3NTE_I3M_A_234
  RCSB PDB12061709583D
Coordinates from PDB:3NTE:A:234 Model:1 without hydrogens
  3  2  0  0  0  0            999 V2000
  -37.3620   27.3260   15.6030   I 0  0  0  0  0  0  0  0  0  0  0  0
  -36.1250   25.1150   14.5540   I 0  5  0  0  0  0  0  0  0  0  0  0
  -34.6770   22.9690   13.5880   I 0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
M  CHG  1   2  -1
A    1
I01
A    2
I02
A    3
I03
M  END
>  <InstanceId>
3NTE_I3M_A_234

>  <ChemCompId>
I3M

>  <PdbId>
3NTE

>  <ChainId>
A

>  <ResidueNumber>
234

>  <InsertionCode>


>  <Model>
1

>  <AltIds>


>  <MissingHeavyAtoms>
0

>  <ObservedFormula>
I3

>  <Name>
Tri-iodode Anion

>  <SystematicName>
triiodide

>  <Synonyms>


>  <Type>
NON-POLYMER

>  <Formula>
I3

>  <MolecularWeight>
380.713

>  <ModifiedDate>
2011-06-04

>  <Parent>


>  <OneLetterCode>


>  <SubcomponentList>


>  <AmbiguousFlag>
N

>  <InChI>
InChI=1S/I3/c1-3-2/q-1

>  <InChIKey>
WRTMQOHKMFDUKX-UHFFFAOYSA-N

>  <SMILES>
I[I-]I

$$$$
