%mem=3000MB
%nprocshared=12
#p opt=(ts,calcfc,noeigentest,maxstep=4) freq b3lyp/6-311+G(d) scrf=(smd,solvent=water) empiricaldispersion=gd3 nosymm

ch3cooch3-nhcho-ts_6311+Gd_aq_new

-1 1
 C	 1.029485000	-0.401048000	 0.084187000
 H	 0.968595000	-1.191705000	-0.641440000
 H	 0.918439000	 0.618972000	-0.235338000
 H	 0.985564000	-0.630275000	 1.132249000
 N	-1.127064000	-0.479150000	 0.080164000
 H	-1.630046000	-1.062950000	-0.583387000
 C	-1.870227000	 0.501105000	 0.531946000
 O	-1.484323000	 1.412896000	 1.330756000
 H	-2.926239000	 0.537987000	 0.197057000
 O	 2.889565000	-0.237605000	 0.010014000
 O	 4.917595000	-1.097074000	 0.240129000
 C	 3.677981000	-1.223204000	 0.304081000
 C	 3.064754000	-2.540353000	 0.729127000
 H	 2.443992000	-2.402100000	 1.617881000
 H	 2.417096000	-2.930163000	-0.060271000
 H	 3.843257000	-3.270044000	 0.945751000




