%mem=53GB
%nprocshared=24
#p scrf=(solvent=n,n-DiMethylFormamide,smd)  b97d/gen pseudo=read opt freq=noraman

opt

0 1
 C                 -1.08719000    2.13522400    1.74061200
 C                 -1.35625100    2.06500900    3.12254200
 H                 -1.99836400    1.27396800    3.50733200
 C                 -0.79725300    2.99267000    4.01450900
 H                 -1.01154500    2.91328200    5.08156000
 C                  0.03350700    4.01553700    3.53069200
 H                  0.47577200    4.73904000    4.21798100
 C                  0.29782300    4.12118000    2.15755300
 C                 -0.26541200    3.18511300    1.27869600
 C                  1.32904000    5.01427500   -0.92791400
 C                  1.16995800    3.67751000   -0.54198500
 C                  2.23248000    2.74762800   -0.59907200
 C                  3.50146900    3.24118400   -0.97702200
 H                  4.35587600    2.56651400   -0.99623800
 C                  3.68201600    4.58396100   -1.34091100
 H                  4.67449300    4.93340900   -1.63014300
 C                  2.59117400    5.46793500   -1.33962700
 H                  2.72228400    6.51000800   -1.63602000
 C                 -2.70339400   -0.24591800    1.49911400
 C                 -2.02699800   -1.03885000    2.45411600
 H                 -0.95769700   -0.90453900    2.61334300
 C                 -2.72287400   -1.99699300    3.20209600
 H                 -2.18784700   -2.59919900    3.93921800
 C                 -4.10133400   -2.18622400    2.99628100
 H                 -4.64348700   -2.93834500    3.57305500
 C                 -4.77680400   -1.40450100    2.04604600
 H                 -5.84619500   -1.54644400    1.87817400
 C                 -4.08348300   -0.43916400    1.29613700
 H                 -4.62144500    0.15103700    0.55749900
 C                 -2.85992600    1.92838200   -0.50555600
 C                 -2.60287200    2.08909000   -1.88113600
 H                 -1.73715800    1.58972000   -2.32269200
 C                 -3.44685900    2.88577900   -2.67009000
 H                 -3.24275800    3.00184400   -3.73654900
 C                 -4.54941300    3.53274000   -2.08538300
 H                 -5.20839300    4.15097700   -2.69843300
 C                 -4.79761600    3.39284100   -0.70834600
 H                 -5.64557300    3.90464900   -0.24876700
 C                 -3.95130100    2.59976400    0.08264300
 H                 -4.13946700    2.50177600    1.15320700
 C                  2.16185200    0.80799300    1.58795100
 C                  2.86514800    1.76604800    2.34398100
 H                  3.29232100    2.64219400    1.85402500
 C                  2.99933800    1.60278900    3.73159800
 H                  3.53435300    2.35545100    4.31444100
 C                  2.44179000    0.48096300    4.36900900
 H                  2.54315800    0.36032500    5.44957600
 C                  1.74993800   -0.48270400    3.61585500
 H                  1.31729600   -1.35816800    4.10108400
 C                  1.60663900   -0.31807600    2.22977400
 H                  1.05190500   -1.05212000    1.64094400
 C                  3.40165600    0.11555300   -0.94847000
 C                  4.03070700   -0.93481500   -0.24862700
 H                  3.71119200   -1.19014000    0.76193200
 C                  5.06748300   -1.66521500   -0.85113000
 H                  5.54485600   -2.47588000   -0.29693200
 C                  5.49796100   -1.34694700   -2.15079200
 H                  6.31140200   -1.90971100   -2.61298100
 C                  4.87233000   -0.30319900   -2.85346900
 H                  5.19151600   -0.05375700   -3.86739000
 C                  3.81784200    0.41065500   -2.26597800
 H                  3.32391700    1.20184200   -2.83105900
 O                 -0.08499400    3.26504400   -0.09982100
 P                 -1.69393900    0.91460000    0.49624100
 P                  1.92487500    0.95609400   -0.23313800
 H                  0.93756600    4.91484700    1.77225500
 H                  0.47041400    5.68490300   -0.87875800
 Pd                -0.09757900   -0.12766600   -0.79765200
 C                 -1.51791500   -2.89140900   -0.40982400
 C                 -1.64221500   -1.80670600   -1.50311600
 H                 -0.58597200   -2.69344500    0.17984200
 H                 -2.34793000   -2.71058800    0.31041500
 O                 -1.54781500   -4.12776500   -1.00100900
 C                 -2.96390700   -1.28911800   -1.86671500
 C                 -3.75634309   -1.55201681   -2.94674374
 H                 -3.38904801   -0.59493864   -1.14148661
 C                 -0.55447000   -1.65611800   -2.46930100
 C                  0.79221400   -1.99329100   -2.08520000
 C                 -0.74050400   -1.11100600   -3.78639600
 C                  1.85954200   -1.87184400   -3.00677600
 H                  0.97600000   -2.54498800   -1.16686000
 C                  0.32923600   -0.96903100   -4.66296100
 H                 -1.74517900   -0.84594000   -4.11474500
 C                  1.63888800   -1.35904300   -4.28128300
 H                  2.85604800   -2.18921000   -2.70183800
 H                  0.15326400   -0.57277700   -5.66559600
 H                  2.46452400   -1.26355600   -4.98901300
 C                 -5.15226836   -0.96970787   -2.99122764
 H                 -5.27026104   -0.28661179   -3.85303619
 H                 -5.89290863   -1.77816504   -3.13570511
 H                 -5.41120503   -0.42485959   -2.06958715
 C                 -3.36744085   -2.34376467   -4.17119997
 H                 -2.27637137   -2.47907440   -4.24789507
 H                 -3.85194323   -3.33720838   -4.16375124
 H                 -3.73997640   -1.82265641   -5.07292487
 H                  0.02419000   -4.70019100   -0.89559700
 N                  1.03182200   -4.96651900   -0.67696200
 H                  1.68407100   -4.67931900   -1.40587500
 C                  1.43708100   -4.60384400    0.59938700
 C                  2.78342200   -4.26251200    0.90014800
 C                  0.49203500   -4.60106700    1.66396700
 C                  3.16495900   -3.94341200    2.21211700
 H                  3.51832400   -4.24418400    0.09104900
 C                  0.88582000   -4.27829900    2.96774900
 H                 -0.54725800   -4.83524800    1.42325500
 C                  2.22581600   -3.95123400    3.26012000
 H                  4.20698900   -3.68136000    2.41491800
 H                  0.13817000   -4.27932700    3.76576000
 H                  2.52785000   -3.70200200    4.27884400

C N O P H 0
6-31g(d)
****
pd 0
SDD
****

pd 0
SDD






