m-cresol,m-methylphenol C7H8O

XYZ [1KB]


Orbital data (ISO value 0.05)

Orbital 29 (HOMO)
PGV [1070KB]
WRL [1350KB]

Orbital 30 (LUMO)
PGV [1103KB]
WRL [1391KB]


Gaussian outputs

optimize [482KB]

frequency [99KB]

orbitals [29KB]


PGV Samples / Copyright(C) 1996-1997 CCIMS / mizutani@ims.ac.jp