%chk=TF_bh3_freq.chk # freq b3lyp/6-31g(d,p) geom=connectivity BH3 frequency 0 1 B 0.00000000 0.00019900 0.00000000 H -0.44086500 -1.10862900 0.00000000 H -0.73909300 0.93541300 0.00000000 H 1.17995800 0.17221900 0.00000000 1 2 1.0 3 1.0 4 1.0 2 3 4