single_line
Total energy
5
1.0e-07

single_line mulliken.out_scf
H       1
2
1.0e-02

single_line mulliken.out_scf
H       1
3
1.0e-02

single_line mulliken.out_scf
H       2
2
1.0e-02

single_line mulliken.out_scf
H       2
3
1.0e-02

single_line mulliken.out_scf
O       3
2
1.0e-02

single_line mulliken.out_scf
O       3
3
1.0e-02

single_line_abs
H      1        s
3
1.0e-01

single_line_abs
H      2        s
3
1.0e-01

single_line_abs
O      3        s
3
1.0e-01

single_line_abs
O      3        py
3
1.0e-01

single_line_abs
O      3        px
3
1.0e-01

single_line
termination of ReSpect
0
0.0e-00
