%chk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/water/CONF157/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) opt freq

Optimization 7H2O-solo/ CONF157 water

0 1
O   -1.1130558495   1.3800579958   0.7891249849
H   -0.1627519850   1.6688162485   0.8200447781
H   -1.6132454210   2.0814823818   1.2191298685
H    2.9810054830  -0.2822416383  -0.5325368098
O   -1.6255321689   0.9571168049  -1.8634040138
H   -1.1984494694   1.6830470419  -2.3280382005
O   -0.4817543167  -2.6670670798   0.2530602341
H   -0.6377182781  -2.0506176914   1.0035776137
H   -1.5012657491   1.1674149132  -0.9141771299
H   -1.3640698555  -2.9202537853  -0.0350643808
O    2.4335657812   0.3474923265  -1.0112569847
H    1.6515549307  -0.1795885298  -1.3155622447
O    0.3074912724  -1.0455143803  -1.8330178298
H   -0.3974341289  -0.3694468784  -1.8918147103
H    0.0433865511  -1.6238680372  -1.0861958878
O   -0.9306359207  -0.9117940099   2.2849632021
H   -1.0333671515  -0.0747240486   1.7848337072
H   -1.8184774337  -1.1202300624   2.5914624675
O    1.4655547957   2.0007965706   0.8733885299
H    1.8438979974   1.4015618083   0.1837315077
H    1.7469819515   1.6152025079   1.7092837331

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/water/CONF157/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read output=wfx

Wavefunction 7H2O-solo/ CONF157 water

0 1

opt-b3lyp.wfx

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/water/CONF157/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 7H2O-solo/ CONF157 water

0 1

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/water/CONF157/opt-b3lyp.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read

Single Point 7H2O-solo/ CONF157 water

0 1