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

single_line h2o+_X.out_scf h2o+_Y.out_scf h2o+_Z.out_scf
Total energy
5
1.0e-07

#  -----------------    analysis    --------------

single_line h2o+_X-CS-GIAO-X.out_cs h2o+_Y-CS-GIAO-Y.out_cs h2o+_Z-CS-GIAO-Z.out_cs
sum:
4
1.0e-3

single_line
termination of ReSpect
0
0.0e-00
