%mem=115GB
%nprocshared=28
%chk=Li_a.chk
#p opt freq b3lyp/gen scrf=(solvent=thf,pcm) empiricaldispersion=gd3bj
scf=xqc

Li_a

0 1
 C                 -2.90894030   -2.52096404    1.30463093
 C                 -2.12418641   -3.60121858    0.55007157
 B                 -1.59534474   -1.57072995   -0.22978691
 O                 -0.94164761   -2.92502367    0.11884218
 O                 -3.01919621   -1.45738095    0.35739235
 C                 -2.94477718   -4.08269380   -0.66088428
 H                 -2.37464346   -4.79522268   -1.21943574
 H                 -3.84952186   -4.54005528   -0.31854302
 H                 -3.18160737   -3.24729789   -1.28571531
 C                 -1.79459452   -4.81992670    1.43300325
 H                 -2.70347754   -5.27874093    1.76196618
 H                 -1.22286823   -5.52633339    0.86762527
 H                 -1.22774253   -4.50162900    2.28319195
 C                 -4.28705150   -3.01811492    1.77827851
 H                 -4.15741093   -3.83262060    2.46000085
 H                 -4.80363443   -2.22027345    2.27005188
 H                 -4.85729276   -3.34585601    0.93474843
 C                 -2.10909287   -2.05692090    2.53607434
 H                 -2.63730953   -1.26689439    3.02692801
 H                 -1.98615506   -2.87743146    3.21162940
 H                 -1.14813143   -1.70440171    2.22496061
 O                 -0.90814079   -0.46737351   -1.05418555
 Li                -1.63308404    1.20274871   -0.55094366
 C                 -4.32429143    1.03682315   -1.32533405
 C                 -2.94055030    1.03315703   -3.00336735
 C                 -3.90228852   -0.40924442   -1.38166534
 H                 -5.09944146    1.26490166   -2.02716269
 H                 -4.66444609    1.33200588   -0.35469988
 C                 -3.19831412   -0.47386503   -2.74104428
 H                 -2.03511755    1.20657538   -3.54765425
 H                 -3.76165531    1.43145722   -3.56147515
 H                 -3.17436948   -0.51489873   -0.60435643
 H                 -4.65351585   -1.15858546   -1.24648375
 H                 -2.34361672   -1.10531763   -2.61543706
 H                 -3.76931728   -0.83419735   -3.57097291
 C                 -3.35302714    2.06884468    1.49059770
 C                 -1.36176936    1.55782345    2.19863017
 C                 -2.58339010    3.32932485    1.19543492
 H                 -3.67617034    2.01524906    2.50923132
 H                 -4.21413304    1.95492467    0.86668747
 C                 -1.28961118    3.09224783    1.98086065
 H                 -0.39590176    1.09657468    2.20584683
 H                 -1.84432576    1.36465347    3.13418200
 H                 -2.37065575    3.28533766    0.14730779
 H                 -3.05328518    4.26665480    1.40633557
 H                 -0.49038430    3.46794172    1.37660698
 H                 -1.21881392    3.53435024    2.95262453
 O                 -3.04751639    1.64326097   -1.72360463
 O                 -2.28509357    1.09860757    1.21915233
 C                  0.59295936    2.13021422   -1.73526536
 C                 -0.73523891    3.88012312   -0.99688035
 C                  0.96856814    3.43241255   -2.41187850
 H                  0.02165963    1.57785696   -2.45142613
 H                  1.41403829    1.52587691   -1.40921628
 C                 -0.44665154    3.99430678   -2.47918995
 H                 -0.09308762    4.58692090   -0.51446623
 H                 -1.74628461    4.07902783   -0.70712145
 H                  1.60610277    4.04064068   -1.80478259
 H                  1.45135014    3.30916133   -3.35919133
 H                 -0.52031662    4.99059601   -2.86245628
 H                 -1.08919341    3.37580847   -3.07150599
 O                 -0.29267264    2.53054159   -0.64118797

C H O B Li 
6-31G(d)
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