%mem=73GB
%nprocshared=24
#p scrf=(solvent=n,n-DiMethylFormamide,smd)  b97d/gen IOP(1/8=4) pseudo=read opt=(ts,calcfc,noeigen,nomicro) freq=noraman

opt

0 1
 C                 -0.72225800    1.29152300   -2.80850100
 C                 -1.63787200    1.19071000   -3.87352700
 H                 -2.01118700    0.21216600   -4.17252400
 C                 -2.08926100    2.33856200   -4.54319200
 H                 -2.80826300    2.24209400   -5.35840800
 C                 -1.61891200    3.60472000   -4.15857900
 H                 -1.97368100    4.50215600   -4.66875300
 C                 -0.67749600    3.72837700   -3.12581400
 C                 -0.23210400    2.57265200   -2.47114500
 C                  1.63332600    4.75485600   -0.90086900
 C                  0.78762900    3.67811400   -0.60812800
 C                  0.00734100    3.63697200    0.57047300
 C                  0.05163900    4.76704600    1.41557800
 H                 -0.56480400    4.79754400    2.31197900
 C                  0.88013600    5.86148700    1.12312600
 H                  0.89368800    6.71877500    1.79801200
 C                  1.68547200    5.85052400   -0.02596000
 H                  2.33932200    6.69427000   -0.25240500
 C                 -1.06377400   -1.59567200   -2.30169100
 C                 -2.47220400   -1.56502500   -2.41606900
 H                 -3.01133300   -0.62984000   -2.28530600
 C                 -3.18937100   -2.73250900   -2.71376100
 H                 -4.27610300   -2.68778300   -2.79967600
 C                 -2.51438600   -3.95237000   -2.88331700
 H                 -3.07370700   -4.86265600   -3.10780900
 C                 -1.11667900   -3.99564700   -2.75241700
 H                 -0.58233200   -4.93975300   -2.87629100
 C                 -0.39360100   -2.82786700   -2.46111600
 H                  0.68921600   -2.87772500   -2.35671900
 C                  1.57281400   -0.36190000   -2.46545600
 C                  2.70269500   -0.10889900   -1.66741300
 H                  2.56781000    0.20266500   -0.63359900
 C                  3.99529800   -0.25948200   -2.19526800
 H                  4.86049400   -0.06345600   -1.56004600
 C                  4.16397000   -0.66330100   -3.52980900
 H                  5.16778600   -0.78604500   -3.94216200
 C                  3.03769500   -0.90698300   -4.33705500
 H                  3.16434100   -1.21665500   -5.37667100
 C                  1.74614800   -0.75076000   -3.81102900
 H                  0.87598600   -0.93997200   -4.44220700
 C                 -2.51923200    2.37396900   -0.10514200
 C                 -2.98693200    3.65682100   -0.45189200
 H                 -2.42015700    4.54335300   -0.16384700
 C                 -4.17839500    3.79149900   -1.18064600
 H                 -4.53040700    4.78629200   -1.46101200
 C                 -4.91489000    2.65202800   -1.55004200
 H                 -5.84258800    2.76237400   -2.11516200
 C                 -4.45428500    1.37332300   -1.19540400
 H                 -5.01813400    0.48228900   -1.47699600
 C                 -3.25407500    1.23583500   -0.48099500
 H                 -2.88015400    0.24800000   -0.21579400
 C                 -1.66543200    2.41430900    2.64394800
 C                 -3.03114600    2.19844300    2.92761500
 H                 -3.72767800    1.95508900    2.12546000
 C                 -3.50631500    2.29271400    4.24571800
 H                 -4.56540900    2.12031900    4.44739000
 C                 -2.62936600    2.61376400    5.29445900
 H                 -3.00143500    2.69055800    6.31793600
 C                 -1.26959700    2.83879000    5.01928600
 H                 -0.57955500    3.09408400    5.82584100
 C                 -0.78797800    2.73272800    3.70608800
 H                  0.27002600    2.90642800    3.50689000
 O                  0.75862900    2.60426000   -1.49336500
 P                 -0.12133600   -0.10732800   -1.77207100
 P                 -1.02075700    2.13808300    0.93485700
 H                 -0.29401800    4.70486500   -2.83098600
 H                  2.22549900    4.72775900   -1.81609300
 Pd                 0.02241200    0.14612900    0.59357000
 C                  2.25589800   -2.01589000    1.02382000
 C                  2.91353600   -0.77089000    1.61658200
 H                  2.89396600   -2.40139500    0.20997600
 H                  2.19304800   -2.80758500    1.79632100
 O                  0.93299700   -1.81675600    0.50847200
 C                  2.15267100    0.12829900    2.32528600
 C                  0.73073200   -0.02925000    2.61252800
 H                  2.61876800    1.06384900    2.64975200
 H                  0.32455500    0.70130500    3.31246700
 H                  0.41327000   -1.04916900    2.86319100
 C                 -0.58827400   -3.63921000    1.69975400
 H                  0.14877400   -2.68646900    1.11808600
 C                 -0.08909600   -3.70011200    3.10010900
 C                 -0.63764300   -3.18631500    4.22316000
 H                  0.86041500   -4.23868800    3.19021100
 H                 -0.13827600   -3.31072800    5.18819500
 H                 -1.58780000   -2.64695700    4.22374100
 C                 -0.07889600   -4.70741200    0.81240800
 O                  0.88874800   -5.44916400    1.02769900
 H                 -0.58583200   -4.73835900   -0.18290300
 C                  4.33549700   -0.52918600    1.31729600
 C                  5.04926352   -1.37447687    0.45754091
 C                  5.01765869    0.62390450    1.84290453
 C                  8.42108037    0.30306550    0.27267483
 C                  6.40397066   -1.12149296    0.10257568
 C                  6.33070196    0.90008524    1.51265052
 H                  4.47061848    1.31957562    2.48057345
 C                  9.10065691   -0.55547021   -0.58273442
 H                  8.91445650    1.18948444    0.67939915
 C                  7.13112814   -1.98478431   -0.77293654
 C                  7.06846643    0.04447266    0.63797264
 H                  6.81962726    1.79404854    1.90794148
 C                  8.44946306   -1.70787582   -1.10805291
 H                 10.13804772   -0.34951335   -0.85477848
 H                  6.62729346   -2.86668276   -1.17630413
 H                  8.99354818   -2.37544725   -1.77976958
 H                  4.57213297   -2.26768407    0.04934666
 C                 -1.99756700   -3.17304800    1.45378400
 C                 -2.65769806   -2.28437240    2.30392177
 C                 -2.72047524   -3.67710335    0.32101834
 C                 -6.10775690   -2.11319627    0.78322669
 C                 -4.02151462   -1.92076182    2.10344851
 C                 -4.03210541   -3.31240335    0.07264415
 H                 -2.22312234   -4.36825790   -0.35563106
 C                 -6.75807003   -1.28277513    1.68705689
 H                 -6.63958344   -2.52869274   -0.07621792
 C                 -4.71473259   -1.05738755    3.00453983
 C                 -4.73395879   -2.44990083    0.96469696
 H                 -4.55460917   -3.70994511   -0.79897408
 C                 -6.05298492   -0.74704730    2.80323247
 H                 -7.81214429   -1.03498030    1.54414804
 H                 -4.17412282   -0.65611282    3.86525757
 H                 -6.57315539   -0.09129388    3.50503246
 H                 -2.13487873   -1.84950826    3.15807097

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

pd 0
SDD






