%chk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/5H2O/5H2O-BF3/gas/CONF24/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=GD3BJ opt freq

Optimization 5H2O-BF3/ CONF24 gas

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H    1.3368099508  -0.3717794391   0.2868992210
O    1.0791083524   2.6311696696  -0.3251478122
H    0.3363644989   2.9741441116  -0.8787774505
O    0.9083446322  -3.4982081747   0.7521249759
H    0.4460427598  -3.8962334860   1.4922809728
H    0.9781717062   3.0444071577   0.5355191633
H    0.2207453915  -3.0599380145   0.2320624943
O    0.6579312868   0.1220740790  -0.2920415851
H    0.8597889219   1.1226071045  -0.2903649742
O   -1.1244996172   3.1943874746  -1.7167888316
H   -1.0285409302   3.1476651171  -2.6702097682
H   -1.5588876906   2.3694062418  -1.4610425120
O    2.2242693532  -1.2024006183   1.2248346249
H    2.0304738517  -0.9681959265   2.1356730898
H    1.8866037428  -2.1221388084   1.1085957554
B   -0.7933854571  -0.2580521583   0.0112005665
F   -0.9292751615  -1.6045506390  -0.3108377927
F   -1.0474838120  -0.0343575545   1.3448740161
F   -1.5972154010   0.5299278814  -0.8050982065

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/5H2O/5H2O-BF3/gas/CONF24/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read output=wfx

Wavefunction 5H2O-BF3/ CONF24 gas

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opt-b3lyp.wfx

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/5H2O/5H2O-BF3/gas/CONF24/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read td=(singlets,nstates=20)

Electronic spectrum 5H2O-BF3/ CONF24 gas

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--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/5H2O/5H2O-BF3/gas/CONF24/opt-b3lyp.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj geom=check guess=read

Single Point 5H2O-BF3/ CONF24 gas

0 1