
#  ----------------------  SCF  ----------------------

single_line    h2o-10a.out_scf
Total energy
5
1.0e-06

#  ----------------------  NMR  ----------------------

single_line h2o-10a-CGO-CP.out_cs h2o-10a-GIAO-CP.out_cs h2o-10a-GIAO-UP.out_cs
SIGMA_11
1
1.0e-2

single_line h2o-10a-CGO-CP.out_cs h2o-10a-GIAO-CP.out_cs h2o-10a-GIAO-UP.out_cs
SIGMA_22
1
1.0e-2

single_line h2o-10a-CGO-CP.out_cs h2o-10a-GIAO-CP.out_cs h2o-10a-GIAO-UP.out_cs
SIGMA_33
1
1.0e-2

single_line
termination of ReSpect
0
0.0e-00
