#
# inpute file for test34
#
# Test for the RotOrientAsym subroutine, using the generated information fron the photoionization from
# the carbon 1s orbital of CH4 that is from the 1a_1 orbital.
#
#
TestOut
Label 'CH4 core ionization'
LMax 20	    # maximum l
LMaxK 10
EMax 40.0	    # maximum E
IPot 290.84	    # IPot, ionization potential

Convert '$pt/test34.g09' 'gaussian'
GetCro '$pt/test34.dat'

FileName 'OrientAsymData' 'test34OrientAsymData.dat' 'REWIND'
FileName 'OrientAsymGeom' 'test34OrientAsymGeom.dat' 'REWIND'
FileName 'OrientAsymEig' 'test34OrientAsymEig.dat' 'REWIND'

JMax 4           # maximum J for final state rotational quantum number.
JPPMax 0          # maximum initial state rotational quantum number
RotOrientAsym 4.35 '$pt/test34.dat'

RotConstants   0.52891694E+01 0.52891694E+01  0.52891694E+01
JMax 4
JPPMax 2
RotOrientAsym 4.35 '$pt/test34.dat'

RmDataRecord 'JMax'
RmDataRecord 'RotConstants'
LMaxK 5
JPPMax 2
RotOrientAsym 4.35 '$pt/test34.dat'