%chk=triplet_EDA_butene_Ph_b.chk
%mem=120GB
%nprocshared=36
#p opt freq=noraman ub3lyp scrf=(smd,solvent=acetonitrile) 
pop=full def2svp empiricaldispersion=gd3bj scf=xqc

Title Card Required

0 3
 C                 -1.41343200    1.32917400    0.25997800
 H                 -1.59809500    2.16548400    0.95041900
 H                 -0.54951600    0.77153000    0.64804400
 C                 -0.96885800    1.89117400   -1.12008700
 H                 -1.84156000    2.35198300   -1.61106500
 H                 -0.61604700    1.06217900   -1.75204900
 C                  0.09521100    2.90854200   -0.94373200
 H                 -0.20764200    3.91709500   -0.63937000
 C                  1.45676000    2.63071800   -1.01329400
 H                  1.78965500    1.67246800   -1.42274600
 H                  2.17368200    3.45337000   -1.06889700
 S                  2.70812300   -0.57183900    0.21323900
 O                  3.43053700   -0.55574200   -1.08545100
 O                  3.35310000   -1.13139400    1.42472800
 Cl                 1.95919300    2.20660700    0.96694000
 C                  1.24115400   -1.79230200   -0.11485400
 F                  0.68802200   -1.44661300   -1.27030700
 F                  1.69963000   -3.03218800   -0.18554200
 F                  0.35458400   -1.70734700    0.86804400
 C                 -2.63317300    0.45360300    0.19499100
 C                 -3.82075400    0.83250200    0.84046400
 C                 -2.61500100   -0.75264800   -0.52341000
 C                 -4.95928300    0.02299200    0.78206400
 H                 -3.84889700    1.77205600    1.39949700
 C                 -3.75094100   -1.56384800   -0.58405900
 H                 -1.70248300   -1.05689800   -1.03869400
 C                 -4.92776800   -1.17936600    0.06974800
 H                 -5.87351000    0.33387900    1.29466900
 H                 -3.71859900   -2.50228200   -1.14374700
 H                 -5.81596300   -1.81459200    0.02332600

