%mem=1gb
%nproc=10
%chk=temp.chk
#t b3lyp/6-31g* opt=(gdiis,loose)

Benzoate_3480

0 1
O -0.6935 -2.8267 0.4385
O -2.2748 -1.9226 -0.5191
C -1.1515 -1.8000 -0.0512
C -0.4624 -0.5903 -0.0637
C 0.9547 -0.5556 -0.0575
C -1.1472 0.6507 -0.0774
C 1.6593 0.6627 -0.0585
C -0.4491 1.8727 -0.0709
C 0.9559 1.8786 -0.0623
H 0.0869 -2.8275 0.8469
H 1.5049 -1.4192 -0.0608
H -2.1711 0.6880 -0.0793
H 2.6824 0.6650 -0.0567
H -0.9609 2.7590 -0.0692
H 1.4664 2.7653 -0.0587

--link1--
%mem=1gb
%nproc=10
%chk=temp.chk
#t pbe1pbe/3-21g** guess=read geom=checkpoint nmr

Benzoate_3480

0 1