%chk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/6H2O/6Agua-solo/water/CONF11/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) opt freq

Optimization 6Agua-solo CONF11 water

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O   -1.8903496595   0.2837254285   1.7192310750
H   -1.0026400118  -0.1340080194   1.7177271621
H   -2.4593349282  -0.3507019855   2.1657123179
H    1.1983745598  -0.1000376073   1.2761333008
H   -2.2928527974   0.1099344970   0.0166611286
H    0.9718642031  -0.0111271959  -1.7349623475
O   -0.0276914004  -1.3676405018  -1.2707855629
H    0.2391406890  -1.3938935480  -0.3361930946
O    2.1370552265   1.2223815394   0.7313383921
H    1.6118530460   1.9855535725   0.9927726269
H   -0.9140078002  -0.9496317622  -1.2373220667
H    1.9676860843   1.1234170470  -0.2342447448
O   -2.4358251972  -0.0417848376  -0.9441023875
H   -2.2239662029   0.8024809705  -1.3540049882
O    0.5777384177  -0.8448889792   1.4643919474
H    0.9850339642  -1.3652808873   2.1635773672
O    1.5482737464   0.7737059750  -1.8843870829
H    2.3447161629   0.4187821773  -2.2904728333

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/6H2O/6Agua-solo/water/CONF11/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read output=wfx

Wavefunction 6Agua-solo CONF11 water

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opt-b3lyp.wfx

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/6H2O/6Agua-solo/water/CONF11/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read td=(singlets,nstates=20)

Electronic spectrum 6Agua-solo CONF11 water

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--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/6H2O/6Agua-solo/water/CONF11/opt-b3lyp.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read

Single Point 6Agua-solo CONF11 water

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