolute yes H1 H 0.54507 0.30357 0.30357 0 0 0 absolute yes H2 H 0.54304 0.19566 0.19566 0 0 0 absolute yes H3 H 0.45696 0.19566 0.19566 0 0 0 absolute yes H4 H 0.41801 0.3212 0.3212 0 0 0 absolute yes H4 H 0.47422 0.33711 0.33711 0 0 0 absolute yes H4 H 0.6788 0.58199 0.6788 0 0 0 absolute yes H4 H 0.66289 0.52578 0.66289 0 0 0 absolute yes H4 H 0.91801 0.3212 0.1788 0 0 0 absolute yes H4 H 0.97422 0.33711 0.16289 0 0 0 absolute yes H2 H 0.54304 0.19566 0.80434 0 0 0 absolute yes H1 H 0.54304 0.30434 0.69566 0 0 0 absolute yes H3 H 0.45696 0.19566 0.80434 0 0 0 absolute yes H4 H 0.47422 0.33711 0.66289 0 0 0 absolute yes H4 H 0.41801 0.3212 0.6788 0 0 0 absolute yes H4 H 0.41801 0.8212 0.8212 0 0 0 absolute yes H4 H 0.47422 0.83711 0.83711 0 0 0 absolute yes H4 H 0.41801 0.8212 0.1788 0 0 0 absolute yes H4 H 0.47422 0.83711 0.16289 0 0 0 absolute yes H4 H 0.91801 0.8212 0.3212 0 0 0 absolute yes H4 H 0.97422 0.83711 0.33711 0 0 0 absolute yes H4 H 0.91801 0.8212 0.6788 0 0 0 absolute yes H4 H 0.97422 0.83711 0.66289 0 0 0 absolute yes H4 H 0.91801 0.3212 0.8212 0 0 0 absolute yes H4 H 0.97422 0.33711 0.83711 0 0 0 absolute yes H4 H 0.6788 0.08199 0.8212 0 0 0 absolute yes H4 H 0.66289 0.02578 0.83711 0 0 0 absolute yes H4 H 0.6788 0.08199 0.1788 0 0 0 absolute yes H4 H 0.66289 0.02578 0.16289 0 0 0 absolute yes H4 H 0.66289 0.33711 0.47422 0 0 0 absolute yes H4 H 0.6788 0.3212 0.41801 0 0 0 absolute yes H4 H 0.8212 0.3212 0.91801 0 0 0 absolute yes H4 H 0.83711 0.33711 0.97422 0 0 0 absolute yes H4 H 0.1788 0.08199 0.6788 0 0 0 absolute yes H4 H 0.16289 0.02578 0.66289 0 0 0 absolute yes H4 H 0.1788 0.3212 0.91801 0 0 0 absolute yes H4 H 0.16289 0.33711 0.97422 0 0 0 absolute yes H4 H 0.1788 0.08199 0.3212 0 0 0 absolute yes H4 H 0.16289 0.02578 0.33711 0 0 0 absolute yes H4 H 0.1788 0.58199 0.8212 0 0 0 absolute yes H4 H 0.16289 0.52578 0.83711 0 0 0 absolute yes H1 H 0.19643 0.45493 0.80357 0 0 0 absolute yes H2 H 0.30434 0.45696 0.69566 0 0 0 absolute yes H3 H 0.30434 0.54304 0.69566 0 0 0 absolute yes H4 H 0.1788 0.8212 0.41801 0 0 0 absolute yes H4 H 0.16289 0.83711 0.47422 0 0 0 absolute yes H1 H 0.19566 0.80434 0.54304 0 0 0 absolute yes H2 H 0.30434 0.69566 0.54304 0 0 0 absolute yes H3 H 0.30357 0.69643 0.45493 0 0 0 absolute yes H3 H 0.19566 0.19566 0.45696 0 0 0 absolute yes H2 H 0.19566 0.19566 0.54304 0 0 0 absolute yes H1 H 0.30357 0.30357 0.54507 0 0 0 absolute yes H4 H 0.3212 0.3212 0.41801 0 0 0 absolute yes H4 H 0.33711 0.33711 0.47422 0 0 0 absolute yes H3 H 0.69566 0.69566 0.45696 0 0 0 absolute yes H4 H 0.8212 0.8212 0.41801 0 0 0 absolute yes H4 H 0.83711 0.83711 0.47422 0 0 0 absolute yes H2 H 0.69643 0.69643 0.54507 0 0 0 absolute yes H1 H 0.80434 0.80434 0.54304 0 0 0 absolute yes H1 H 0.69566 0.30434 0.54304 0 0 0 absolute yes H3 H 0.80434 0.19566 0.45696 0 0 0 absolute yes H2 H 0.80434 0.19566 0.54304 0 0 0 absolute yes H4 H 0.6788 0.8212 0.91801 0 0 0 absolute yes H4 H 0.66289 0.83711 0.97422 0 0 0 absolute yes H4 H 0.6788 0.58199 0.3212 0 0 0 absolute yes H4 H 0.66289 0.52578 0.33711 0 0 0 absolute yes H2 H 0.30434 0.45696 0.30434 0 0 0 absolute yes H3 H 0.30434 0.54304 0.30434 0 0 0 absolute yes H1 H 0.19566 0.45696 0.19566 0 0 0 absolute yes H4 H 0.16289 0.52578 0.16289 0 0 0 absolute yes H4 H 0.1788 0.58199 0.1788 0 0 0 absolute yes H4 H 0.3212 0.8212 0.91801 0 0 0 absolute yes H4 H 0.33711 0.83711 0.97422 0 0 0 absolute yes H3 H 0.95696 0.19566 0.30434 0 0 0 absolute yes H3 H 0.95696 0.19566 0.69566 0 0 0 absolute yes H3 H 0.95696 0.69566 0.80434 0 0 0 absolute yes H3 H 0.95696 0.69566 0.19566 0 0 0 absolute yes H2 H 0.04304 0.69566 0.19566 0 0 0 absolute yes H3 H 0.80434 0.04304 0.30434 0 0 0 absolute yes H3 H 0.80434 0.04304 0.69566 0 0 0 absolute yes H3 H 0.30434 0.04304 0.80434 0 0 0 absolute yes H3 H 0.30434 0.04304 0.19566 0 0 0 absolute yes H3 H 0.69566 0.19566 0.95696 0 0 0 absolute yes H3 H 0.30434 0.19566 0.95696 0 0 0 absolute yes H3 H 0.19566 0.69566 0.95696 0 0 0 absolute yes H3 H 0.80434 0.69566 0.95696 0 0 0 absolute yes H1 H 0.30434 0.80434 0.04304 0 0 0 absolute yes H2 H 0.19566 0.69566 0.04304 0 0 0 absolute yes H2 H 0.30434 0.19566 0.04304 0 0 0 absolute yes H1 H 0.19566 0.30434 0.04304 0 0 0 absolute yes H2 H 0.69566 0.19566 0.04304 0 0 0 absolute yes H1 H 0.80434 0.30434 0.04304 0 0 0 absolute yes H1 H 0.69566 0.80434 0.04304 0 0 0 absolute yes H2 H 0.80434 0.69566 0.04304 0 0 0 absolute yes H2 H 0.04304 0.19566 0.30434 0 0 0 absolute yes H1 H 0.04304 0.30434 0.19566 0 0 0 absolute yes H1 H 0.04304 0.80434 0.30434 0 0 0 absolute yes H1 H 0.04304 0.80434 0.69566 0 0 0 absolute yes H2 H 0.04304 0.19566 0.69566 0 0 0 absolute yes H1 H 0.04304 0.30434 0.80434 0 0 0 absolute yes H2 H 0.04304 0.69566 0.80434 0 0 0 absolute yes H1 H 0.69566 0.95696 0.19566 0 0 0 absolute yes H2 H 0.80434 0.95696 0.30434 0 0 0 absolute yes H2 H 0.80434 0.95696 0.69566 0 0 0 absolute yes H1 H 0.69566 0.95696 0.80434 0 0 0 absolute yes H2 H 0.30434 0.95696 0.80434 0 0 0 absolute yes H1 H 0.19566 0.95696 0.69566 0 0 0 absolute yes H2 H 0.30434 0.95696 0.19566 0 0 0 absolute yes H1 H 0.19566 0.95696 0.30434 0 0 0 absolute yes