%chk=opt-b3lyp-pople.chk
#p opt freq b3lyp/6-311+g(d,p) scrf=(smd,solvent=water) Empiricaldispersion=gd3 IOp(1/17=1)

Optimization Cypermethrin-zeta CONF15 water

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 Cl                 2.95067000   -0.60709300    1.67089000
 Cl                 4.58626600   -1.10528000   -0.70990400
 O                 -1.19119200    1.88911700    0.40815100
 O                 -1.68121600    2.49133000   -1.70922700
 O                 -2.27279900   -3.04107100   -0.13665900
 N                 -2.82330700    1.73817200    3.30292300
 C                  1.56444100    3.15908700   -0.26462400
 C                  1.59599000    1.65168800   -0.10214400
 C                  0.60328200    2.28346000   -1.07746000
 C                  1.05821400    3.97653900    0.90732300
 C                  2.64278200    3.86481000   -1.06455000
 C                  2.68085500    0.81716000   -0.64312100
 C                 -0.85146400    2.24228600   -0.85421500
 C                  3.30646700   -0.15447100    0.01856800
 C                 -2.60636100    1.77930100    0.68795600
 C                 -3.16558600    0.51533000    0.06663300
 C                 -2.70905300    1.75979300    2.15202900
 C                 -2.46397600   -0.66930100    0.26140100
 C                 -4.33787500    0.53954100   -0.68664800
 C                 -2.92784100   -1.83445100   -0.32709200
 C                 -4.80900500   -0.65012500   -1.24790300
 C                 -4.10273500   -1.84142300   -1.07822300
 C                 -0.87738500   -3.02967200   -0.09333300
 C                 -0.12342600   -2.29054000   -1.00499000
 C                 -0.26717600   -3.84811600    0.85215700
 C                  1.26760300   -2.37509700   -0.95783500
 C                  1.12547800   -3.93222900    0.88108000
 C                  1.89600200   -3.19671700   -0.02056800
 H                  1.15326500    1.29981100    0.82069900
 H                  0.84199000    2.21421400   -2.13157700
 H                  0.63909400    4.92394400    0.55438600
 H                  1.89488000    4.20607700    1.57388100
 H                  0.29577300    3.45591700    1.48554800
 H                  2.26010900    4.81911200   -1.43788200
 H                  2.98578400    3.28159800   -1.92004100
 H                  3.50456100    4.07423800   -0.42336500
 H                  3.00381900    0.99959400   -1.66174500
 H                 -3.13755400    2.66380900    0.32949500
 H                 -1.55418600   -0.67666200    0.84894700
 H                 -4.86810700    1.47194600   -0.83982500
 H                 -5.71779400   -0.64633700   -1.83800200
 H                 -4.44391200   -2.76853100   -1.52251900
 H                 -0.61672900   -1.65761200   -1.73233900
 H                 -0.88150500   -4.40759900    1.54734600
 H                  1.85897800   -1.79961600   -1.66092300
 H                  1.60566600   -4.56861200    1.61559700
 H                  2.97737800   -3.25827200    0.01031500

--Link1--
%oldchk=opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read output=wfx

Wavefunction Cypermethrin-zeta CONF15 water

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opt-b3lyp-pople.wfx

--Link1--
%oldchk=opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read td=(singlets,nstates=10)

Electronic spectrum Cypermethrin-zeta CONF15 water

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--Link1--
%oldchk=opt-b3lyp-pople.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read

Single Point Cypermethrin-zeta CONF15 water

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