%chk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/mcpa/gas/CONF2/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 opt freq

Optimization mcpa CONF2 gas

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Cl   3.8589698258  -0.8908333429   0.2341093506
O   -1.5717258657   1.1773400999  -0.4334741639
O   -3.9749930469  -1.4467478278  -0.5771356473
O   -2.8200782547  -0.6743257572   1.1805916819
C    0.6116776531   1.4392540515   0.3246625844
C   -0.3430526317   0.6220698341  -0.2927920635
C    1.8988476625   0.9514067515   0.4753662851
C   -0.0010621459  -0.6469718678  -0.7362719518
C    0.2373569661   2.8045880356   0.8155258205
C    2.2400137277  -0.3169407752   0.0273340480
C    1.2948861999  -1.1196129928  -0.5761598167
C   -2.6069067787   0.4163398318  -0.9613033600
C   -3.1161246670  -0.6190416664   0.0255162409
H    2.6477803535   1.5701767588   0.9522767703
H   -0.7213772583  -1.3003715283  -1.2095629374
H    1.0885383078   3.2924517062   1.2874002265
H   -0.1059821870   3.4454702630   0.0024612391
H   -0.5695765765   2.7560652823   1.5474044353
H    1.5540402873  -2.1104996873  -0.9214194684
H   -3.4246240993   1.1104472174  -1.1739073397
H   -2.3498580622  -0.0583205042  -1.9157805752
H   -4.3189940955  -2.0679467900   0.0786709167

--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/mcpa/gas/CONF2/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read output=wfx

Wavefunction mcpa CONF2 gas

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opt-b3lyp-pople.wfx

--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/mcpa/gas/CONF2/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read td=(singlets,nstates=10)

Electronic spectrum mcpa CONF2 gas

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--Link1--
%oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/2_herbicidas/group4/mcpa/gas/CONF2/opt-b3lyp-pople.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 geom=check guess=read

Single Point mcpa CONF2 gas

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