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

guanine_149248

0 1
C -0.2265 2.7017 0.3988
C -0.8788 0.6612 0.1633
C 0.5140 0.7190 0.0642
C -1.4745 -0.5890 0.0324
C 0.5975 -1.5588 -0.2713
N 1.2889 -2.6145 -0.4765
N -1.3121 1.9092 0.3733
N 1.2149 -0.4005 -0.1463
N 0.9035 1.9933 0.2114
N -0.6961 -1.6311 -0.1855
O -2.6834 -0.7329 0.1214
H -0.2522 3.7121 0.5420
H 2.2221 -2.5782 -0.4196
H 0.8697 -3.4247 -0.6822
H -2.2338 2.1907 0.4856
H 2.1469 -0.3575 -0.2113

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

guanine_149248

0 1