PC-Atoms
Defined in file pcsubstance.asn
C++ class: CPC_Atoms
PC-Atoms ::= SEQUENCE {
-- [Note: Parallel Arrays must be kept Synchronized]
aid SEQUENCE OF INTEGER, -- Atom Identifiers (vector)
-- Note: Atom ID's must be greater than "0"
element SEQUENCE OF PC-Element, -- Atomic Numbers (vector)
-- Independent Arrays of ID-Value Pairs (Technically allows multiple values per Atom)
label SEQUENCE OF PC-AtomString OPTIONAL, -- Atom labels
isotope SEQUENCE OF PC-AtomInt OPTIONAL, -- Isotopic Information
charge SEQUENCE OF PC-AtomInt OPTIONAL, -- Formal Charges
radical SEQUENCE OF PC-AtomRadical OPTIONAL, -- Radical Information
source SEQUENCE OF PC-AtomSource OPTIONAL, -- E.g. identity of MMDB "R" groups
comment SEQUENCE OF PC-AtomString OPTIONAL -- Atom Comments
}