static void Main(string[] args)
{
string file = File.ReadAllText("1hho.cif"); // downloaded from http://www.rcsb.org/pdb/explore.do?structureId=1HHO (PDBx/mmCIF Format9
using (var reader = new ModelReader())
{
var entry = reader.ReadEntry(file);
foreach (var atomSite in entry.AtomSites)
{
Console.WriteLine(
atomSite.Symbol + " Position: " + atomSite.X + "/" + atomSite.Y + "/" + atomSite.Z
);
}
}
Console.ReadKey();
}
