%chk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/9H2O/9Agua-BF3/acidity/gas/CONF73/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=GD3BJ opt freq

Optimization acidity/ CONF73 gas

-1 1
B   -0.7315681798  -1.5126311663   0.2034421724
F   -0.6781113859  -0.9850231019   1.5134237997
F   -1.0034792122  -2.8729797196   0.2568938108
F   -1.8149309997  -0.8746327148  -0.4855391458
O    0.5329446948  -1.2171384702  -0.4482984014
H    0.5256393232  -1.5037318376  -1.3815162111
H    0.0374363197  -0.5588241110  -3.3736993895
H    0.2774467604   0.5040204163   2.5394638900
H    2.9460845743   0.7645480553   1.2890439995
O   -1.5508719225   1.9373939737  -0.8319400062
H   -1.7702472553   0.9945190054  -0.8127292209
O    2.7532000671  -1.2027892883   1.2313750032
H    2.0535629470  -1.3053986816   0.5577120245
H   -0.5732623455   1.9311875082  -0.7484876442
H    2.3149964063  -1.4625400146   2.0432440376
O    0.4484005753   1.3945623467   2.8642425161
H   -0.3591788910   1.8663269021   2.5932298567
O   -0.0127711791  -1.5177353356  -3.1877439788
H   -0.9291900113  -1.6679948744  -2.9445523718
O    2.7162340450   1.7088077470   1.2802572994
H    1.9696037500   1.7619906328   1.9086355642
O    0.1028268583   1.2704678456  -3.4436162270
H   -0.7205204684   1.6022344502  -3.0705870748
H    0.7314506992   1.4290448441  -2.7163768884
O   -2.1172361500   2.0812463530   1.8873838606
H   -2.3302551837   1.1476656577   1.9681885707
H   -1.9738507230   2.1964279093   0.9269249582
O    1.1362061173   1.4329531275  -0.8832811132
H    0.9586360977   0.4865688586  -0.7013371864
H    1.7785222148   1.6942400227  -0.1808583425

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/9H2O/9Agua-BF3/acidity/gas/CONF73/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read output=wfx

Wavefunction acidity/ CONF73 gas

-1 1

opt-b3lyp.wfx

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/9H2O/9Agua-BF3/acidity/gas/CONF73/opt-b3lyp.chk
#P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj geom=check guess=read pop=nbo7read

Wavefunction acidity/ CONF73 gas

-1 1

$nbo PLOT File=opt-b3lyp bndidx nbcp ncu $end 

--Link1--
%oldchk=/home/lamsabhi/diver/Herbicidas/Calculos/BF3-H2O/9H2O/9Agua-BF3/acidity/gas/CONF73/opt-b3lyp.chk
#P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj geom=check guess=read

Single Point acidity/ CONF73 gas

-1 1