! Freq RIJCOSX r2scan-3c CPCM(CH2Cl2)
%cpcm
surfacetype vdw_gaussian
end
%output 
xyzfile=True 
end 
%scf 
maxiter 250 
end
%output
Print[P_Hirshfeld] = 1
end
% maxcore
4800
%pal nprocs 16
end
*xyz 1 1
C    1.85536303   2.01765186   1.34930008 
C    0.54403813   1.67357825   2.01055139 
C   -0.38426713   0.77429795   1.43873219 
C   -0.05591574   0.08290901   0.17756865 
C    1.15624866  -0.66168770   0.11039706 
C    1.68515866  -1.34207177   1.26188291 
O    0.82890443  -1.49162026   2.28615769 
C    1.30012472  -2.11114403   3.49355910 
C    2.95929225  -1.87245393   1.27319168 
C    3.75738007  -1.75207771   0.12744596 
O    4.98584052  -2.28054038   0.23921745 
C    5.87473761  -2.22383535  -0.89367092 
C    3.28374172  -1.14365963  -1.03994871 
C    1.99183108  -0.63798556  -1.05826213 
O    1.48853887  -0.01500136  -2.13304840 
C    2.31637347   0.15837968  -3.29567575 
C   -0.96074665   0.19719762  -0.91539625 
C   -1.73071576   1.39256931  -1.13317009 
O   -1.33620591   2.46829980  -0.43188024 
C   -2.08578612   3.68732360  -0.55727769 
C   -2.75026922   1.44299655  -2.06211398 
C   -3.04013931   0.29917715  -2.81822860 
O   -4.05633763   0.43920222  -3.68315920 
C   -4.41942946  -0.67717248  -4.51915698 
C   -2.30255316  -0.88173621  -2.68128160 
C   -1.25923898  -0.92051508  -1.76766217 
O   -0.53511569  -2.02948102  -1.56263531 
C   -0.85606488  -3.22315972  -2.29677969 
C   -1.62199391   0.53388434   2.07282417 
C   -2.62952867  -0.45568578   1.54313112 
C   -1.89784504   1.18296456   3.27412140 
C   -1.00408334   2.08705608   3.84742611 
C   -1.34049773   2.81134096   5.11969208 
C    0.20773676   2.32186070   3.19432925 
H    1.75572811   2.09103270   0.26224153 
H    2.22310209   2.97564465   1.72675767 
H    2.62581066   1.26496287   1.55513052 
H    1.58231425  -3.15431296   3.31157374 
H    2.14975781  -1.55692427   3.90744501 
H    0.45738206  -2.07069564   4.18412932 
H    3.35930872  -2.40449949   2.12630828 
H    5.45238618  -2.76990729  -1.74370904 
H    6.07915143  -1.18449431  -1.17174217 
H    6.79366303  -2.70661241  -0.56202690 
H    3.91650962  -1.05925132  -1.91075592 
H    1.69317685   0.69530931  -4.01099615 
H    2.60869745  -0.81169433  -3.71233052 
H    3.20521313   0.75230429  -3.05586489 
H   -1.61352197   4.38591197   0.13386448 
H   -2.02666699   4.07747336  -1.57956526 
H   -3.13226352   3.53029459  -0.27324852 
H   -3.31987075   2.34338587  -2.25087606 
H   -5.25498602  -0.32376984  -5.12285239 
H   -3.58462217  -0.96162142  -5.16830427 
H   -4.73542808  -1.52959306  -3.90853195 
H   -2.54748235  -1.75259183  -3.27062286 
H   -0.72993959  -3.06278550  -3.37303991 
H   -1.87826822  -3.55146848  -2.07867983 
H   -0.14381089  -3.97139872  -1.94879361 
H   -2.14844061  -1.35393340   1.14426264 
H   -3.23446660  -0.02573434   0.73598599 
H   -3.31196096  -0.75558886   2.34280606 
H   -2.83598596   0.96880108   3.78242483 
H   -1.64920592   3.84199670   4.90443115 
H   -2.16046370   2.32238631   5.65235381 
H   -0.47236977   2.86785092   5.78419147 
H    0.90897704   3.03836112   3.61855315 
*
