%chk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/gas/CONF122/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=GD3BJ opt freq

Optimization 7H2O-solo/ CONF122 gas

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O    1.4031753003   0.8970868879   1.4689354972
H    0.8827819553   0.0880889003   1.3732121733
H    0.8761772217   1.5358331778   0.9698473188
H    2.8128646928   0.4111765058   0.5602084877
O   -3.1458790739   1.2940801812   0.3448530787
H   -3.1360218293   0.3073592833   0.3231214217
O   -2.8322923296  -1.3725479678   0.2979540350
H   -1.8597647060  -1.3975951669   0.1527336163
H   -3.3863223140   1.5280079155   1.2428840511
H   -3.2174363637  -1.8160626663  -0.4592665927
O    3.4821816168   0.0314477616  -0.0525500638
H    3.8469975359   0.7726806541  -0.5373250547
O   -0.2326668136  -0.9668195734  -0.1766000704
H    0.5177834427  -1.3748811797  -0.6655289748
H   -0.3119565352  -0.0603605200  -0.5131864247
O    2.0244237953  -1.7838595722  -1.3998131522
H    2.3607412331  -2.6436318104  -1.1422828746
H    2.6307634646  -1.1303578590  -0.9816228307
O   -0.6534534735   1.8516508554  -0.3938907901
H   -0.6920014270   2.3884436051  -1.1864116156
H   -1.5878267451   1.7441839637  -0.0869727098

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/gas/CONF122/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read output=wfx

Wavefunction 7H2O-solo/ CONF122 gas

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opt-b3lyp.wfx

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/gas/CONF122/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read td=(singlets,nstates=20)

Electronic spectrum 7H2O-solo/ CONF122 gas

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--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/7H2O/7H2O-solo/gas/CONF122/opt-b3lyp.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj geom=check guess=read

Single Point 7H2O-solo/ CONF122 gas

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