data_HGN
# 
_chem_comp.id                                    HGN 
_chem_comp.name                                  mercuriomercury 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               Hg2 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2017-12-14 
_chem_comp.pdbx_modified_date                    2018-02-02 
_chem_comp.pdbx_ambiguous_flag                   N 
_chem_comp.pdbx_release_status                   REL 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        401.180 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     HGN 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        6BRI 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.alt_atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.charge 
_chem_comp_atom.pdbx_align 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_leaving_atom_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.model_Cartn_x 
_chem_comp_atom.model_Cartn_y 
_chem_comp_atom.model_Cartn_z 
_chem_comp_atom.pdbx_model_Cartn_x_ideal 
_chem_comp_atom.pdbx_model_Cartn_y_ideal 
_chem_comp_atom.pdbx_model_Cartn_z_ideal 
_chem_comp_atom.pdbx_component_atom_id 
_chem_comp_atom.pdbx_component_comp_id 
_chem_comp_atom.pdbx_ordinal 
HGN HG1 HG1 HG 0 0 N N N -35.980 28.983 1.554 -1.320 0.000  0.000  HG1 HGN 1 
HGN HG2 HG2 HG 0 0 N N N -37.351 31.686 0.526 1.320  -0.000 -0.000 HG2 HGN 2 
# 
_chem_comp_bond.comp_id              HGN 
_chem_comp_bond.atom_id_1            HG2 
_chem_comp_bond.atom_id_2            HG1 
_chem_comp_bond.value_order          SING 
_chem_comp_bond.pdbx_aromatic_flag   N 
_chem_comp_bond.pdbx_stereo_config   N 
_chem_comp_bond.pdbx_ordinal         1 
# 
loop_
_pdbx_chem_comp_descriptor.comp_id 
_pdbx_chem_comp_descriptor.type 
_pdbx_chem_comp_descriptor.program 
_pdbx_chem_comp_descriptor.program_version 
_pdbx_chem_comp_descriptor.descriptor 
HGN InChI            InChI                1.03  InChI=1S/2Hg                
HGN InChIKey         InChI                1.03  KYKQHSMYWLWROM-UHFFFAOYSA-N 
HGN SMILES_CANONICAL CACTVS               3.385 "[Hg].[Hg]"                 
HGN SMILES           CACTVS               3.385 "[Hg].[Hg]"                 
HGN SMILES_CANONICAL "OpenEye OEToolkits" 2.0.6 "[Hg][Hg]"                  
HGN SMILES           "OpenEye OEToolkits" 2.0.6 "[Hg][Hg]"                  
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
HGN "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.6 mercuriomercury 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
HGN "Create component" 2017-12-14 RCSB 
HGN "Initial release"  2018-02-07 RCSB 
# 
