%chk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/numerouno/water/CONF1/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) opt freq

Optimization numerouno/ CONF1 water

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Cl   0.6835415647   3.1718674077   0.0956651870
Cl  -1.9389770472  -2.4175298378  -0.4260303337
Cl  -3.6979208858   0.0874590719   0.3209604198
O    2.0462204152   0.7585797733  -0.5767199763
O    3.9610302422  -2.1455282749   0.1945288304
O    2.7283194484  -0.8264456597   1.5228595093
C    0.7411616511   0.5193245441  -0.3738963813
C   -0.0520285354   1.6224581354  -0.0472979742
C    0.1347520105  -0.7238572612  -0.4888265926
C   -1.2293823424  -0.8590718188  -0.2770522528
C   -1.4084859728   1.4870899049   0.1637145550
C   -2.0067427286   0.2412327902   0.0506055211
C    2.9143118203  -0.3194653079  -0.8192264650
C    3.1710288246  -1.1132796952   0.4410922128
H    0.7014065621  -1.6069389117  -0.7498987029
H   -2.0044280686   2.3521809473   0.4190743470
H    2.5664983432  -0.9692425553  -1.6278147657
H    3.8570155740   0.1181425441  -1.1520939808
H    4.1423734135  -2.6354732190   1.0120691983

--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/numerouno/water/CONF1/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read output=wfx

Wavefunction numerouno/ CONF1 water

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opt-b3lyp-pople.wfx

--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/numerouno/water/CONF1/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 numerouno/ CONF1 water

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--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/numerouno/water/CONF1/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read

Single Point numerouno/ CONF1 water

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