
Examples included in this distributions are:

01.cp2zrcl2          : zirconocene
02.nhc               : N-heterocyclic carbene Se complex
03.nhc-Mesh-005      : N-heterocyclic carbene Se complex, mesh grid 0.05 instead of 0.10 default
04.nhc-C210          : N-heterocyclic carbene Se complex, carbene C atom fixed at 2.10 from sphere center
05.nhc-H-Yes         : N-heterocyclic carbene Se complex, H atoms included in the buried volume calculation
06.Mn-salen          : Mn-salen complex
07.Mn-salen-R450     : Mn-salen complex, sphere radius increased to 4.5 Angs
08.Mn-salen-R1500    : Mn-salen complex, sphere radius increased to 15.0 Angs
09.Pd-xantphos-Pos-Z : PdCl2-xantphos complex, Cl atoms oriented on the positive Z axis
10.Pd-xantphos-Neg-Z : PdCl2-xantphos complex, Cl atoms oriented on the negative Z axis
11.Ti-taddol-3frames : Ti-taddol complex, 3 xyz frames included in the input file
12.Metalloprot       : Metalloprotein, radius of the sphere set to 10.0 Angs

to run all the examples :   sh ./runall
