%mem=3000MB %nprocshared=12 #p freq=noraman b3lyp/6-311+g(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 scf=(maxcyc=1000,conver=8,nosym) ch3cf3-nhcho_6311+Gd_ch2cl2 -1 1 N 3.28948100 -0.81209000 0.00463500 H 3.45220200 -1.81967900 -0.00580500 C 4.45830300 -0.19851500 -0.00937200 O 4.66347600 1.04446400 0.00309800 H 5.37213500 -0.84840500 -0.03350500 C -0.82225900 -0.22783100 0.05823900 H -0.28218100 0.71760300 0.01714100 H -0.58150500 -0.74113500 0.98912600 H -0.52979000 -0.84928500 -0.78820600 C -2.29219600 0.03036700 -0.00015200 F -3.02804200 -1.11288700 0.07160900 F -2.67111900 0.65156000 -1.14925700 F -2.72618600 0.82196000 1.01895100