%nprocshared=8
%mem=20GB
#p b3lyp/gen scrf=(smd,solvent=thf) nosymm scf=xqc EmpiricalDispersion=GD3 Int=Grid=UltraFine

Panti

0 1
 C                  2.52857900    1.20074700    1.47902200
 O                  2.39220400    1.55903100    0.10470800
 C                  2.28683800   -2.20813000   -0.01476900
 H                  3.29445100   -2.58924400   -0.15494800
 H                  1.48367800   -2.75786500   -0.50091100
 C                  2.03076100   -1.12051200    0.71056500
 H                  0.99618200   -0.79393500    0.82354100
 C                  3.02875700   -0.29501500    1.51455200
 C                  3.40753800    2.18581600    2.23083900
 C                  3.10422800    2.54153500    3.55223100
 C                  4.53215400    2.75799600    1.61801600
 C                  3.91698900    3.43285400    4.25665900
 H                  2.22418000    2.11854300    4.03174600
 C                  5.34282400    3.65271700    2.31836200
 H                  4.76809800    2.49469200    0.59244900
 C                  5.04075800    3.99008900    3.64095400
 H                  3.66720900    3.69784500    5.28087000
 H                  6.21303300    4.08510200    1.83108600
 H                  5.67271600    4.68707400    4.18530500
 H                  1.53506900    1.19843100    1.95627400
 C                  4.46558700   -0.38642300    0.98624000
 C                  5.56531000   -0.57527300    1.83604600
 C                  4.72334100   -0.19552200   -0.38305300
 C                  6.87272900   -0.56372600    1.34220600
 H                  5.41372400   -0.74840200    2.89421500
 C                  6.02754300   -0.18118200   -0.87947000
 H                  3.89177200   -0.04217400   -1.05916100
 C                  7.11233800   -0.36288400   -0.01754900
 H                  7.70376000   -0.71331300    2.02714900
 H                  6.19460700   -0.02664600   -1.94274300
 H                  8.12907900   -0.35329700   -0.40210900
 C                  2.90205900   -0.76539200    2.98435600
 H                  3.51592200   -0.12889400    3.63537900
 H                  1.85471800   -0.63593600    3.29908800
 O                  3.29554100   -2.12900800    3.08295100
 H                  3.26888900   -2.36523800    4.02435300
 H                  2.17861000    2.50695800    0.07508300

-C -H 0
cc-pvtz
****
-O -N -P -Cl 0
aug-cc-pvtz
****

