%mem=3000MB
%nprocshared=4
#p opt=maxstep=4 freq=noraman b3lyp/6-311+g(d) scrf=(smd,solvent=water) nosymm 
empiricaldispersion=gd3 int=superfinegrid

ch3och2ch3-nhcho_6311+Gd

-1 1
 C                 -1.48470300   -0.09482500    0.11763800
 H                 -1.01583200   -0.95618300   -0.35671800
 H                 -1.22091400    0.82681300   -0.40001400
 H                 -1.21947700   -0.03870700    1.17275600
 N                  2.20351700    0.22919200    0.21661700
 H                  2.73637900   -0.02881100   -0.61334000
 C                  3.00350900    0.18545100    1.24953800
 O                  2.67825000    0.44871100    2.46157300
 H                  4.06309300   -0.10254100    1.08714500
 O                 -2.90225708   -0.26009329    0.02748909
 C                 -3.28649270   -1.46182702    0.70061541
 H                 -2.79986378   -2.29792488    0.24341450
 H                 -2.99997764   -1.40139157    1.72976878
 C                 -4.81303399   -1.63962730    0.60233648
 H                 -5.10054250   -2.53881083    1.10603067
 H                 -5.29966209   -0.80351402    1.05951004
 H                 -5.09954575   -1.70009358   -0.42681601

