/usr/share/doc/avogadro/examples/methane.mp is in avogadro 1.2.0-3.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 | *** Jobname.Temp
!file,2,INSERT WAVEFUNCTION FILE LOCATION HERE
!memory,INSERT MEMORY HERE
basis,6-31g
gprint,basis
gprint,orbitals
geomtyp=xyz
geometry={
5
Geometry specification:
C, -0.00092, -0.00000, -0.00289
H, -0.62971, -0.93095, -0.19667
H, -0.62951, 0.93099, -0.19709
H, 0.92146, -0.00025, -0.67283
H, 0.34326, 0.00021, 1.08392
}
!INSERT QM METHODS HERE
hf
orbprint,12
frequencies
---
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