%mem=1gb
%nproc=4
%chk=temp.chk
#t b3lyp/6-31g* opt=(gdiis,loose)

nicotine_4007

0 1
C -0.0679 -1.3826 -2.0763
C 2.3187 2.3412 -0.0041
C 1.5905 1.1357 0.0120
C 1.6133 3.5570 -0.0084
C -0.4639 2.3940 0.0148
C -1.3611 -2.0415 1.3337
C -0.9298 -0.5768 1.5018
C -0.5406 -2.5311 0.1250
C 0.1741 1.1309 0.0170
C -0.6424 -0.1190 0.0543
N 0.2581 3.5421 0.0017
N -0.0566 -1.3237 -0.5908
H 0.4182 -0.5030 -2.5019
H 0.4799 -2.2586 -2.4301
H -1.0887 -1.4344 -2.4637
H 3.3416 2.3402 -0.0110
H 2.1145 0.2570 0.0230
H 2.1062 4.4517 -0.0175
H -1.4822 2.4740 0.0271
H -2.4314 -2.0900 1.1093
H -1.1735 -2.6310 2.2352
H -1.7147 0.0205 1.9751
H -0.0345 -0.5298 2.1304
H 0.3346 -3.0919 0.4617
H -1.1516 -3.1990 -0.4913
H -1.6110 0.0682 -0.4271

--link1--
%mem=1gb
%nproc=4
%chk=temp.chk
#t pbe1pbe/3-21g** guess=read geom=checkpoint nmr

nicotine_4007

0 1