%mem=3000MB
%nprocshared=4
#p opt=maxstep=3 freq=noraman b3lyp/6-311+g(d) scrf=(smd,solvent=water)
nosymm guess=always scf=qc empiricaldispersion=gd3 int=ultrafine

ch3nh2-sch2ch3_6311+Gd

-1 1
 N                 -4.69852000    2.00128800   -0.16025300
 H                 -4.15119900    1.14631400   -0.21073300
 H                 -4.41892700    2.55269800   -0.96696400
 C                 -4.33623600    2.73020900    1.06709000
 H                 -4.90003000    3.66292800    1.11840300
 H                 -4.60814400    2.13460800    1.93990300
 H                 -3.27038900    2.97623800    1.14618300
 S                 -3.55972200    4.59976100    4.26809200
 C                 -3.19309611    5.47456347    5.77431446
 H                 -2.66424704    6.37569693    5.54371277
 H                 -4.10584744    5.71561597    6.27797973
 C                 -2.32337092    4.58752092    6.68444281
 H                 -2.10296435    5.11339408    7.58985894
 H                 -2.85222966    3.68639768    6.91506225
 H                 -1.41062939    4.34644950    6.18076884

