data_34401 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution NMR structure of the peptide 3967 from medicinal leech Hirudo medicinalis in dodecylphosphocholine micelles ; _BMRB_accession_number 34401 _BMRB_flat_file_name bmr34401.str _Entry_type original _Submission_date 2019-05-20 _Accession_date 2019-05-20 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Nadezhdin K. D. . 2 Grafskaia E. N. . 3 Arseniev A. S. . 4 Lazarev V. N. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 spectral_peak_list 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 92 "13C chemical shifts" 52 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-10-22 original BMRB . stop_ _Original_release_date 2019-10-11 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Medicinal leech antimicrobial peptides lacking toxicity represent a promising alternative strategy to combat antibiotic-resistant pathogens. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31302447 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Grafskaia E. N. . 2 Nadezhdin K. D. . 3 Talyzina I. A. . 4 Polina N. F. . 5 Podgorny O. V. . 6 Pavlova E. R. . 7 Bashkirov P. V. . 8 Kharlampieva D. D. . 9 Bobrovsky P. A. . 10 Latsis I. A. . 11 Manuvera V. A. . 12 Babenko V. V. . 13 Trukhan V. M. . 14 Arseniev A. S. . 15 Klinov D. V. . 16 Lazarev V. N. . stop_ _Journal_abbreviation 'Eur. J. Med. Chem.' _Journal_volume 180 _Journal_issue . _Journal_ASTM EJMCA5 _Journal_ISSN 0223-5234 _Journal_CSD 0493 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 143 _Page_last 153 _Year 2019 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'peptide 3967' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass 1562.066 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 12 _Mol_residue_sequence ; FRIMRILRVLKL ; loop_ _Residue_seq_code _Residue_label 1 PHE 2 ARG 3 ILE 4 MET 5 ARG 6 ILE 7 LEU 8 ARG 9 VAL 10 LEU 11 LYS 12 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 'medicinal leech' 6421 Eukaryota Metazoa Hirudo medicinalis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type micelle _Details '1 mM peptide 3967, 100 mM dodecylphosphocholine, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM 'natural abundance' dodecylphosphocholine 100 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name PSVS _Version . loop_ _Vendor _Address _Electronic_address 'Bhattacharya and Montelione' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_software_2 _Saveframe_category software _Name TopSpin _Version 3.98.5 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3 _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure calculation' stop_ _Details . save_ save_software_4 _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-1H_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_1 save_ save_2D_1H-1H_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0 . mM pH 4 0.1 pH pressure 1 . atm temperature 303 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio TSP C 13 'methyl carbons' ppm 0 external direct . . . 1.0 water H 1 protons ppm 4.7 internal direct . . . 1.0 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-1H NOESY' '2D 1H-1H TOCSY' '2D 1H-13C HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name entity_1 _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 PHE HA H 4.296 0.020 1 2 1 1 PHE HB2 H 3.220 0.020 1 3 1 1 PHE HB3 H 3.220 0.020 1 4 1 1 PHE HD1 H 7.260 0.020 1 5 1 1 PHE HD2 H 7.260 0.020 1 6 1 1 PHE HE1 H 7.168 0.020 1 7 1 1 PHE HE2 H 7.168 0.020 1 8 1 1 PHE CA C 56.893 0.3 1 9 1 1 PHE CB C 39.199 0.3 1 10 2 2 ARG H H 8.695 0.020 1 11 2 2 ARG HA H 4.546 0.020 1 12 2 2 ARG HB2 H 1.748 0.020 2 13 2 2 ARG HB3 H 1.863 0.020 2 14 2 2 ARG HG2 H 1.689 0.020 2 15 2 2 ARG HG3 H 1.598 0.020 2 16 2 2 ARG HD2 H 3.206 0.020 1 17 2 2 ARG HD3 H 3.206 0.020 1 18 2 2 ARG HE H 7.381 0.020 1 19 2 2 ARG CA C 53.731 0.3 1 20 2 2 ARG CB C 30.315 0.3 1 21 2 2 ARG CG C 26.531 0.3 1 22 2 2 ARG CD C 42.916 0.3 1 23 3 3 ILE H H 8.570 0.020 1 24 3 3 ILE HA H 3.903 0.020 1 25 3 3 ILE HB H 1.894 0.020 1 26 3 3 ILE HG12 H 1.571 0.020 2 27 3 3 ILE HG13 H 1.277 0.020 2 28 3 3 ILE HG2 H 0.930 0.020 1 29 3 3 ILE HD1 H 0.932 0.020 1 30 3 3 ILE CA C 62.746 0.3 1 31 3 3 ILE CB C 37.949 0.3 1 32 3 3 ILE CG1 C 28.510 0.3 1 33 3 3 ILE CG2 C 17.589 0.3 1 34 3 3 ILE CD1 C 13.326 0.3 1 35 4 4 MET H H 8.593 0.020 1 36 4 4 MET HA H 4.293 0.020 1 37 4 4 MET HB2 H 2.072 0.020 2 38 4 4 MET HB3 H 2.039 0.020 2 39 4 4 MET HG2 H 2.617 0.020 2 40 4 4 MET HG3 H 2.710 0.020 2 41 4 4 MET HE H 2.035 0.020 1 42 4 4 MET CA C 56.317 0.3 1 43 4 4 MET CB C 30.448 0.3 1 44 4 4 MET CG C 32.061 0.3 1 45 4 4 MET CE C 16.256 0.3 1 46 5 5 ARG H H 7.781 0.020 1 47 5 5 ARG HA H 4.031 0.020 1 48 5 5 ARG HB2 H 1.878 0.020 1 49 5 5 ARG HB3 H 1.878 0.020 1 50 5 5 ARG HG2 H 1.670 0.020 2 51 5 5 ARG HG3 H 1.624 0.020 2 52 5 5 ARG HD2 H 3.109 0.020 2 53 5 5 ARG HD3 H 3.193 0.020 2 54 5 5 ARG HE H 7.475 0.020 1 55 5 5 ARG CA C 58.239 0.3 1 56 5 5 ARG CB C 29.592 0.3 1 57 5 5 ARG CG C 26.967 0.3 1 58 5 5 ARG CD C 42.933 0.3 1 59 6 6 ILE H H 7.525 0.020 1 60 6 6 ILE HA H 3.873 0.020 1 61 6 6 ILE HB H 2.032 0.020 1 62 6 6 ILE HG12 H 1.619 0.020 2 63 6 6 ILE HG13 H 1.272 0.020 2 64 6 6 ILE HG2 H 0.910 0.020 1 65 6 6 ILE HD1 H 0.879 0.020 1 66 6 6 ILE CA C 62.848 0.3 1 67 6 6 ILE CB C 37.595 0.3 1 68 6 6 ILE CG1 C 28.374 0.3 1 69 6 6 ILE CG2 C 17.363 0.3 1 70 6 6 ILE CD1 C 12.935 0.3 1 71 7 7 LEU H H 7.716 0.020 1 72 7 7 LEU HA H 3.973 0.020 1 73 7 7 LEU HB2 H 1.861 0.020 2 74 7 7 LEU HB3 H 1.541 0.020 2 75 7 7 LEU HG H 1.828 0.020 1 76 7 7 LEU HD1 H 0.928 0.020 2 77 7 7 LEU HD2 H 0.830 0.020 2 78 7 7 LEU CA C 57.276 0.3 1 79 7 7 LEU CB C 40.681 0.3 1 80 7 7 LEU CG C 26.733 0.3 1 81 7 7 LEU CD1 C 25.380 0.3 1 82 7 7 LEU CD2 C 22.704 0.3 1 83 8 8 ARG H H 7.723 0.020 1 84 8 8 ARG HA H 4.131 0.020 1 85 8 8 ARG HB2 H 1.907 0.020 1 86 8 8 ARG HB3 H 1.907 0.020 1 87 8 8 ARG HG2 H 1.744 0.020 2 88 8 8 ARG HG3 H 1.688 0.020 2 89 8 8 ARG HD2 H 3.164 0.020 1 90 8 8 ARG HD3 H 3.164 0.020 1 91 8 8 ARG HE H 7.394 0.020 1 92 8 8 ARG CA C 57.913 0.3 1 93 8 8 ARG CB C 29.731 0.3 1 94 8 8 ARG CG C 27.277 0.3 1 95 8 8 ARG CD C 42.920 0.3 1 96 9 9 VAL H H 7.535 0.020 1 97 9 9 VAL HA H 4.034 0.020 1 98 9 9 VAL HB H 2.295 0.020 1 99 9 9 VAL HG1 H 0.981 0.020 2 100 9 9 VAL HG2 H 1.063 0.020 2 101 9 9 VAL CA C 63.377 0.3 1 102 9 9 VAL CB C 31.492 0.3 1 103 9 9 VAL CG1 C 21.038 0.3 1 104 9 9 VAL CG2 C 20.974 0.3 1 105 10 10 LEU H H 7.376 0.020 1 106 10 10 LEU HA H 4.202 0.020 1 107 10 10 LEU HB2 H 1.750 0.020 2 108 10 10 LEU HB3 H 1.550 0.020 2 109 10 10 LEU HG H 1.819 0.020 1 110 10 10 LEU HD1 H 0.858 0.020 2 111 10 10 LEU HD2 H 0.823 0.020 2 112 10 10 LEU CA C 54.741 0.3 1 113 10 10 LEU CB C 41.897 0.3 1 114 10 10 LEU CG C 26.308 0.3 1 115 10 10 LEU CD1 C 25.535 0.3 1 116 10 10 LEU CD2 C 22.590 0.3 1 117 11 11 LYS H H 7.690 0.020 1 118 11 11 LYS HA H 4.149 0.020 1 119 11 11 LYS HB2 H 1.867 0.020 1 120 11 11 LYS HB3 H 1.867 0.020 1 121 11 11 LYS HG2 H 1.675 0.020 1 122 11 11 LYS HG3 H 1.675 0.020 1 123 11 11 LYS HD2 H 1.365 0.020 2 124 11 11 LYS HD3 H 1.409 0.020 2 125 11 11 LYS HE2 H 2.976 0.020 1 126 11 11 LYS HE3 H 2.976 0.020 1 127 11 11 LYS HZ H 7.584 0.020 1 128 11 11 LYS CA C 55.758 0.3 1 129 11 11 LYS CB C 30.975 0.3 1 130 11 11 LYS CG C 28.701 0.3 1 131 11 11 LYS CD C 24.307 0.3 1 132 11 11 LYS CE C 41.795 0.3 1 133 12 12 LEU H H 7.892 0.020 1 134 12 12 LEU HA H 4.288 0.020 1 135 12 12 LEU HB2 H 1.634 0.020 2 136 12 12 LEU HB3 H 1.556 0.020 2 137 12 12 LEU HG H 1.671 0.020 1 138 12 12 LEU HD1 H 0.896 0.020 2 139 12 12 LEU HD2 H 0.854 0.020 2 140 12 12 LEU CA C 54.018 0.3 1 141 12 12 LEU CB C 42.470 0.3 1 142 12 12 LEU CG C 26.545 0.3 1 143 12 12 LEU CD1 C 25.472 0.3 1 144 12 12 LEU CD2 C 23.078 0.3 1 stop_ save_ save_spectral_peak_list_1 _Saveframe_category spectral_peak_list _Details . _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H 2 H H stop_ _Sample_label $sample_1 _Sample_conditions_label $sample_conditions_1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_spectral_peak_list_1 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode spectral_peak_list_1 >> _Spectral_peak_list.Entry_ID 34401 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Name . >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $sample_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 >> _Spectral_peak_list.Experiment_ID 1 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Experiment_class . >> _Spectral_peak_list.Experiment_type . >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Chemical_shift_list . >> _Spectral_peak_list.Assigned_chem_shift_list_ID 1 >> _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 >> _Spectral_peak_list.Details . >> _Spectral_peak_list.Text_data_format text >> _Spectral_peak_list.Text_data >>; >># Number of dimensions 2 >>#INAME 1 H1 >>#INAME 2 H1 >> 1 1.277 8.593 0 U 6.582e+02 0.00e+00 - 0 60 1 0 >># HG13 I3/H M4 >> 2 8.593 1.277 0 U 1.237e+03 0.00e+00 - 0 1 60 0 >># H M4/HG13 I3 >> 3 1.571 8.593 0 U 1.091e+03 0.00e+00 - 0 59 1 0 >># HG12 I3/H M4 >> 4 8.593 1.571 0 U 1.757e+03 0.00e+00 - 0 1 59 0 >># H M4/HG12 I3 >> 5 3.903 3.903 0 U 8.032e+04 0.00e+00 - 0 8 8 0 >># HA/HA I3 >> 6 3.903 1.571 0 U 1.853e+03 0.00e+00 - 0 8 59 0 >># HA/HG12 I3 >> 7 3.903 7.260 0 U 1.097e+03 0.00e+00 - 0 8 135 0 >># HA I3/HD F1 >> 8 3.903 7.525 0 U 1.165e+03 0.00e+00 - 0 8 15 0 >># HA I3/H I6 >> 9 3.903 0.932 0 U 2.888e+04 0.00e+00 - 0 8 70 0 >># HA/HD1 I3 >> 10 3.903 0.930 0 U -2.037e+04 0.00e+00 - 0 8 58 0 >># HA/HG2 I3 >> 11 3.903 8.570 0 U 3.074e+03 0.00e+00 - 0 8 7 0 >># HA/H I3 >> 12 3.903 1.277 0 U 2.558e+03 0.00e+00 - 0 8 60 0 >># HA/HG13 I3 >> 13 3.903 0.879 0 U 1.930e+03 0.00e+00 - 0 8 69 0 >># HA I3/HD1 I6 >> 14 3.903 1.894 0 U 4.686e+03 0.00e+00 - 0 8 57 0 >># HA/HB I3 >> 15 3.903 7.781 0 U 7.943e+02 0.00e+00 - 0 8 11 0 >># HA I3/H R5 >> 16 3.903 8.593 0 U 2.302e+03 0.00e+00 - 0 8 1 0 >># HA I3/H M4 >> 17 1.556 1.556 0 U 3.255e+05 0.00e+00 - 0 125 125 0 >># HB3/HB3 L12 >> 18 1.556 4.288 0 U 1.084e+04 0.00e+00 - 0 125 22 0 >># HB3/HA L12 >> 19 1.556 7.892 0 U 6.935e+03 0.00e+00 - 0 125 21 0 >># HB3/H L12 >> 20 1.556 1.634 0 U 5.862e+04 0.00e+00 - 0 125 42 0 >># HB3/HB2 L12 >> 21 1.556 0.854 0 U 4.321e+03 0.00e+00 - 0 125 44 0 >># HB3/HD2 L12 >> 22 1.556 1.671 0 U 3.462e+04 0.00e+00 - 0 125 94 0 >># HB3/HG L12 >> 23 1.556 0.896 0 U 1.690e+04 0.00e+00 - 0 125 43 0 >># HB3/HD1 L12 >> 24 1.907 1.907 0 U 1.758e+05 0.00e+00 - 0 33 33 0 >># HB/HB R8 >> 25 1.907 4.131 0 U 1.965e+04 0.00e+00 - 0 33 14 0 >># HB/HA R8 >> 26 1.907 1.744 0 U 2.619e+04 0.00e+00 - 0 33 35 0 >># HB/HG2 R8 >> 27 1.907 7.723 0 U 1.847e+04 0.00e+00 - 0 33 13 0 >># HB/H R8 >> 28 1.907 7.535 0 U 6.810e+03 0.00e+00 - 0 33 19 0 >># HB R8/H V9 >> 29 1.907 1.688 0 U 2.357e+04 0.00e+00 - 0 33 36 0 >># HB/HG3 R8 >> 30 1.907 7.394 0 U 1.948e+03 0.00e+00 - 0 33 134 0 >># HB/HE R8 >> 31 1.907 3.164 0 U 1.095e+04 0.00e+00 - 0 33 32 0 >># HB/HD R8 >> 32 3.206 3.206 0 U 1.892e+05 0.00e+00 - 0 24 24 0 >># HD/HD R2 >> 33 3.206 1.598 0 U 6.654e+03 0.00e+00 - 0 24 26 0 >># HD/HG3 R2 >> 34 3.206 7.381 0 U 1.447e+03 0.00e+00 - 0 24 128 0 >># HD/HE R2 >> 35 3.206 1.748 0 U 3.691e+03 0.00e+00 - 0 24 23 0 >># HD/HB2 R2 >> 36 3.206 8.695 0 U 5.562e+02 0.00e+00 - 0 24 3 0 >># HD/H R2 >> 37 3.206 1.689 0 U 6.288e+03 0.00e+00 - 0 24 25 0 >># HD/HG2 R2 >> 38 3.206 1.863 0 U 3.561e+03 0.00e+00 - 0 24 88 0 >># HD/HB3 R2 >> 39 3.206 4.546 0 U 2.347e+03 0.00e+00 - 0 24 4 0 >># HD/HA R2 >> 40 3.873 3.873 0 U 7.044e+04 0.00e+00 - 0 16 16 0 >># HA/HA I6 >> 41 3.873 1.063 0 U 3.296e+03 0.00e+00 - 0 16 74 0 >># HA I6/HG2 V9 >> 42 3.873 0.910 0 U 6.607e+03 0.00e+00 - 0 16 54 0 >># HA/HG2 I6 >> 43 3.873 7.525 0 U 3.606e+03 0.00e+00 - 0 16 15 0 >># HA/H I6 >> 44 3.873 7.716 0 U 1.648e+03 0.00e+00 - 0 16 5 0 >># HA I6/H L7 >> 45 3.873 1.272 0 U 2.744e+03 0.00e+00 - 0 16 56 0 >># HA/HG13 I6 >> 46 3.873 2.032 0 U 3.515e+03 0.00e+00 - 0 16 41 0 >># HA/HB I6 >> 47 3.873 1.619 0 U 2.182e+03 0.00e+00 - 0 16 55 0 >># HA/HG12 I6 >> 48 3.873 2.295 0 U 1.340e+03 0.00e+00 - 0 16 52 0 >># HA I6/HB V9 >> 49 3.873 0.879 0 U 1.312e+03 0.00e+00 - 0 16 69 0 >># HA/HD1 I6 >> 50 4.288 1.556 0 U 4.495e+02 0.00e+00 - 0 22 125 0 >># HA/HB3 L12 >> 51 4.288 4.288 0 U 3.966e+04 0.00e+00 - 0 22 22 0 >># HA/HA L12 >> 52 4.288 7.892 0 U 2.274e+02 0.00e+00 - 0 22 21 0 >># HA/H L12 >> 53 4.288 1.634 0 U 3.151e+02 0.00e+00 - 0 22 42 0 >># HA/HB2 L12 >> 54 4.288 0.854 0 U 5.971e+02 0.00e+00 - 0 22 44 0 >># HA/HD2 L12 >> 55 4.288 1.671 0 U 1.653e+02 0.00e+00 - 0 22 94 0 >># HA/HG L12 >> 56 4.288 0.896 0 U -8.731e+01 0.00e+00 - 0 22 43 0 >># HA/HD1 L12 >> 57 7.689 7.689 0 U 1.499e+05 0.00e+00 - 0 17 17 0 >># H/H K11 >> 58 7.689 1.669 0 U 2.397e+03 0.00e+00 - 0 17 49 0 >># H/HG K11 >> 59 7.689 7.374 0 U 9.333e+03 0.00e+00 - 0 17 9 0 >># H K11/H L10 >> 60 7.689 4.034 0 U 2.268e+03 0.00e+00 - 0 17 20 0 >># H K11/HA V9 >> 61 7.689 7.892 0 U 8.550e+03 0.00e+00 - 0 17 21 0 >># H K11/H L12 >> 62 7.689 2.976 0 U 4.627e+02 0.00e+00 - 0 17 51 0 >># H/HE K11 >> 63 7.689 1.550 0 U 4.164e+03 0.00e+00 - 0 17 61 0 >># H K11/HB3 L10 >> 64 7.689 1.867 0 U 1.315e+04 0.00e+00 - 0 17 48 0 >># H/HB K11 >> 65 7.689 1.409 0 U 3.998e+03 0.00e+00 - 0 17 132 0 >># H/HD3 K11 >> 66 7.689 4.202 0 U 1.581e+04 0.00e+00 - 0 17 10 0 >># H K11/HA L10 >> 67 7.689 4.149 0 U 2.537e+04 0.00e+00 - 0 17 18 0 >># H/HA K11 >> 68 7.689 1.365 0 U 3.604e+03 0.00e+00 - 0 17 50 0 >># H/HD2 K11 >> 69 7.689 7.584 0 U 1.371e+03 0.00e+00 - 0 17 133 0 >># H/HZ K11 >> 70 7.689 1.819 0 U 2.439e+03 0.00e+00 - 0 17 96 0 >># H K11/HG L10 >> 71 4.031 4.031 0 U 1.240e+05 0.00e+00 - 0 12 12 0 >># HA/HA R5 >> 72 4.031 1.624 0 U 1.147e+03 0.00e+00 - 0 12 31 0 >># HA/HG3 R5 >> 73 4.031 1.748 0 U 5.978e+02 0.00e+00 - 0 12 23 0 >># HA R5/HB2 R2 >> 74 4.031 7.525 0 U -1.094e+01 0.00e+00 - 0 12 15 0 >># HA R5/H I6 >> 75 4.031 7.475 0 U 1.357e+02 0.00e+00 - 0 12 129 0 >># HA/HE R5 >> 76 4.031 1.878 0 U 3.363e+03 0.00e+00 - 0 12 28 0 >># HA/HB R5 >> 77 4.031 1.670 0 U 1.255e+03 0.00e+00 - 0 12 30 0 >># HA/HG2 R5 >> 78 4.031 7.723 0 U 1.011e+03 0.00e+00 - 0 12 13 0 >># HA R5/H R8 >> 79 4.031 7.781 0 U 1.803e+03 0.00e+00 - 0 12 11 0 >># HA/H R5 >> 80 4.031 3.109 0 U 2.534e+02 0.00e+00 - 0 12 27 0 >># HA/HD2 R5 >> 81 4.031 3.193 0 U 6.298e+02 0.00e+00 - 0 12 130 0 >># HA/HD3 R5 >> 82 1.063 3.873 0 U 9.441e+03 0.00e+00 - 0 74 16 0 >># HG2 V9/HA I6 >> 83 1.063 1.063 0 U 1.277e+06 0.00e+00 - 0 74 74 0 >># HG2/HG2 V9 >> 84 1.063 7.374 0 U 4.210e+03 0.00e+00 - 0 74 9 0 >># HG2 V9/H L10 >> 85 1.063 4.034 0 U 1.760e+04 0.00e+00 - 0 74 20 0 >># HG2/HA V9 >> 86 1.063 0.986 0 U 4.849e+04 0.00e+00 - 0 74 53 0 >># HG2/HG1 V9 >> 87 1.063 7.535 0 U 1.608e+04 0.00e+00 - 0 74 19 0 >># HG2/H V9 >> 88 1.063 2.295 0 U 1.658e+04 0.00e+00 - 0 74 52 0 >># HG2/HB V9 >> 89 2.035 2.035 0 U 7.479e+07 0.00e+00 - 0 110 110 0 >># HE/HE M4 >> 90 2.035 2.710 0 U 2.282e+04 0.00e+00 - 0 110 40 0 >># HE/HG3 M4 >> 91 2.035 2.039 0 U -3.552e+07 0.00e+00 - 0 110 38 0 >># HE/HB3 M4 >> 92 2.035 2.617 0 U 1.061e+04 0.00e+00 - 0 110 39 0 >># HE/HG2 M4 >> 93 2.035 2.072 0 U 5.905e+05 0.00e+00 - 0 110 37 0 >># HE/HB2 M4 >> 94 2.035 4.293 0 U 1.784e+04 0.00e+00 - 0 110 2 0 >># HE/HA M4 >> 95 2.035 8.593 0 U 7.683e+03 0.00e+00 - 0 110 1 0 >># HE/H M4 >> 96 2.710 2.035 0 U 5.310e+03 0.00e+00 - 0 40 110 0 >># HG3/HE M4 >> 97 2.710 2.710 0 U 1.108e+05 0.00e+00 - 0 40 40 0 >># HG3/HG3 M4 >> 98 2.710 2.039 0 U 4.362e+03 0.00e+00 - 0 40 38 0 >># HG3/HB3 M4 >> 99 2.710 2.617 0 U 6.339e+04 0.00e+00 - 0 40 39 0 >># HG3/HG2 M4 >> 100 2.710 0.932 0 U 2.694e+03 0.00e+00 - 0 40 70 0 >># HG3 M4/HD1 I3 >> 101 2.710 2.072 0 U 6.295e+03 0.00e+00 - 0 40 37 0 >># HG3/HB2 M4 >> 102 2.710 4.293 0 U 3.247e+03 0.00e+00 - 0 40 2 0 >># HG3/HA M4 >> 103 2.710 7.781 0 U 5.793e+02 0.00e+00 - 0 40 11 0 >># HG3 M4/H R5 >> 104 2.710 8.593 0 U 3.329e+03 0.00e+00 - 0 40 1 0 >># HG3/H M4 >> 105 0.910 3.873 0 U 1.982e+04 0.00e+00 - 0 54 16 0 >># HG2/HA I6 >> 106 0.910 0.910 0 U -2.370e+06 0.00e+00 - 0 54 54 0 >># HG2/HG2 I6 >> 107 0.910 7.374 0 U 1.164e+03 0.00e+00 - 0 54 9 0 >># HG2 I6/H L10 >> 108 0.910 7.525 0 U 6.983e+03 0.00e+00 - 0 54 15 0 >># HG2/H I6 >> 109 0.910 1.272 0 U 1.259e+04 0.00e+00 - 0 54 56 0 >># HG2/HG13 I6 >> 110 0.910 2.032 0 U 2.022e+04 0.00e+00 - 0 54 41 0 >># HG2/HB I6 >> 111 0.910 1.619 0 U 5.622e+03 0.00e+00 - 0 54 55 0 >># HG2/HG12 I6 >> 112 0.910 0.879 0 U -2.047e+05 0.00e+00 - 0 54 69 0 >># HG2/HD1 I6 >> 113 1.669 7.689 0 U 1.729e+03 0.00e+00 - 0 49 17 0 >># HG/H K11 >> 114 1.669 1.669 0 U 2.991e+08 0.00e+00 - 0 49 49 0 >># HG/HG K11 >> 115 1.669 2.976 0 U -9.138e+02 0.00e+00 - 0 49 51 0 >># HG/HE K11 >> 116 1.669 1.867 0 U 1.583e+04 0.00e+00 - 0 49 48 0 >># HG/HB K11 >> 117 1.669 1.409 0 U 9.740e+03 0.00e+00 - 0 49 132 0 >># HG/HD3 K11 >> 118 1.669 4.149 0 U 3.100e+03 0.00e+00 - 0 49 18 0 >># HG/HA K11 >> 119 1.669 1.365 0 U 7.575e+03 0.00e+00 - 0 49 50 0 >># HG/HD2 K11 >> 120 1.669 7.584 0 U 1.475e+02 0.00e+00 - 0 49 133 0 >># HG/HZ K11 >> 121 2.039 2.035 0 U -3.721e+07 0.00e+00 - 0 38 110 0 >># HB3/HE M4 >> 122 2.039 2.710 0 U -1.034e+04 0.00e+00 - 0 38 40 0 >># HB3/HG3 M4 >> 123 2.039 2.039 0 U 1.902e+07 0.00e+00 - 0 38 38 0 >># HB3/HB3 M4 >> 124 2.039 2.617 0 U -2.720e+03 0.00e+00 - 0 38 39 0 >># HB3/HG2 M4 >> 125 2.039 2.072 0 U -2.879e+05 0.00e+00 - 0 38 37 0 >># HB3/HB2 M4 >> 126 2.039 4.293 0 U -2.197e+03 0.00e+00 - 0 38 2 0 >># HB3/HA M4 >> 127 2.039 7.781 0 U 3.586e+03 0.00e+00 - 0 38 11 0 >># HB3 M4/H R5 >> 128 2.039 8.593 0 U 1.156e+02 0.00e+00 - 0 38 1 0 >># HB3/H M4 >> 129 1.571 3.903 0 U 3.227e+03 0.00e+00 - 0 59 8 0 >># HG12/HA I3 >> 130 1.571 1.571 0 U 1.091e+05 0.00e+00 - 0 59 59 0 >># HG12/HG12 I3 >> 131 1.571 7.260 0 U 7.317e+02 0.00e+00 - 0 59 135 0 >># HG12 I3/HD F1 >> 132 1.571 0.932 0 U 1.089e+05 0.00e+00 - 0 59 70 0 >># HG12/HD1 I3 >> 133 1.571 0.930 0 U -9.495e+04 0.00e+00 - 0 59 58 0 >># HG12/HG2 I3 >> 134 1.571 8.570 0 U 2.721e+03 0.00e+00 - 0 59 7 0 >># HG12/H I3 >> 135 1.571 1.277 0 U 2.863e+04 0.00e+00 - 0 59 60 0 >># HG12/HG13 I3 >> 136 1.571 1.894 0 U 6.435e+03 0.00e+00 - 0 59 57 0 >># HG12/HB I3 >> 137 1.598 3.206 0 U 6.713e+03 0.00e+00 - 0 26 24 0 >># HG3/HD R2 >> 138 1.598 1.598 0 U 1.173e+05 0.00e+00 - 0 26 26 0 >># HG3/HG3 R2 >> 139 1.598 7.381 0 U 1.101e+03 0.00e+00 - 0 26 128 0 >># HG3/HE R2 >> 140 1.598 1.748 0 U 1.599e+04 0.00e+00 - 0 26 23 0 >># HG3/HB2 R2 >> 141 1.598 8.695 0 U 6.837e+02 0.00e+00 - 0 26 3 0 >># HG3/H R2 >> 142 1.598 8.570 0 U 1.556e+03 0.00e+00 - 0 26 7 0 >># HG3 R2/H I3 >> 143 1.598 1.689 0 U 4.297e+04 0.00e+00 - 0 26 25 0 >># HG3/HG2 R2 >> 144 1.598 1.863 0 U 1.349e+04 0.00e+00 - 0 26 88 0 >># HG3/HB3 R2 >> 145 1.598 4.546 0 U 5.552e+03 0.00e+00 - 0 26 4 0 >># HG3/HA R2 >> 146 7.374 7.689 0 U 9.112e+03 0.00e+00 - 0 9 17 0 >># H L10/H K11 >> 147 7.374 1.063 0 U 4.585e+03 0.00e+00 - 0 9 74 0 >># H L10/HG2 V9 >> 148 7.374 0.910 0 U 1.757e+03 0.00e+00 - 0 9 54 0 >># H L10/HG2 I6 >> 149 7.374 7.374 0 U 1.937e+05 0.00e+00 - 0 9 9 0 >># H/H L10 >> 150 7.374 0.823 0 U 5.344e+03 0.00e+00 - 0 9 101 0 >># H/HD2 L10 >> 151 7.374 4.131 0 U 2.217e+03 0.00e+00 - 0 9 14 0 >># H L10/HA R8 >> 152 7.374 3.973 0 U 2.832e+03 0.00e+00 - 0 9 6 0 >># H L10/HA L7 >> 153 7.374 4.034 0 U 6.103e+03 0.00e+00 - 0 9 20 0 >># H L10/HA V9 >> 154 7.374 7.892 0 U 1.056e+03 0.00e+00 - 0 9 21 0 >># H L10/H L12 >> 155 7.374 1.550 0 U 8.107e+03 0.00e+00 - 0 9 61 0 >># H/HB3 L10 >> 156 7.374 0.986 0 U 4.163e+03 0.00e+00 - 0 9 53 0 >># H L10/HG1 V9 >> 157 7.374 4.202 0 U 1.015e+04 0.00e+00 - 0 9 10 0 >># H/HA L10 >> 158 7.374 7.535 0 U 1.435e+04 0.00e+00 - 0 9 19 0 >># H L10/H V9 >> 159 7.374 2.295 0 U 4.843e+03 0.00e+00 - 0 9 52 0 >># H L10/HB V9 >> 160 7.374 1.750 0 U 1.733e+04 0.00e+00 - 0 9 138 0 >># H/HB2 L10 >> 161 7.374 0.858 0 U 5.332e+03 0.00e+00 - 0 9 102 0 >># H/HD1 L10 >> 162 7.374 1.819 0 U 1.384e+04 0.00e+00 - 0 9 96 0 >># H/HG L10 >> 163 7.381 3.206 0 U 3.659e+03 0.00e+00 - 0 128 24 0 >># HE/HD R2 >> 164 7.381 1.598 0 U 2.185e+03 0.00e+00 - 0 128 26 0 >># HE/HG3 R2 >> 165 7.381 7.381 0 U -4.202e+04 0.00e+00 - 0 128 128 0 >># HE/HE R2 >> 166 7.381 1.748 0 U -2.587e+03 0.00e+00 - 0 128 23 0 >># HE/HB2 R2 >> 167 7.381 8.695 0 U 1.077e+02 0.00e+00 - 0 128 3 0 >># HE/H R2 >> 168 7.381 1.689 0 U 2.563e+03 0.00e+00 - 0 128 25 0 >># HE/HG2 R2 >> 169 7.381 1.863 0 U 3.443e+03 0.00e+00 - 0 128 88 0 >># HE/HB3 R2 >> 170 7.381 4.546 0 U 6.108e+02 0.00e+00 - 0 128 4 0 >># HE/HA R2 >> 171 0.823 7.374 0 U 5.903e+03 0.00e+00 - 0 101 9 0 >># HD2/H L10 >> 172 0.823 0.823 0 U 1.956e+06 0.00e+00 - 0 101 101 0 >># HD2/HD2 L10 >> 173 0.823 1.550 0 U 2.455e+04 0.00e+00 - 0 101 61 0 >># HD2/HB3 L10 >> 174 0.823 4.202 0 U 3.498e+04 0.00e+00 - 0 101 10 0 >># HD2/HA L10 >> 175 0.823 1.750 0 U 1.008e+04 0.00e+00 - 0 101 138 0 >># HD2/HB2 L10 >> 176 0.823 0.858 0 U -1.802e+05 0.00e+00 - 0 101 102 0 >># HD2/HD1 L10 >> 177 0.823 1.819 0 U 2.944e+04 0.00e+00 - 0 101 96 0 >># HD2/HG L10 >> 178 1.861 1.861 0 U 4.847e+06 0.00e+00 - 0 45 45 0 >># HB2/HB2 L7 >> 179 1.861 1.828 0 U -1.770e+04 0.00e+00 - 0 45 95 0 >># HB2/HG L7 >> 180 1.861 3.973 0 U 6.331e+03 0.00e+00 - 0 45 6 0 >># HB2/HA L7 >> 181 1.861 7.716 0 U 1.216e+04 0.00e+00 - 0 45 5 0 >># HB2/H L7 >> 182 1.861 1.541 0 U 3.176e+04 0.00e+00 - 0 45 137 0 >># HB2/HB3 L7 >> 183 1.861 4.293 0 U 6.541e+03 0.00e+00 - 0 45 2 0 >># HB2 L7/HA M4 >> 184 1.861 0.830 0 U 9.376e+03 0.00e+00 - 0 45 47 0 >># HB2/HD2 L7 >> 185 1.861 0.928 0 U 1.906e+04 0.00e+00 - 0 45 46 0 >># HB2/HD1 L7 >> 186 7.260 3.903 0 U 6.200e+03 0.00e+00 - 0 135 8 0 >># HD F1/HA I3 >> 187 7.260 1.571 0 U 2.441e+03 0.00e+00 - 0 135 59 0 >># HD F1/HG12 I3 >> 188 7.260 7.260 0 U 1.606e+06 0.00e+00 - 0 135 135 0 >># HD/HD F1 >> 189 7.260 7.168 0 U 9.080e+04 0.00e+00 - 0 135 136 0 >># HD/HE F1 >> 190 7.260 1.272 0 U 3.463e+03 0.00e+00 - 0 135 56 0 >># HD F1/HG13 I6 >> 191 7.260 0.932 0 U 1.154e+04 0.00e+00 - 0 135 70 0 >># HD F1/HD1 I3 >> 192 7.260 4.296 0 U 8.445e+03 0.00e+00 - 0 135 123 0 >># HD/HA F1 >> 193 7.260 3.220 0 U 1.782e+04 0.00e+00 - 0 135 126 0 >># HD/HB F1 >> 194 7.260 0.879 0 U 4.421e+03 0.00e+00 - 0 135 69 0 >># HD F1/HD1 I6 >> 195 7.260 1.894 0 U 4.576e+03 0.00e+00 - 0 135 57 0 >># HD F1/HB I3 >> 196 1.624 4.031 0 U 5.078e+03 0.00e+00 - 0 31 12 0 >># HG3/HA R5 >> 197 1.624 1.624 0 U -4.983e+04 0.00e+00 - 0 31 31 0 >># HG3/HG3 R5 >> 198 1.624 7.475 0 U 1.757e+03 0.00e+00 - 0 31 129 0 >># HG3/HE R5 >> 199 1.624 1.878 0 U 1.726e+04 0.00e+00 - 0 31 28 0 >># HG3/HB R5 >> 200 1.624 1.670 0 U 1.773e+05 0.00e+00 - 0 31 30 0 >># HG3/HG2 R5 >> 201 1.624 7.781 0 U 3.486e+03 0.00e+00 - 0 31 11 0 >># HG3/H R5 >> 202 1.624 3.109 0 U 4.759e+03 0.00e+00 - 0 31 27 0 >># HG3/HD2 R5 >> 203 1.624 3.193 0 U 6.946e+03 0.00e+00 - 0 31 130 0 >># HG3/HD3 R5 >> 204 4.131 1.907 0 U 2.498e+03 0.00e+00 - 0 14 33 0 >># HA/HB R8 >> 205 4.131 7.374 0 U 2.877e+02 0.00e+00 - 0 14 9 0 >># HA R8/H L10 >> 206 4.131 4.131 0 U 2.655e+04 0.00e+00 - 0 14 14 0 >># HA/HA R8 >> 207 4.131 1.744 0 U 6.349e+02 0.00e+00 - 0 14 35 0 >># HA/HG2 R8 >> 208 4.131 7.723 0 U 1.383e+03 0.00e+00 - 0 14 13 0 >># HA/H R8 >> 209 4.131 7.535 0 U 5.098e+02 0.00e+00 - 0 14 19 0 >># HA R8/H V9 >> 210 4.131 1.688 0 U 8.266e+02 0.00e+00 - 0 14 36 0 >># HA/HG3 R8 >> 211 4.131 7.394 0 U -2.996e+00 0.00e+00 - 0 14 134 0 >># HA/HE R8 >> 212 4.131 3.164 0 U 3.965e+02 0.00e+00 - 0 14 32 0 >># HA/HD R8 >> 213 1.828 1.861 0 U 5.467e+04 0.00e+00 - 0 95 45 0 >># HG/HB2 L7 >> 214 1.828 1.828 0 U 1.097e+05 0.00e+00 - 0 95 95 0 >># HG/HG L7 >> 215 1.828 3.973 0 U 6.737e+03 0.00e+00 - 0 95 6 0 >># HG/HA L7 >> 216 1.828 7.716 0 U 1.221e+04 0.00e+00 - 0 95 5 0 >># HG/H L7 >> 217 1.828 1.541 0 U 1.616e+04 0.00e+00 - 0 95 137 0 >># HG/HB3 L7 >> 218 1.828 0.830 0 U 1.425e+04 0.00e+00 - 0 95 47 0 >># HG/HD2 L7 >> 219 1.828 0.928 0 U 2.254e+04 0.00e+00 - 0 95 46 0 >># HG/HD1 L7 >> 220 1.744 1.907 0 U 2.422e+04 0.00e+00 - 0 35 33 0 >># HG2/HB R8 >> 221 1.744 4.131 0 U 5.413e+03 0.00e+00 - 0 35 14 0 >># HG2/HA R8 >> 222 1.744 1.744 0 U 3.467e+05 0.00e+00 - 0 35 35 0 >># HG2/HG2 R8 >> 223 1.744 7.723 0 U 5.441e+03 0.00e+00 - 0 35 13 0 >># HG2/H R8 >> 224 1.744 7.535 0 U 2.140e+03 0.00e+00 - 0 35 19 0 >># HG2 R8/H V9 >> 225 1.744 1.688 0 U 1.198e+05 0.00e+00 - 0 35 36 0 >># HG2/HG3 R8 >> 226 1.744 7.394 0 U -2.267e+03 0.00e+00 - 0 35 134 0 >># HG2/HE R8 >> 227 1.744 3.164 0 U 1.145e+04 0.00e+00 - 0 35 32 0 >># HG2/HD R8 >> 228 1.748 3.206 0 U 3.456e+03 0.00e+00 - 0 23 24 0 >># HB2/HD R2 >> 229 1.748 4.031 0 U 2.431e+03 0.00e+00 - 0 23 12 0 >># HB2 R2/HA R5 >> 230 1.748 1.598 0 U 1.705e+04 0.00e+00 - 0 23 26 0 >># HB2/HG3 R2 >> 231 1.748 7.381 0 U 9.224e+03 0.00e+00 - 0 23 128 0 >># HB2/HE R2 >> 232 1.748 1.748 0 U -7.398e+05 0.00e+00 - 0 23 23 0 >># HB2/HB2 R2 >> 233 1.748 8.695 0 U 1.257e+03 0.00e+00 - 0 23 3 0 >># HB2/H R2 >> 234 1.748 8.570 0 U 1.698e+03 0.00e+00 - 0 23 7 0 >># HB2 R2/H I3 >> 235 1.748 1.689 0 U -4.459e+04 0.00e+00 - 0 23 25 0 >># HB2/HG2 R2 >> 236 1.748 1.863 0 U 4.013e+04 0.00e+00 - 0 23 88 0 >># HB2/HB3 R2 >> 237 1.748 4.546 0 U 5.563e+03 0.00e+00 - 0 23 4 0 >># HB2/HA R2 >> 238 7.525 3.903 0 U 2.282e+03 0.00e+00 - 0 15 8 0 >># H I6/HA I3 >> 239 7.525 3.873 0 U 1.089e+04 0.00e+00 - 0 15 16 0 >># H/HA I6 >> 240 7.525 4.031 0 U 3.823e+02 0.00e+00 - 0 15 12 0 >># H I6/HA R5 >> 241 7.525 0.910 0 U 7.764e+03 0.00e+00 - 0 15 54 0 >># H/HG2 I6 >> 242 7.525 7.525 0 U 5.860e+04 0.00e+00 - 0 15 15 0 >># H/H I6 >> 243 7.525 7.716 0 U 1.020e+04 0.00e+00 - 0 15 5 0 >># H I6/H L7 >> 244 7.525 1.272 0 U 5.619e+03 0.00e+00 - 0 15 56 0 >># H/HG13 I6 >> 245 7.525 4.293 0 U 1.957e+03 0.00e+00 - 0 15 2 0 >># H I6/HA M4 >> 246 7.525 2.032 0 U 1.826e+04 0.00e+00 - 0 15 41 0 >># H/HB I6 >> 247 7.525 1.619 0 U 9.181e+03 0.00e+00 - 0 15 55 0 >># H/HG12 I6 >> 248 7.525 0.879 0 U 2.574e+03 0.00e+00 - 0 15 69 0 >># H/HD1 I6 >> 249 7.525 7.781 0 U 1.075e+04 0.00e+00 - 0 15 11 0 >># H I6/H R5 >> 250 7.525 8.593 0 U 9.917e+02 0.00e+00 - 0 15 1 0 >># H I6/H M4 >> 251 3.973 7.374 0 U 5.793e+02 0.00e+00 - 0 6 9 0 >># HA L7/H L10 >> 252 3.973 1.861 0 U 1.235e+03 0.00e+00 - 0 6 45 0 >># HA/HB2 L7 >> 253 3.973 1.828 0 U 1.502e+03 0.00e+00 - 0 6 95 0 >># HA/HG L7 >> 254 3.973 3.973 0 U 3.374e+04 0.00e+00 - 0 6 6 0 >># HA/HA L7 >> 255 3.973 7.716 0 U 9.855e+02 0.00e+00 - 0 6 5 0 >># HA/H L7 >> 256 3.973 1.541 0 U 2.830e+03 0.00e+00 - 0 6 137 0 >># HA/HB3 L7 >> 257 3.973 7.723 0 U 1.306e+03 0.00e+00 - 0 6 13 0 >># HA L7/H R8 >> 258 3.973 7.535 0 U 5.523e+02 0.00e+00 - 0 6 19 0 >># HA L7/H V9 >> 259 3.973 0.830 0 U 5.831e+03 0.00e+00 - 0 6 47 0 >># HA/HD2 L7 >> 260 3.973 1.750 0 U 7.770e+02 0.00e+00 - 0 6 138 0 >># HA L7/HB2 L10 >> 261 3.973 0.858 0 U 2.391e+02 0.00e+00 - 0 6 102 0 >># HA L7/HD1 L10 >> 262 3.973 0.928 0 U 1.248e+03 0.00e+00 - 0 6 46 0 >># HA/HD1 L7 >> 263 4.034 7.689 0 U 3.441e+02 0.00e+00 - 0 20 17 0 >># HA V9/H K11 >> 264 4.034 1.063 0 U 3.717e+03 0.00e+00 - 0 20 74 0 >># HA/HG2 V9 >> 265 4.034 7.374 0 U 1.192e+03 0.00e+00 - 0 20 9 0 >># HA V9/H L10 >> 266 4.034 4.034 0 U -3.954e+04 0.00e+00 - 0 20 20 0 >># HA/HA V9 >> 267 4.034 0.986 0 U 4.219e+03 0.00e+00 - 0 20 53 0 >># HA/HG1 V9 >> 268 4.034 7.535 0 U 2.980e+03 0.00e+00 - 0 20 19 0 >># HA/H V9 >> 269 4.034 2.295 0 U 4.007e+03 0.00e+00 - 0 20 52 0 >># HA/HB V9 >> 270 7.716 3.873 0 U 5.113e+03 0.00e+00 - 0 5 16 0 >># H L7/HA I6 >> 271 7.716 1.861 0 U 1.591e+04 0.00e+00 - 0 5 45 0 >># H/HB2 L7 >> 272 7.716 1.828 0 U 1.616e+04 0.00e+00 - 0 5 95 0 >># H/HG L7 >> 273 7.716 7.525 0 U 1.012e+04 0.00e+00 - 0 5 15 0 >># H L7/H I6 >> 274 7.716 3.973 0 U 1.278e+04 0.00e+00 - 0 5 6 0 >># H/HA L7 >> 275 7.716 7.716 0 U 4.445e+04 0.00e+00 - 0 5 5 0 >># H/H L7 >> 276 7.716 1.541 0 U 9.011e+03 0.00e+00 - 0 5 137 0 >># H/HB3 L7 >> 277 7.716 4.293 0 U 5.432e+03 0.00e+00 - 0 5 2 0 >># H L7/HA M4 >> 278 7.716 2.032 0 U 9.733e+03 0.00e+00 - 0 5 41 0 >># H L7/HB I6 >> 279 7.716 0.830 0 U 6.946e+03 0.00e+00 - 0 5 47 0 >># H/HD2 L7 >> 280 7.716 0.928 0 U 9.817e+03 0.00e+00 - 0 5 46 0 >># H/HD1 L7 >> 281 7.892 1.556 0 U 7.618e+03 0.00e+00 - 0 21 125 0 >># H/HB3 L12 >> 282 7.892 4.288 0 U 8.331e+03 0.00e+00 - 0 21 22 0 >># H/HA L12 >> 283 7.892 7.689 0 U 9.206e+03 0.00e+00 - 0 21 17 0 >># H L12/H K11 >> 284 7.892 7.374 0 U 1.254e+03 0.00e+00 - 0 21 9 0 >># H L12/H L10 >> 285 7.892 7.892 0 U 1.902e+05 0.00e+00 - 0 21 21 0 >># H/H L12 >> 286 7.892 1.634 0 U 1.303e+04 0.00e+00 - 0 21 42 0 >># H/HB2 L12 >> 287 7.892 1.867 0 U 4.897e+03 0.00e+00 - 0 21 48 0 >># H L12/HB K11 >> 288 7.892 0.854 0 U 4.027e+03 0.00e+00 - 0 21 44 0 >># H/HD2 L12 >> 289 7.892 1.671 0 U 1.080e+04 0.00e+00 - 0 21 94 0 >># H/HG L12 >> 290 7.892 4.149 0 U 1.934e+04 0.00e+00 - 0 21 18 0 >># H L12/HA K11 >> 291 7.892 0.896 0 U 3.506e+03 0.00e+00 - 0 21 43 0 >># H/HD1 L12 >> 292 7.168 7.260 0 U 8.103e+04 0.00e+00 - 0 136 135 0 >># HE/HD F1 >> 293 7.168 7.168 0 U 2.907e+05 0.00e+00 - 0 136 136 0 >># HE/HE F1 >> 294 7.168 0.932 0 U 2.418e+03 0.00e+00 - 0 136 70 0 >># HE F1/HD1 I3 >> 295 7.168 4.296 0 U 3.984e+02 0.00e+00 - 0 136 123 0 >># HE/HA F1 >> 296 7.168 3.220 0 U 8.205e+02 0.00e+00 - 0 136 126 0 >># HE/HB F1 >> 297 7.168 0.879 0 U 1.295e+03 0.00e+00 - 0 136 69 0 >># HE F1/HD1 I6 >> 298 1.634 1.556 0 U 6.324e+04 0.00e+00 - 0 42 125 0 >># HB2/HB3 L12 >> 299 1.634 4.288 0 U 7.937e+03 0.00e+00 - 0 42 22 0 >># HB2/HA L12 >> 300 1.634 7.892 0 U 1.008e+04 0.00e+00 - 0 42 21 0 >># HB2/H L12 >> 301 1.634 1.634 0 U 1.693e+05 0.00e+00 - 0 42 42 0 >># HB2/HB2 L12 >> 302 1.634 0.854 0 U 8.005e+03 0.00e+00 - 0 42 44 0 >># HB2/HD2 L12 >> 303 1.634 1.671 0 U -1.095e+05 0.00e+00 - 0 42 94 0 >># HB2/HG L12 >> 304 1.634 0.896 0 U 1.704e+04 0.00e+00 - 0 42 43 0 >># HB2/HD1 L12 >> 305 1.541 1.861 0 U 2.994e+04 0.00e+00 - 0 137 45 0 >># HB3/HB2 L7 >> 306 1.541 1.828 0 U 1.208e+04 0.00e+00 - 0 137 95 0 >># HB3/HG L7 >> 307 1.541 3.973 0 U 1.029e+04 0.00e+00 - 0 137 6 0 >># HB3/HA L7 >> 308 1.541 7.716 0 U 5.749e+03 0.00e+00 - 0 137 5 0 >># HB3/H L7 >> 309 1.541 1.541 0 U 2.684e+05 0.00e+00 - 0 137 137 0 >># HB3/HB3 L7 >> 310 1.541 0.830 0 U 9.124e+03 0.00e+00 - 0 137 47 0 >># HB3/HD2 L7 >> 311 1.541 0.928 0 U 1.824e+04 0.00e+00 - 0 137 46 0 >># HB3/HD1 L7 >> 312 7.475 4.031 0 U 1.378e+03 0.00e+00 - 0 129 12 0 >># HE/HA R5 >> 313 7.475 1.624 0 U 4.218e+03 0.00e+00 - 0 129 31 0 >># HE/HG3 R5 >> 314 7.475 7.475 0 U 1.385e+05 0.00e+00 - 0 129 129 0 >># HE/HE R5 >> 315 7.475 1.878 0 U 4.693e+03 0.00e+00 - 0 129 28 0 >># HE/HB R5 >> 316 7.475 1.670 0 U 3.512e+03 0.00e+00 - 0 129 30 0 >># HE/HG2 R5 >> 317 7.475 7.781 0 U 8.222e+02 0.00e+00 - 0 129 11 0 >># HE/H R5 >> 318 7.475 3.109 0 U 6.164e+03 0.00e+00 - 0 129 27 0 >># HE/HD2 R5 >> 319 7.475 3.193 0 U 6.924e+03 0.00e+00 - 0 129 130 0 >># HE/HD3 R5 >> 320 1.272 3.873 0 U 4.276e+03 0.00e+00 - 0 56 16 0 >># HG13/HA I6 >> 321 1.272 0.910 0 U 5.040e+03 0.00e+00 - 0 56 54 0 >># HG13/HG2 I6 >> 322 1.272 7.260 0 U 8.263e+02 0.00e+00 - 0 56 135 0 >># HG13 I6/HD F1 >> 323 1.272 7.525 0 U 3.109e+03 0.00e+00 - 0 56 15 0 >># HG13/H I6 >> 324 1.272 1.272 0 U 1.488e+05 0.00e+00 - 0 56 56 0 >># HG13/HG13 I6 >> 325 1.272 2.032 0 U 3.430e+03 0.00e+00 - 0 56 41 0 >># HG13/HB I6 >> 326 1.272 1.619 0 U 2.270e+04 0.00e+00 - 0 56 55 0 >># HG13/HG12 I6 >> 327 1.272 0.879 0 U 4.425e+03 0.00e+00 - 0 56 69 0 >># HG13/HD1 I6 >> 328 2.976 7.689 0 U 3.297e+02 0.00e+00 - 0 51 17 0 >># HE/H K11 >> 329 2.976 1.669 0 U -2.852e+03 0.00e+00 - 0 51 49 0 >># HE/HG K11 >> 330 2.976 2.976 0 U 5.944e+05 0.00e+00 - 0 51 51 0 >># HE/HE K11 >> 331 2.976 1.867 0 U 1.414e+03 0.00e+00 - 0 51 48 0 >># HE/HB K11 >> 332 2.976 1.409 0 U 1.818e+03 0.00e+00 - 0 51 132 0 >># HE/HD3 K11 >> 333 2.976 4.149 0 U 5.000e+02 0.00e+00 - 0 51 18 0 >># HE/HA K11 >> 334 2.976 1.365 0 U 1.769e+03 0.00e+00 - 0 51 50 0 >># HE/HD2 K11 >> 335 2.976 7.584 0 U 1.072e+02 0.00e+00 - 0 51 133 0 >># HE/HZ K11 >> 336 2.617 2.035 0 U 1.711e+03 0.00e+00 - 0 39 110 0 >># HG2/HE M4 >> 337 2.617 2.710 0 U 6.218e+04 0.00e+00 - 0 39 40 0 >># HG2/HG3 M4 >> 338 2.617 2.039 0 U 4.018e+03 0.00e+00 - 0 39 38 0 >># HG2/HB3 M4 >> 339 2.617 2.617 0 U 9.985e+04 0.00e+00 - 0 39 39 0 >># HG2/HG2 M4 >> 340 2.617 2.072 0 U 6.147e+03 0.00e+00 - 0 39 37 0 >># HG2/HB2 M4 >> 341 2.617 0.930 0 U 3.092e+03 0.00e+00 - 0 39 58 0 >># HG2 M4/HG2 I3 >> 342 2.617 4.293 0 U 3.035e+03 0.00e+00 - 0 39 2 0 >># HG2/HA M4 >> 343 2.617 7.781 0 U 5.622e+02 0.00e+00 - 0 39 11 0 >># HG2 M4/H R5 >> 344 2.617 8.593 0 U 4.242e+03 0.00e+00 - 0 39 1 0 >># HG2/H M4 >> 345 8.695 3.206 0 U 9.562e+02 0.00e+00 - 0 3 24 0 >># H/HD R2 >> 346 8.695 1.598 0 U 1.536e+03 0.00e+00 - 0 3 26 0 >># H/HG3 R2 >> 347 8.695 7.381 0 U 7.609e+01 0.00e+00 - 0 3 128 0 >># H/HE R2 >> 348 8.695 1.748 0 U 3.493e+03 0.00e+00 - 0 3 23 0 >># H/HB2 R2 >> 349 8.695 8.695 0 U 1.212e+04 0.00e+00 - 0 3 3 0 >># H/H R2 >> 350 8.695 8.570 0 U 2.154e+03 0.00e+00 - 0 3 7 0 >># H R2/H I3 >> 351 8.695 1.689 0 U 2.278e+03 0.00e+00 - 0 3 25 0 >># H/HG2 R2 >> 352 8.695 1.863 0 U 2.343e+03 0.00e+00 - 0 3 88 0 >># H/HB3 R2 >> 353 8.695 4.296 0 U 7.203e+03 0.00e+00 - 0 3 123 0 >># H R2/HA F1 >> 354 8.695 4.546 0 U 2.773e+03 0.00e+00 - 0 3 4 0 >># H/HA R2 >> 355 8.695 3.220 0 U 1.588e+03 0.00e+00 - 0 3 126 0 >># H R2/HB F1 >> 356 1.550 7.689 0 U 2.061e+03 0.00e+00 - 0 61 17 0 >># HB3 L10/H K11 >> 357 1.550 7.374 0 U 5.497e+03 0.00e+00 - 0 61 9 0 >># HB3/H L10 >> 358 1.550 0.823 0 U 1.044e+04 0.00e+00 - 0 61 101 0 >># HB3/HD2 L10 >> 359 1.550 1.550 0 U -2.102e+05 0.00e+00 - 0 61 61 0 >># HB3/HB3 L10 >> 360 1.550 4.202 0 U 9.752e+03 0.00e+00 - 0 61 10 0 >># HB3/HA L10 >> 361 1.550 1.750 0 U 3.539e+04 0.00e+00 - 0 61 138 0 >># HB3/HB2 L10 >> 362 1.550 0.858 0 U 1.645e+04 0.00e+00 - 0 61 102 0 >># HB3/HD1 L10 >> 363 1.550 1.819 0 U 8.827e+03 0.00e+00 - 0 61 96 0 >># HB3/HG L10 >> 364 0.986 1.063 0 U 3.793e+04 0.00e+00 - 0 53 74 0 >># HG1/HG2 V9 >> 365 0.986 7.374 0 U 2.715e+03 0.00e+00 - 0 53 9 0 >># HG1 V9/H L10 >> 366 0.986 4.034 0 U 1.660e+04 0.00e+00 - 0 53 20 0 >># HG1/HA V9 >> 367 0.986 0.986 0 U 1.190e+06 0.00e+00 - 0 53 53 0 >># HG1/HG1 V9 >> 368 0.986 7.535 0 U 6.301e+03 0.00e+00 - 0 53 19 0 >># HG1/H V9 >> 369 0.986 2.295 0 U 1.689e+04 0.00e+00 - 0 53 52 0 >># HG1/HB V9 >> 370 1.867 7.689 0 U 7.183e+03 0.00e+00 - 0 48 17 0 >># HB/H K11 >> 371 1.867 1.669 0 U 1.099e+04 0.00e+00 - 0 48 49 0 >># HB/HG K11 >> 372 1.867 7.892 0 U 3.143e+03 0.00e+00 - 0 48 21 0 >># HB K11/H L12 >> 373 1.867 2.976 0 U 1.460e+03 0.00e+00 - 0 48 51 0 >># HB/HE K11 >> 374 1.867 1.867 0 U 2.946e+06 0.00e+00 - 0 48 48 0 >># HB/HB K11 >> 375 1.867 1.409 0 U 3.094e+03 0.00e+00 - 0 48 132 0 >># HB/HD3 K11 >> 376 1.867 4.149 0 U 1.827e+04 0.00e+00 - 0 48 18 0 >># HB/HA K11 >> 377 1.867 1.365 0 U 3.018e+03 0.00e+00 - 0 48 50 0 >># HB/HD2 K11 >> 378 1.867 7.584 0 U 3.602e+02 0.00e+00 - 0 48 133 0 >># HB/HZ K11 >> 379 0.932 3.903 0 U 3.522e+04 0.00e+00 - 0 70 8 0 >># HD1/HA I3 >> 380 0.932 2.710 0 U 2.345e+03 0.00e+00 - 0 70 40 0 >># HD1 I3/HG3 M4 >> 381 0.932 1.571 0 U 4.936e+04 0.00e+00 - 0 70 59 0 >># HD1/HG12 I3 >> 382 0.932 7.260 0 U 5.206e+03 0.00e+00 - 0 70 135 0 >># HD1 I3/HD F1 >> 383 0.932 7.168 0 U 1.174e+03 0.00e+00 - 0 70 136 0 >># HD1 I3/HE F1 >> 384 0.932 0.932 0 U -4.895e+07 0.00e+00 - 0 70 70 0 >># HD1/HD1 I3 >> 385 0.932 0.930 0 U 2.016e+08 0.00e+00 - 0 70 58 0 >># HD1/HG2 I3 >> 386 0.932 8.570 0 U 1.573e+04 0.00e+00 - 0 70 7 0 >># HD1/H I3 >> 387 0.932 1.277 0 U 5.593e+04 0.00e+00 - 0 70 60 0 >># HD1/HG13 I3 >> 388 0.932 1.894 0 U 8.164e+04 0.00e+00 - 0 70 57 0 >># HD1/HB I3 >> 389 0.932 8.593 0 U 1.207e+04 0.00e+00 - 0 70 1 0 >># HD1 I3/H M4 >> 390 2.072 2.035 0 U 2.998e+05 0.00e+00 - 0 37 110 0 >># HB2/HE M4 >> 391 2.072 2.710 0 U 7.005e+03 0.00e+00 - 0 37 40 0 >># HB2/HG3 M4 >> 392 2.072 2.039 0 U -1.131e+05 0.00e+00 - 0 37 38 0 >># HB2/HB3 M4 >> 393 2.072 2.617 0 U 5.596e+03 0.00e+00 - 0 37 39 0 >># HB2/HG2 M4 >> 394 2.072 2.072 0 U 7.449e+04 0.00e+00 - 0 37 37 0 >># HB2/HB2 M4 >> 395 2.072 4.293 0 U 1.034e+04 0.00e+00 - 0 37 2 0 >># HB2/HA M4 >> 396 2.072 7.781 0 U 2.515e+03 0.00e+00 - 0 37 11 0 >># HB2 M4/H R5 >> 397 2.072 8.593 0 U 7.833e+03 0.00e+00 - 0 37 1 0 >># HB2/H M4 >> 398 0.930 3.903 0 U -1.209e+04 0.00e+00 - 0 58 8 0 >># HG2/HA I3 >> 399 0.930 1.571 0 U -3.112e+04 0.00e+00 - 0 58 59 0 >># HG2/HG12 I3 >> 400 0.930 2.617 0 U 4.355e+03 0.00e+00 - 0 58 39 0 >># HG2 I3/HG2 M4 >> 401 0.930 0.932 0 U 2.100e+08 0.00e+00 - 0 58 70 0 >># HG2/HD1 I3 >> 402 0.930 0.930 0 U -5.092e+08 0.00e+00 - 0 58 58 0 >># HG2/HG2 I3 >> 403 0.930 8.570 0 U -5.707e+03 0.00e+00 - 0 58 7 0 >># HG2/H I3 >> 404 0.930 1.277 0 U -3.101e+04 0.00e+00 - 0 58 60 0 >># HG2/HG13 I3 >> 405 0.930 3.220 0 U 1.670e+03 0.00e+00 - 0 58 126 0 >># HG2 I3/HB F1 >> 406 0.930 1.894 0 U -4.362e+04 0.00e+00 - 0 58 57 0 >># HG2/HB I3 >> 407 0.930 7.781 0 U 2.524e+03 0.00e+00 - 0 58 11 0 >># HG2 I3/H R5 >> 408 0.930 8.593 0 U -1.417e+03 0.00e+00 - 0 58 1 0 >># HG2 I3/H M4 >> 409 8.570 3.903 0 U 9.667e+03 0.00e+00 - 0 7 8 0 >># H/HA I3 >> 410 8.570 1.571 0 U 4.943e+03 0.00e+00 - 0 7 59 0 >># H/HG12 I3 >> 411 8.570 1.598 0 U 1.027e+03 0.00e+00 - 0 7 26 0 >># H I3/HG3 R2 >> 412 8.570 1.748 0 U 1.901e+03 0.00e+00 - 0 7 23 0 >># H I3/HB2 R2 >> 413 8.570 8.695 0 U 1.417e+03 0.00e+00 - 0 7 3 0 >># H I3/H R2 >> 414 8.570 0.932 0 U 3.898e+04 0.00e+00 - 0 7 70 0 >># H/HD1 I3 >> 415 8.570 0.930 0 U -2.708e+04 0.00e+00 - 0 7 58 0 >># H/HG2 I3 >> 416 8.570 8.570 0 U 8.772e+04 0.00e+00 - 0 7 7 0 >># H/H I3 >> 417 8.570 1.689 0 U 1.195e+03 0.00e+00 - 0 7 25 0 >># H I3/HG2 R2 >> 418 8.570 1.863 0 U 2.890e+03 0.00e+00 - 0 7 88 0 >># H I3/HB3 R2 >> 419 8.570 4.546 0 U 2.239e+04 0.00e+00 - 0 7 4 0 >># H I3/HA R2 >> 420 8.570 1.277 0 U 4.180e+03 0.00e+00 - 0 7 60 0 >># H/HG13 I3 >> 421 8.570 1.894 0 U 1.510e+04 0.00e+00 - 0 7 57 0 >># H/HB I3 >> 422 1.689 3.206 0 U 6.036e+03 0.00e+00 - 0 25 24 0 >># HG2/HD R2 >> 423 1.689 1.598 0 U 2.448e+04 0.00e+00 - 0 25 26 0 >># HG2/HG3 R2 >> 424 1.689 7.381 0 U 8.245e+02 0.00e+00 - 0 25 128 0 >># HG2/HE R2 >> 425 1.689 1.748 0 U 8.362e+04 0.00e+00 - 0 25 23 0 >># HG2/HB2 R2 >> 426 1.689 8.695 0 U 7.721e+02 0.00e+00 - 0 25 3 0 >># HG2/H R2 >> 427 1.689 8.570 0 U 1.006e+03 0.00e+00 - 0 25 7 0 >># HG2 R2/H I3 >> 428 1.689 1.689 0 U 2.979e+07 0.00e+00 - 0 25 25 0 >># HG2/HG2 R2 >> 429 1.689 1.863 0 U 1.846e+04 0.00e+00 - 0 25 88 0 >># HG2/HB3 R2 >> 430 1.689 4.546 0 U 4.247e+03 0.00e+00 - 0 25 4 0 >># HG2/HA R2 >> 431 1.409 7.689 0 U 2.306e+03 0.00e+00 - 0 132 17 0 >># HD3/H K11 >> 432 1.409 1.669 0 U 1.030e+04 0.00e+00 - 0 132 49 0 >># HD3/HG K11 >> 433 1.409 2.976 0 U 1.866e+03 0.00e+00 - 0 132 51 0 >># HD3/HE K11 >> 434 1.409 1.867 0 U 4.806e+03 0.00e+00 - 0 132 48 0 >># HD3/HB K11 >> 435 1.409 1.409 0 U 1.123e+05 0.00e+00 - 0 132 132 0 >># HD3/HD3 K11 >> 436 1.409 4.149 0 U 3.235e+03 0.00e+00 - 0 132 18 0 >># HD3/HA K11 >> 437 1.409 1.365 0 U 6.370e+04 0.00e+00 - 0 132 50 0 >># HD3/HD2 K11 >> 438 1.409 7.584 0 U 3.965e+01 0.00e+00 - 0 132 133 0 >># HD3/HZ K11 >> 439 4.293 2.035 0 U 1.223e+02 0.00e+00 - 0 2 110 0 >># HA/HE M4 >> 440 4.293 2.710 0 U 1.071e+02 0.00e+00 - 0 2 40 0 >># HA/HG3 M4 >> 441 4.293 2.039 0 U 1.601e+02 0.00e+00 - 0 2 38 0 >># HA/HB3 M4 >> 442 4.293 1.861 0 U 3.052e+02 0.00e+00 - 0 2 45 0 >># HA M4/HB2 L7 >> 443 4.293 7.525 0 U 7.435e+01 0.00e+00 - 0 2 15 0 >># HA M4/H I6 >> 444 4.293 7.716 0 U 1.140e+02 0.00e+00 - 0 2 5 0 >># HA M4/H L7 >> 445 4.293 2.617 0 U 9.155e+01 0.00e+00 - 0 2 39 0 >># HA/HG2 M4 >> 446 4.293 2.072 0 U 3.963e+01 0.00e+00 - 0 2 37 0 >># HA/HB2 M4 >> 447 4.293 4.293 0 U -5.857e+04 0.00e+00 - 0 2 2 0 >># HA/HA M4 >> 448 4.293 7.781 0 U 1.237e+02 0.00e+00 - 0 2 11 0 >># HA M4/H R5 >> 449 4.293 8.593 0 U 1.881e+02 0.00e+00 - 0 2 1 0 >># HA/H M4 >> 450 4.293 0.928 0 U 3.102e+02 0.00e+00 - 0 2 46 0 >># HA M4/HD1 L7 >> 451 1.878 4.031 0 U 1.698e+04 0.00e+00 - 0 28 12 0 >># HB/HA R5 >> 452 1.878 1.624 0 U 1.755e+04 0.00e+00 - 0 28 31 0 >># HB/HG3 R5 >> 453 1.878 7.475 0 U 2.235e+03 0.00e+00 - 0 28 129 0 >># HB/HE R5 >> 454 1.878 1.878 0 U -9.559e+04 0.00e+00 - 0 28 28 0 >># HB/HB R5 >> 455 1.878 1.670 0 U 1.147e+04 0.00e+00 - 0 28 30 0 >># HB/HG2 R5 >> 456 1.878 7.781 0 U 1.380e+04 0.00e+00 - 0 28 11 0 >># HB/H R5 >> 457 1.878 3.109 0 U 4.913e+03 0.00e+00 - 0 28 27 0 >># HB/HD2 R5 >> 458 1.878 3.193 0 U 5.063e+03 0.00e+00 - 0 28 130 0 >># HB/HD3 R5 >> 459 1.863 3.206 0 U 4.305e+03 0.00e+00 - 0 88 24 0 >># HB3/HD R2 >> 460 1.863 1.598 0 U 1.270e+04 0.00e+00 - 0 88 26 0 >># HB3/HG3 R2 >> 461 1.863 7.381 0 U 2.255e+03 0.00e+00 - 0 88 128 0 >># HB3/HE R2 >> 462 1.863 1.748 0 U 3.743e+04 0.00e+00 - 0 88 23 0 >># HB3/HB2 R2 >> 463 1.863 8.695 0 U 1.004e+03 0.00e+00 - 0 88 3 0 >># HB3/H R2 >> 464 1.863 8.570 0 U 5.181e+03 0.00e+00 - 0 88 7 0 >># HB3 R2/H I3 >> 465 1.863 1.689 0 U 2.362e+04 0.00e+00 - 0 88 25 0 >># HB3/HG2 R2 >> 466 1.863 1.863 0 U -6.964e+06 0.00e+00 - 0 88 88 0 >># HB3/HB3 R2 >> 467 1.863 4.546 0 U 7.700e+03 0.00e+00 - 0 88 4 0 >># HB3/HA R2 >> 468 0.854 1.556 0 U 1.088e+04 0.00e+00 - 0 44 125 0 >># HD2/HB3 L12 >> 469 0.854 4.288 0 U 2.651e+04 0.00e+00 - 0 44 22 0 >># HD2/HA L12 >> 470 0.854 7.892 0 U 4.247e+03 0.00e+00 - 0 44 21 0 >># HD2/H L12 >> 471 0.854 1.634 0 U 7.993e+03 0.00e+00 - 0 44 42 0 >># HD2/HB2 L12 >> 472 0.854 0.854 0 U 1.690e+06 0.00e+00 - 0 44 44 0 >># HD2/HD2 L12 >> 473 0.854 1.671 0 U 3.146e+04 0.00e+00 - 0 44 94 0 >># HD2/HG L12 >> 474 0.854 0.896 0 U 2.224e+04 0.00e+00 - 0 44 43 0 >># HD2/HD1 L12 >> 475 1.670 4.031 0 U 6.383e+03 0.00e+00 - 0 30 12 0 >># HG2/HA R5 >> 476 1.670 1.624 0 U 4.764e+05 0.00e+00 - 0 30 31 0 >># HG2/HG3 R5 >> 477 1.670 7.475 0 U 1.702e+03 0.00e+00 - 0 30 129 0 >># HG2/HE R5 >> 478 1.670 1.878 0 U 1.365e+04 0.00e+00 - 0 30 28 0 >># HG2/HB R5 >> 479 1.670 1.670 0 U -6.139e+08 0.00e+00 - 0 30 30 0 >># HG2/HG2 R5 >> 480 1.670 7.781 0 U 3.948e+03 0.00e+00 - 0 30 11 0 >># HG2/H R5 >> 481 1.670 3.109 0 U 4.419e+03 0.00e+00 - 0 30 27 0 >># HG2/HD2 R5 >> 482 1.670 3.193 0 U 7.648e+03 0.00e+00 - 0 30 130 0 >># HG2/HD3 R5 >> 483 4.296 7.260 0 U 3.501e+02 0.00e+00 - 0 123 135 0 >># HA/HD F1 >> 484 4.296 7.168 0 U 4.929e+01 0.00e+00 - 0 123 136 0 >># HA/HE F1 >> 485 4.296 8.695 0 U 1.928e+02 0.00e+00 - 0 123 3 0 >># HA F1/H R2 >> 486 4.296 4.296 0 U 4.197e+04 0.00e+00 - 0 123 123 0 >># HA/HA F1 >> 487 4.296 3.220 0 U 2.363e+03 0.00e+00 - 0 123 126 0 >># HA/HB F1 >> 488 7.723 1.907 0 U 2.683e+04 0.00e+00 - 0 13 33 0 >># H/HB R8 >> 489 7.723 4.031 0 U 5.353e+03 0.00e+00 - 0 13 12 0 >># H R8/HA R5 >> 490 7.723 4.131 0 U 1.442e+04 0.00e+00 - 0 13 14 0 >># H/HA R8 >> 491 7.723 1.744 0 U 6.991e+03 0.00e+00 - 0 13 35 0 >># H/HG2 R8 >> 492 7.723 3.973 0 U -7.492e+02 0.00e+00 - 0 13 6 0 >># H R8/HA L7 >> 493 7.723 7.723 0 U 1.693e+05 0.00e+00 - 0 13 13 0 >># H/H R8 >> 494 7.723 7.535 0 U 1.074e+04 0.00e+00 - 0 13 19 0 >># H R8/H V9 >> 495 7.723 1.688 0 U 5.476e+03 0.00e+00 - 0 13 36 0 >># H/HG3 R8 >> 496 7.723 7.394 0 U 1.615e+03 0.00e+00 - 0 13 134 0 >># H/HE R8 >> 497 7.723 3.164 0 U 2.269e+03 0.00e+00 - 0 13 32 0 >># H/HD R8 >> 498 4.546 3.206 0 U 1.389e+02 0.00e+00 - 0 4 24 0 >># HA/HD R2 >> 499 4.546 1.598 0 U -1.116e+01 0.00e+00 - 0 4 26 0 >># HA/HG3 R2 >> 500 4.546 7.381 0 U -2.702e+01 0.00e+00 - 0 4 128 0 >># HA/HE R2 >> 501 4.546 1.748 0 U -1.373e+01 0.00e+00 - 0 4 23 0 >># HA/HB2 R2 >> 502 4.546 8.695 0 U -3.081e+01 0.00e+00 - 0 4 3 0 >># HA/H R2 >> 503 4.546 8.570 0 U -3.722e+01 0.00e+00 - 0 4 7 0 >># HA R2/H I3 >> 504 4.546 1.689 0 U -5.217e+00 0.00e+00 - 0 4 25 0 >># HA/HG2 R2 >> 505 4.546 1.863 0 U 4.695e+01 0.00e+00 - 0 4 88 0 >># HA/HB3 R2 >> 506 4.546 4.546 0 U 1.520e+02 0.00e+00 - 0 4 4 0 >># HA/HA R2 >> 507 1.671 1.556 0 U 3.261e+04 0.00e+00 - 0 94 125 0 >># HG/HB3 L12 >> 508 1.671 4.288 0 U 4.989e+03 0.00e+00 - 0 94 22 0 >># HG/HA L12 >> 509 1.671 7.892 0 U 7.148e+03 0.00e+00 - 0 94 21 0 >># HG/H L12 >> 510 1.671 1.634 0 U -6.325e+05 0.00e+00 - 0 94 42 0 >># HG/HB2 L12 >> 511 1.671 0.854 0 U 1.835e+04 0.00e+00 - 0 94 44 0 >># HG/HD2 L12 >> 512 1.671 1.671 0 U 3.201e+08 0.00e+00 - 0 94 94 0 >># HG/HG L12 >> 513 1.671 0.896 0 U 2.008e+04 0.00e+00 - 0 94 43 0 >># HG/HD1 L12 >> 514 4.202 7.689 0 U 8.086e+02 0.00e+00 - 0 10 17 0 >># HA L10/H K11 >> 515 4.202 7.374 0 U 6.400e+02 0.00e+00 - 0 10 9 0 >># HA/H L10 >> 516 4.202 0.823 0 U 1.728e+03 0.00e+00 - 0 10 101 0 >># HA/HD2 L10 >> 517 4.202 1.550 0 U 1.151e+03 0.00e+00 - 0 10 61 0 >># HA/HB3 L10 >> 518 4.202 4.202 0 U 1.481e+04 0.00e+00 - 0 10 10 0 >># HA/HA L10 >> 519 4.202 1.750 0 U 9.982e+02 0.00e+00 - 0 10 138 0 >># HA/HB2 L10 >> 520 4.202 0.858 0 U 1.602e+02 0.00e+00 - 0 10 102 0 >># HA/HD1 L10 >> 521 4.202 1.819 0 U 3.983e+02 0.00e+00 - 0 10 96 0 >># HA/HG L10 >> 522 7.535 1.907 0 U 9.285e+03 0.00e+00 - 0 19 33 0 >># H V9/HB R8 >> 523 7.535 1.063 0 U 1.853e+04 0.00e+00 - 0 19 74 0 >># H/HG2 V9 >> 524 7.535 7.374 0 U 1.602e+04 0.00e+00 - 0 19 9 0 >># H V9/H L10 >> 525 7.535 4.131 0 U 4.997e+03 0.00e+00 - 0 19 14 0 >># H V9/HA R8 >> 526 7.535 1.744 0 U 2.552e+03 0.00e+00 - 0 19 35 0 >># H V9/HG2 R8 >> 527 7.535 3.973 0 U 2.418e+03 0.00e+00 - 0 19 6 0 >># H V9/HA L7 >> 528 7.535 4.034 0 U 1.478e+04 0.00e+00 - 0 19 20 0 >># H/HA V9 >> 529 7.535 0.986 0 U 9.221e+03 0.00e+00 - 0 19 53 0 >># H/HG1 V9 >> 530 7.535 7.723 0 U 1.018e+04 0.00e+00 - 0 19 13 0 >># H V9/H R8 >> 531 7.535 7.535 0 U 1.481e+05 0.00e+00 - 0 19 19 0 >># H/H V9 >> 532 7.535 2.295 0 U 1.301e+04 0.00e+00 - 0 19 52 0 >># H/HB V9 >> 533 7.535 0.830 0 U 1.873e+03 0.00e+00 - 0 19 47 0 >># H V9/HD2 L7 >> 534 7.535 1.688 0 U 2.089e+03 0.00e+00 - 0 19 36 0 >># H V9/HG3 R8 >> 535 4.149 7.689 0 U 2.087e+03 0.00e+00 - 0 18 17 0 >># HA/H K11 >> 536 4.149 1.669 0 U 3.229e+02 0.00e+00 - 0 18 49 0 >># HA/HG K11 >> 537 4.149 7.892 0 U 1.477e+03 0.00e+00 - 0 18 21 0 >># HA K11/H L12 >> 538 4.149 2.976 0 U 3.566e+01 0.00e+00 - 0 18 51 0 >># HA/HE K11 >> 539 4.149 1.867 0 U 2.434e+03 0.00e+00 - 0 18 48 0 >># HA/HB K11 >> 540 4.149 1.409 0 U 3.945e+02 0.00e+00 - 0 18 132 0 >># HA/HD3 K11 >> 541 4.149 4.149 0 U 1.664e+04 0.00e+00 - 0 18 18 0 >># HA/HA K11 >> 542 4.149 1.365 0 U 5.820e+02 0.00e+00 - 0 18 50 0 >># HA/HD2 K11 >> 543 4.149 7.584 0 U -2.790e+01 0.00e+00 - 0 18 133 0 >># HA/HZ K11 >> 544 2.032 3.873 0 U 8.191e+03 0.00e+00 - 0 41 16 0 >># HB/HA I6 >> 545 2.032 0.910 0 U 1.654e+04 0.00e+00 - 0 41 54 0 >># HB/HG2 I6 >> 546 2.032 7.525 0 U 1.314e+04 0.00e+00 - 0 41 15 0 >># HB/H I6 >> 547 2.032 7.716 0 U 8.117e+03 0.00e+00 - 0 41 5 0 >># HB I6/H L7 >> 548 2.032 1.272 0 U 4.748e+03 0.00e+00 - 0 41 56 0 >># HB/HG13 I6 >> 549 2.032 2.032 0 U -2.147e+07 0.00e+00 - 0 41 41 0 >># HB/HB I6 >> 550 2.032 1.619 0 U 8.815e+03 0.00e+00 - 0 41 55 0 >># HB/HG12 I6 >> 551 2.032 0.879 0 U 5.020e+03 0.00e+00 - 0 41 69 0 >># HB/HD1 I6 >> 552 1.619 3.873 0 U 4.141e+03 0.00e+00 - 0 55 16 0 >># HG12/HA I6 >> 553 1.619 0.910 0 U 6.649e+03 0.00e+00 - 0 55 54 0 >># HG12/HG2 I6 >> 554 1.619 7.525 0 U 5.793e+03 0.00e+00 - 0 55 15 0 >># HG12/H I6 >> 555 1.619 1.272 0 U 2.574e+04 0.00e+00 - 0 55 56 0 >># HG12/HG13 I6 >> 556 1.619 2.032 0 U 6.245e+03 0.00e+00 - 0 55 41 0 >># HG12/HB I6 >> 557 1.619 1.619 0 U 2.003e+05 0.00e+00 - 0 55 55 0 >># HG12/HG12 I6 >> 558 1.619 0.879 0 U 1.218e+04 0.00e+00 - 0 55 69 0 >># HG12/HD1 I6 >> 559 1.365 7.689 0 U 2.156e+03 0.00e+00 - 0 50 17 0 >># HD2/H K11 >> 560 1.365 1.669 0 U 8.074e+03 0.00e+00 - 0 50 49 0 >># HD2/HG K11 >> 561 1.365 2.976 0 U 1.822e+03 0.00e+00 - 0 50 51 0 >># HD2/HE K11 >> 562 1.365 1.867 0 U 3.905e+03 0.00e+00 - 0 50 48 0 >># HD2/HB K11 >> 563 1.365 1.409 0 U 6.705e+04 0.00e+00 - 0 50 132 0 >># HD2/HD3 K11 >> 564 1.365 4.149 0 U 3.909e+03 0.00e+00 - 0 50 18 0 >># HD2/HA K11 >> 565 1.365 1.365 0 U 1.082e+05 0.00e+00 - 0 50 50 0 >># HD2/HD2 K11 >> 566 1.365 7.584 0 U 9.474e+00 0.00e+00 - 0 50 133 0 >># HD2/HZ K11 >> 567 1.277 3.903 0 U 3.749e+03 0.00e+00 - 0 60 8 0 >># HG13/HA I3 >> 568 1.277 1.571 0 U 2.625e+04 0.00e+00 - 0 60 59 0 >># HG13/HG12 I3 >> 569 1.277 0.932 0 U 4.247e+04 0.00e+00 - 0 60 70 0 >># HG13/HD1 I3 >> 570 1.277 0.930 0 U -2.705e+04 0.00e+00 - 0 60 58 0 >># HG13/HG2 I3 >> 571 1.277 8.570 0 U 2.259e+03 0.00e+00 - 0 60 7 0 >># HG13/H I3 >> 572 1.277 1.277 0 U 6.271e+04 0.00e+00 - 0 60 60 0 >># HG13/HG13 I3 >> 573 1.277 1.894 0 U 4.172e+03 0.00e+00 - 0 60 57 0 >># HG13/HB I3 >> 574 2.295 3.873 0 U 2.698e+03 0.00e+00 - 0 52 16 0 >># HB V9/HA I6 >> 575 2.295 1.063 0 U 1.091e+04 0.00e+00 - 0 52 74 0 >># HB/HG2 V9 >> 576 2.295 7.374 0 U 3.301e+03 0.00e+00 - 0 52 9 0 >># HB V9/H L10 >> 577 2.295 4.034 0 U 1.153e+04 0.00e+00 - 0 52 20 0 >># HB/HA V9 >> 578 2.295 0.986 0 U 1.255e+04 0.00e+00 - 0 52 53 0 >># HB/HG1 V9 >> 579 2.295 7.535 0 U 8.185e+03 0.00e+00 - 0 52 19 0 >># HB/H V9 >> 580 2.295 2.295 0 U 1.308e+05 0.00e+00 - 0 52 52 0 >># HB/HB V9 >> 581 3.220 7.260 0 U 9.013e+03 0.00e+00 - 0 126 135 0 >># HB/HD F1 >> 582 3.220 7.168 0 U 2.631e+02 0.00e+00 - 0 126 136 0 >># HB/HE F1 >> 583 3.220 8.695 0 U 7.760e+02 0.00e+00 - 0 126 3 0 >># HB F1/H R2 >> 584 3.220 0.930 0 U 2.170e+03 0.00e+00 - 0 126 58 0 >># HB F1/HG2 I3 >> 585 3.220 4.296 0 U 7.690e+03 0.00e+00 - 0 126 123 0 >># HB/HA F1 >> 586 3.220 3.220 0 U 1.688e+05 0.00e+00 - 0 126 126 0 >># HB/HB F1 >> 587 0.830 1.861 0 U 1.171e+04 0.00e+00 - 0 47 45 0 >># HD2/HB2 L7 >> 588 0.830 1.828 0 U 2.075e+04 0.00e+00 - 0 47 95 0 >># HD2/HG L7 >> 589 0.830 3.973 0 U 2.790e+04 0.00e+00 - 0 47 6 0 >># HD2/HA L7 >> 590 0.830 7.716 0 U 6.814e+03 0.00e+00 - 0 47 5 0 >># HD2/H L7 >> 591 0.830 1.541 0 U 6.403e+03 0.00e+00 - 0 47 137 0 >># HD2/HB3 L7 >> 592 0.830 7.535 0 U 1.113e+03 0.00e+00 - 0 47 19 0 >># HD2 L7/H V9 >> 593 0.830 0.830 0 U 7.603e+05 0.00e+00 - 0 47 47 0 >># HD2/HD2 L7 >> 594 0.830 0.928 0 U 6.524e+04 0.00e+00 - 0 47 46 0 >># HD2/HD1 L7 >> 595 0.879 3.903 0 U 4.255e+03 0.00e+00 - 0 69 8 0 >># HD1 I6/HA I3 >> 596 0.879 3.873 0 U 5.317e+03 0.00e+00 - 0 69 16 0 >># HD1/HA I6 >> 597 0.879 0.910 0 U -3.163e+05 0.00e+00 - 0 69 54 0 >># HD1/HG2 I6 >> 598 0.879 7.260 0 U 1.823e+03 0.00e+00 - 0 69 135 0 >># HD1 I6/HD F1 >> 599 0.879 7.525 0 U 3.043e+03 0.00e+00 - 0 69 15 0 >># HD1/H I6 >> 600 0.879 7.168 0 U 7.101e+02 0.00e+00 - 0 69 136 0 >># HD1 I6/HE F1 >> 601 0.879 1.272 0 U 1.150e+04 0.00e+00 - 0 69 56 0 >># HD1/HG13 I6 >> 602 0.879 2.032 0 U 8.386e+03 0.00e+00 - 0 69 41 0 >># HD1/HB I6 >> 603 0.879 1.619 0 U 1.715e+04 0.00e+00 - 0 69 55 0 >># HD1/HG12 I6 >> 604 0.879 0.879 0 U 7.528e+05 0.00e+00 - 0 69 69 0 >># HD1/HD1 I6 >> 605 1.688 1.907 0 U 2.055e+04 0.00e+00 - 0 36 33 0 >># HG3/HB R8 >> 606 1.688 4.131 0 U 5.805e+03 0.00e+00 - 0 36 14 0 >># HG3/HA R8 >> 607 1.688 1.744 0 U -1.527e+04 0.00e+00 - 0 36 35 0 >># HG3/HG2 R8 >> 608 1.688 7.723 0 U 4.453e+03 0.00e+00 - 0 36 13 0 >># HG3/H R8 >> 609 1.688 7.535 0 U 1.828e+03 0.00e+00 - 0 36 19 0 >># HG3 R8/H V9 >> 610 1.688 1.688 0 U -3.230e+07 0.00e+00 - 0 36 36 0 >># HG3/HG3 R8 >> 611 1.688 7.394 0 U 1.633e+03 0.00e+00 - 0 36 134 0 >># HG3/HE R8 >> 612 1.688 3.164 0 U 1.363e+04 0.00e+00 - 0 36 32 0 >># HG3/HD R8 >> 613 1.750 7.374 0 U 2.966e+03 0.00e+00 - 0 138 9 0 >># HB2/H L10 >> 614 1.750 0.823 0 U 7.081e+03 0.00e+00 - 0 138 101 0 >># HB2/HD2 L10 >> 615 1.750 3.973 0 U 2.930e+03 0.00e+00 - 0 138 6 0 >># HB2 L10/HA L7 >> 616 1.750 1.550 0 U 3.972e+04 0.00e+00 - 0 138 61 0 >># HB2/HB3 L10 >> 617 1.750 4.202 0 U 7.558e+03 0.00e+00 - 0 138 10 0 >># HB2/HA L10 >> 618 1.750 1.750 0 U 6.027e+05 0.00e+00 - 0 138 138 0 >># HB2/HB2 L10 >> 619 1.750 0.858 0 U 1.495e+04 0.00e+00 - 0 138 102 0 >># HB2/HD1 L10 >> 620 1.750 1.819 0 U 1.856e+04 0.00e+00 - 0 138 96 0 >># HB2/HG L10 >> 621 1.894 3.903 0 U 1.143e+04 0.00e+00 - 0 57 8 0 >># HB/HA I3 >> 622 1.894 1.571 0 U 6.100e+03 0.00e+00 - 0 57 59 0 >># HB/HG12 I3 >> 623 1.894 7.260 0 U 1.598e+03 0.00e+00 - 0 57 135 0 >># HB I3/HD F1 >> 624 1.894 0.932 0 U 1.122e+05 0.00e+00 - 0 57 70 0 >># HB/HD1 I3 >> 625 1.894 0.930 0 U -8.636e+04 0.00e+00 - 0 57 58 0 >># HB/HG2 I3 >> 626 1.894 8.570 0 U 1.027e+04 0.00e+00 - 0 57 7 0 >># HB/H I3 >> 627 1.894 1.277 0 U 5.897e+03 0.00e+00 - 0 57 60 0 >># HB/HG13 I3 >> 628 1.894 1.894 0 U 2.482e+05 0.00e+00 - 0 57 57 0 >># HB/HB I3 >> 629 1.894 8.593 0 U 5.279e+03 0.00e+00 - 0 57 1 0 >># HB I3/H M4 >> 630 7.781 3.903 0 U 2.211e+03 0.00e+00 - 0 11 8 0 >># H R5/HA I3 >> 631 7.781 4.031 0 U 1.058e+04 0.00e+00 - 0 11 12 0 >># H/HA R5 >> 632 7.781 2.710 0 U 7.276e+02 0.00e+00 - 0 11 40 0 >># H R5/HG3 M4 >> 633 7.781 2.039 0 U 4.257e+03 0.00e+00 - 0 11 38 0 >># H R5/HB3 M4 >> 634 7.781 1.624 0 U 4.481e+03 0.00e+00 - 0 11 31 0 >># H/HG3 R5 >> 635 7.781 7.525 0 U 1.102e+04 0.00e+00 - 0 11 15 0 >># H R5/H I6 >> 636 7.781 7.475 0 U 7.522e+02 0.00e+00 - 0 11 129 0 >># H/HE R5 >> 637 7.781 2.617 0 U 7.836e+02 0.00e+00 - 0 11 39 0 >># H R5/HG2 M4 >> 638 7.781 2.072 0 U 2.957e+03 0.00e+00 - 0 11 37 0 >># H R5/HB2 M4 >> 639 7.781 0.930 0 U 2.453e+03 0.00e+00 - 0 11 58 0 >># H R5/HG2 I3 >> 640 7.781 4.293 0 U 4.924e+03 0.00e+00 - 0 11 2 0 >># H R5/HA M4 >> 641 7.781 1.878 0 U 1.908e+04 0.00e+00 - 0 11 28 0 >># H/HB R5 >> 642 7.781 1.670 0 U 4.383e+03 0.00e+00 - 0 11 30 0 >># H/HG2 R5 >> 643 7.781 7.781 0 U 1.113e+05 0.00e+00 - 0 11 11 0 >># H/H R5 >> 644 7.781 8.593 0 U 6.979e+03 0.00e+00 - 0 11 1 0 >># H R5/H M4 >> 645 7.781 3.109 0 U 8.204e+02 0.00e+00 - 0 11 27 0 >># H/HD2 R5 >> 646 7.781 3.193 0 U 1.094e+03 0.00e+00 - 0 11 130 0 >># H/HD3 R5 >> 647 8.593 3.903 0 U 6.144e+03 0.00e+00 - 0 1 8 0 >># H M4/HA I3 >> 648 8.593 2.035 0 U 7.001e+01 0.00e+00 - 0 1 110 0 >># H/HE M4 >> 649 8.593 2.710 0 U 3.081e+03 0.00e+00 - 0 1 40 0 >># H/HG3 M4 >> 650 8.593 2.039 0 U 7.816e+03 0.00e+00 - 0 1 38 0 >># H/HB3 M4 >> 651 8.593 7.525 0 U 9.508e+02 0.00e+00 - 0 1 15 0 >># H M4/H I6 >> 652 8.593 2.617 0 U 6.411e+03 0.00e+00 - 0 1 39 0 >># H/HG2 M4 >> 653 8.593 0.932 0 U 2.955e+04 0.00e+00 - 0 1 70 0 >># H M4/HD1 I3 >> 654 8.593 2.072 0 U 1.040e+04 0.00e+00 - 0 1 37 0 >># H/HB2 M4 >> 655 8.593 0.930 0 U -1.893e+04 0.00e+00 - 0 1 58 0 >># H M4/HG2 I3 >> 656 8.593 4.293 0 U 9.430e+03 0.00e+00 - 0 1 2 0 >># H/HA M4 >> 657 8.593 1.894 0 U 6.937e+03 0.00e+00 - 0 1 57 0 >># H M4/HB I3 >> 658 8.593 7.781 0 U 7.211e+03 0.00e+00 - 0 1 11 0 >># H M4/H R5 >> 659 8.593 8.593 0 U 9.865e+04 0.00e+00 - 0 1 1 0 >># H/H M4 >> 660 0.858 7.374 0 U 5.330e+03 0.00e+00 - 0 102 9 0 >># HD1/H L10 >> 661 0.858 0.823 0 U -2.481e+05 0.00e+00 - 0 102 101 0 >># HD1/HD2 L10 >> 662 0.858 3.973 0 U 6.216e+03 0.00e+00 - 0 102 6 0 >># HD1 L10/HA L7 >> 663 0.858 1.550 0 U 1.926e+04 0.00e+00 - 0 102 61 0 >># HD1/HB3 L10 >> 664 0.858 4.202 0 U 6.332e+03 0.00e+00 - 0 102 10 0 >># HD1/HA L10 >> 665 0.858 1.750 0 U 1.952e+04 0.00e+00 - 0 102 138 0 >># HD1/HB2 L10 >> 666 0.858 0.858 0 U 1.111e+06 0.00e+00 - 0 102 102 0 >># HD1/HD1 L10 >> 667 0.858 1.819 0 U 2.753e+04 0.00e+00 - 0 102 96 0 >># HD1/HG L10 >> 668 7.394 1.907 0 U 2.970e+03 0.00e+00 - 0 134 33 0 >># HE/HB R8 >> 669 7.394 4.131 0 U 8.822e+02 0.00e+00 - 0 134 14 0 >># HE/HA R8 >> 670 7.394 1.744 0 U 3.577e+03 0.00e+00 - 0 134 35 0 >># HE/HG2 R8 >> 671 7.394 7.723 0 U 8.386e+02 0.00e+00 - 0 134 13 0 >># HE/H R8 >> 672 7.394 1.688 0 U 2.616e+03 0.00e+00 - 0 134 36 0 >># HE/HG3 R8 >> 673 7.394 7.394 0 U 2.211e+05 0.00e+00 - 0 134 134 0 >># HE/HE R8 >> 674 7.394 3.164 0 U 1.271e+04 0.00e+00 - 0 134 32 0 >># HE/HD R8 >> 675 7.584 7.689 0 U 8.957e+02 0.00e+00 - 0 133 17 0 >># HZ/H K11 >> 676 7.584 1.669 0 U 4.037e+02 0.00e+00 - 0 133 49 0 >># HZ/HG K11 >> 677 7.584 2.976 0 U 7.720e+02 0.00e+00 - 0 133 51 0 >># HZ/HE K11 >> 678 7.584 1.867 0 U 4.249e+02 0.00e+00 - 0 133 48 0 >># HZ/HB K11 >> 679 7.584 1.409 0 U 1.200e+02 0.00e+00 - 0 133 132 0 >># HZ/HD3 K11 >> 680 7.584 4.149 0 U 1.940e+02 0.00e+00 - 0 133 18 0 >># HZ/HA K11 >> 681 7.584 1.365 0 U 1.189e+02 0.00e+00 - 0 133 50 0 >># HZ/HD2 K11 >> 682 7.584 7.584 0 U 8.989e+03 0.00e+00 - 0 133 133 0 >># HZ/HZ K11 >> 683 0.928 1.861 0 U 2.139e+04 0.00e+00 - 0 46 45 0 >># HD1/HB2 L7 >> 684 0.928 1.828 0 U 3.065e+04 0.00e+00 - 0 46 95 0 >># HD1/HG L7 >> 685 0.928 3.973 0 U 5.563e+03 0.00e+00 - 0 46 6 0 >># HD1/HA L7 >> 686 0.928 7.716 0 U 7.722e+03 0.00e+00 - 0 46 5 0 >># HD1/H L7 >> 687 0.928 1.541 0 U 2.070e+04 0.00e+00 - 0 46 137 0 >># HD1/HB3 L7 >> 688 0.928 4.293 0 U 1.347e+04 0.00e+00 - 0 46 2 0 >># HD1 L7/HA M4 >> 689 0.928 0.830 0 U 7.601e+04 0.00e+00 - 0 46 47 0 >># HD1/HD2 L7 >> 690 0.928 0.928 0 U 1.573e+08 0.00e+00 - 0 46 46 0 >># HD1/HD1 L7 >> 691 3.109 4.031 0 U 1.940e+03 0.00e+00 - 0 27 12 0 >># HD2/HA R5 >> 692 3.109 1.624 0 U 5.686e+03 0.00e+00 - 0 27 31 0 >># HD2/HG3 R5 >> 693 3.109 7.475 0 U 2.738e+03 0.00e+00 - 0 27 129 0 >># HD2/HE R5 >> 694 3.109 1.878 0 U 4.748e+03 0.00e+00 - 0 27 28 0 >># HD2/HB R5 >> 695 3.109 1.670 0 U 3.988e+03 0.00e+00 - 0 27 30 0 >># HD2/HG2 R5 >> 696 3.109 7.781 0 U 6.863e+02 0.00e+00 - 0 27 11 0 >># HD2/H R5 >> 697 3.109 3.109 0 U 1.155e+05 0.00e+00 - 0 27 27 0 >># HD2/HD2 R5 >> 698 3.109 3.193 0 U 4.234e+04 0.00e+00 - 0 27 130 0 >># HD2/HD3 R5 >> 699 3.193 4.031 0 U 2.880e+03 0.00e+00 - 0 130 12 0 >># HD3/HA R5 >> 700 3.193 1.624 0 U 6.415e+03 0.00e+00 - 0 130 31 0 >># HD3/HG3 R5 >> 701 3.193 7.475 0 U 2.953e+03 0.00e+00 - 0 130 129 0 >># HD3/HE R5 >> 702 3.193 1.878 0 U 5.707e+03 0.00e+00 - 0 130 28 0 >># HD3/HB R5 >> 703 3.193 1.670 0 U 7.504e+03 0.00e+00 - 0 130 30 0 >># HD3/HG2 R5 >> 704 3.193 7.781 0 U 8.272e+02 0.00e+00 - 0 130 11 0 >># HD3/H R5 >> 705 3.193 3.109 0 U 4.160e+04 0.00e+00 - 0 130 27 0 >># HD3/HD2 R5 >> 706 3.193 3.193 0 U 2.004e+05 0.00e+00 - 0 130 130 0 >># HD3/HD3 R5 >> 707 3.164 1.907 0 U 1.087e+04 0.00e+00 - 0 32 33 0 >># HD/HB R8 >> 708 3.164 4.131 0 U 4.499e+03 0.00e+00 - 0 32 14 0 >># HD/HA R8 >> 709 3.164 1.744 0 U 1.228e+04 0.00e+00 - 0 32 35 0 >># HD/HG2 R8 >> 710 3.164 7.723 0 U 1.857e+03 0.00e+00 - 0 32 13 0 >># HD/H R8 >> 711 3.164 1.688 0 U 1.578e+04 0.00e+00 - 0 32 36 0 >># HD/HG3 R8 >> 712 3.164 7.394 0 U 7.014e+03 0.00e+00 - 0 32 134 0 >># HD/HE R8 >> 713 3.164 3.164 0 U 5.997e+05 0.00e+00 - 0 32 32 0 >># HD/HD R8 >> 714 0.896 1.556 0 U 1.939e+04 0.00e+00 - 0 43 125 0 >># HD1/HB3 L12 >> 715 0.896 4.288 0 U 3.694e+03 0.00e+00 - 0 43 22 0 >># HD1/HA L12 >> 716 0.896 7.892 0 U 3.450e+03 0.00e+00 - 0 43 21 0 >># HD1/H L12 >> 717 0.896 1.634 0 U 1.506e+04 0.00e+00 - 0 43 42 0 >># HD1/HB2 L12 >> 718 0.896 0.854 0 U -1.009e+04 0.00e+00 - 0 43 44 0 >># HD1/HD2 L12 >> 719 0.896 1.671 0 U 2.939e+04 0.00e+00 - 0 43 94 0 >># HD1/HG L12 >> 720 0.896 0.896 0 U 2.428e+06 0.00e+00 - 0 43 43 0 >># HD1/HD1 L12 >> 721 1.819 7.689 0 U 9.416e+02 0.00e+00 - 0 96 17 0 >># HG L10/H K11 >> 722 1.819 7.374 0 U 9.134e+03 0.00e+00 - 0 96 9 0 >># HG/H L10 >> 723 1.819 0.823 0 U 1.720e+04 0.00e+00 - 0 96 101 0 >># HG/HD2 L10 >> 724 1.819 1.550 0 U 1.170e+04 0.00e+00 - 0 96 61 0 >># HG/HB3 L10 >> 725 1.819 4.202 0 U 4.608e+03 0.00e+00 - 0 96 10 0 >># HG/HA L10 >> 726 1.819 1.750 0 U 1.903e+04 0.00e+00 - 0 96 138 0 >># HG/HB2 L10 >> 727 1.819 0.858 0 U 1.582e+04 0.00e+00 - 0 96 102 0 >># HG/HD1 L10 >> 728 1.819 1.819 0 U 8.198e+04 0.00e+00 - 0 96 96 0 >># HG/HG L10 >>; >> >> loop_ >> _Spectral_dim.ID >> _Spectral_dim.Axis_code >> _Spectral_dim.Spectrometer_frequency >> _Spectral_dim.Atom_type >> _Spectral_dim.Atom_isotope_number >> _Spectral_dim.Spectral_region >> _Spectral_dim.Magnetization_linkage_ID >> _Spectral_dim.Under_sampling_type >> _Spectral_dim.Sweep_width >> _Spectral_dim.Sweep_width_units >> _Spectral_dim.Value_first_point >> _Spectral_dim.Absolute_peak_positions >> _Spectral_dim.Acquisition >> _Spectral_dim.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_reduced_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 . . H 1 H . . 8169.935 Hz . . . 4.7 . . 34401 1 >> 2 . . H 1 H . . 8169.935 Hz . . . 4.7 . . 34401 1 >> >> stop_ >> >>save_ >> ; save_