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

ch3nhcho-sch2ch3_6311+Gd_ch2cl2_1

-1 1
 N                 -0.46765700    0.06822200    0.16849900
 H                 -0.46737700   -0.12856100   -0.82219400
 C                  0.09521600    1.21681700    0.57917300
 O                  0.17107300    1.59165200    1.74711500
 H                  0.50204800    1.81580500   -0.25385800
 C                 -1.07891200   -0.89437200    1.07684700
 H                 -1.44074100   -1.73622200    0.48959800
 H                 -0.35215000   -1.25572200    1.80821200
 H                 -1.92047900   -0.44930900    1.61270900
 S                 -4.24892400   -3.24124700    2.09953100
 C                 -5.71678800   -4.25294800    2.61068300
 H                 -5.74614000   -4.32236800    3.70497400
 H                 -5.59675100   -5.27897900    2.24188900
 C                 -7.05401500   -3.70325800    2.11462900
 H                 -7.89425500   -4.33384700    2.43963900
 H                 -7.22662700   -2.69030000    2.49309200
 H                 -7.07447700   -3.65136400    1.02084300

