%chk=TDDFT_EDA_complex_pentene_def2svp.chk
%mem=120GB
%nprocshared=24
#p td=(nstates=100) PBEPBE/Def2TZVP scrf=(smd,solvent=acetonitrile) pop=full empiricaldispersion=gd3bj gfinput iop(9/40=2) scf=save

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0 1
 C                  2.97998900    1.84307100    0.34969000
 H                  3.69677200    2.65893900    0.56718300
 H                  2.53686500    1.55301000    1.31794100
 C                  3.73905000    0.68399600   -0.22746300
 H                  4.06540300    0.79934400   -1.27013400
 C                  4.04572800   -0.45045400    0.42007100
 H                  4.61791900   -1.24780400   -0.06385400
 H                  3.75744200   -0.60835600    1.46526400
 S                 -1.64560200   -1.54491000   -0.06053800
 C                 -2.06119000    0.19410600    0.01122400
 C                 -2.11687100    0.91574900   -1.18318500
 C                 -2.26474300    0.78236100    1.26081300
 C                 -2.39514700    2.28178200   -1.11520800
 H                 -1.94421000    0.42072000   -2.13985100
 C                 -2.54348700    2.14979700    1.30766600
 H                 -2.20631900    0.18496100    2.17155600
 C                 -2.60497400    2.89541200    0.12523500
 H                 -2.44551700    2.86865400   -2.03475800
 H                 -2.71085500    2.63347400    2.27243400
 H                 -2.81505200    3.96635200    0.17061700
 O                 -2.03512400   -2.08305100   -1.37063600
 O                 -2.08814800   -2.20316400    1.17564400
 I                  0.90038200   -1.38851300   -0.00992800
 C                  1.89595900    2.39811400   -0.58542100
 H                  2.37051800    2.72836500   -1.52669500
 H                  1.20035100    1.58747800   -0.85876900
 C                  1.11565500    3.55379600    0.03438100
 H                  1.78536200    4.38458200    0.31543700
 H                  0.36248700    3.95139300   -0.66416100
 H                  0.58458800    3.23195000    0.94571200


