single_line 4c.out_scf x2c.out_scf
Total energy
5
1.0e-10

single_line 4c.out_mossbauer x2c.out_mossbauer
Contact density at center of atom C
13
1.0e-04

single_line 4c.out_mossbauer x2c.out_mossbauer
Contact density at center of atom O
13
1.0e-04

single_line 4c.out_mossbauer x2c.out_mossbauer
Effective density at center of atom C
13
1.0e-04

single_line 4c.out_mossbauer x2c.out_mossbauer
Effective density at center of atom O
13
1.0e-04

single_line
termination of ReSpect
0
0.0e-00
