Hauusian program for multi-components structure system generation. The number of atoms in hau2 version is up to 480. Hauusian have read the files with the extensions (p1, p2): 1. Only geometry: log out (from Gaussian, the last geometry) pdb ent mol2 and mol (Mercury, Chemsketch) gjf (from Gaussian, only in the xyz format) geo (Geom program) orn (manually chosen geometry from Gaussian log file) xyz Caution: the coordinate system is moved to (0,0,0) with exception of .orn files 2. geometry and frequencies: log out (the geometry chosen from Gaussian) fmt fmu fmv (Vead4) hau (Hauusian) Caution: here the coordinate system is not moved If the geometry and frequencies are formally correct – the file .hau is automatically generated – see exemplary files ______________________ Hauusian program create the default connection matrix (with exception of .pdb files) the connection matrix is written to .mpo file (text file) the connection matrix can be edited by user ____________________ Output files: .hau , .pdb, .gjf Gaussian input file .gjf can be generated Many .hau files can be easy connect in one system ____________________ The picture with the structure: Left mouse (up-down, left-right): turn the structure in YZ, ZX planes Left mouse + Shift: turn the structure in XY plane Right mouse (left-right): change of the size of the structure (up-down): change of the size of balls and sticks Right mouse + Shift: move the structure in XY plane Buttons: XY, YZ, ZX: set the structure position to given plane (+/-): slowly move the structure in given plane and also (+/-) with Shift, Alt, Ctrl very slow movement ___________________________ remuneration of the atoms (only in files log, hau): place the line: renum atoms and the two columns: old number new number .... _____________________________