FOCALINUS: Molecular Geometry Calculator FOCAL
| focal8-296 |

Department of Chemistry, The University Of Toledo, Toledo,

OH

description of the geometry of molecules in terms of internal coordinates:

bond and dihedral angles and bond lengths. In addition cartesian

coordinates of all the atoms, a variety of interatomic distances and angles

may be derived, including three types of dihedral angles. FOCALINUS

is a FOCAL derivative of the program LINUS, described in the Journal

of Chemical Physics, 47, 3410 (1968).