data_YB2
# 
_chem_comp.id                                    YB2 
_chem_comp.name                                  "YTTERBIUM (II) ION" 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAI 
_chem_comp.formula                               Yb 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    2 
_chem_comp.pdbx_initial_date                     2007-07-09 
_chem_comp.pdbx_modified_date                    2008-10-14 
_chem_comp.pdbx_ambiguous_flag                   ? 
_chem_comp.pdbx_release_status                   REL 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        173.040 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     YB2 
_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        ? 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
# 
_chem_comp_atom.comp_id                    YB2 
_chem_comp_atom.atom_id                    YB 
_chem_comp_atom.alt_atom_id                YB 
_chem_comp_atom.type_symbol                YB 
_chem_comp_atom.charge                     2 
_chem_comp_atom.pdbx_align                 0 
_chem_comp_atom.pdbx_aromatic_flag         N 
_chem_comp_atom.pdbx_leaving_atom_flag     N 
_chem_comp_atom.pdbx_stereo_config         N 
_chem_comp_atom.model_Cartn_x              13.354 
_chem_comp_atom.model_Cartn_y              13.861 
_chem_comp_atom.model_Cartn_z              1.925 
_chem_comp_atom.pdbx_model_Cartn_x_ideal   0.000 
_chem_comp_atom.pdbx_model_Cartn_y_ideal   0.000 
_chem_comp_atom.pdbx_model_Cartn_z_ideal   0.000 
_chem_comp_atom.pdbx_component_atom_id     YB 
_chem_comp_atom.pdbx_component_comp_id     YB2 
_chem_comp_atom.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 
YB2 SMILES           ACDLabs              10.04 [Yb+2]                    
YB2 InChI            InChI                1.02b InChI=1/Yb/q+2            
YB2 InChIKey         InChI                1.02b SVJLBBSKJLMTRQ-UHFFFAOYAY 
YB2 SMILES_CANONICAL CACTVS               3.341 [Yb++]                    
YB2 SMILES           CACTVS               3.341 [Yb++]                    
YB2 SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 [Yb+2]                    
YB2 SMILES           "OpenEye OEToolkits" 1.5.0 [Yb+2]                    
# 
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 
YB2 "SYSTEMATIC NAME" ACDLabs              10.04 ytterbium(2+)          
YB2 "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 "ytterbium(+2) cation" 
# 
