%mem=73GB
%nprocshared=24
#p freq=noraman scrf=(solvent=n,n-DiMethylFormamide,smd)  b97d/gen pseudo=read opt

op

0 1
 C                 -0.81257900    1.67804400    2.33004400
 C                 -0.28074700    1.62664600    3.63476300
 H                  0.03483200    0.67102000    4.04882200
 C                 -0.12251000    2.78856800    4.40199900
 H                  0.30561600    2.72065300    5.40318900
 C                 -0.50951700    4.03167300    3.87631400
 H                 -0.39594000    4.94206100    4.46744800
 C                 -1.03557300    4.11118300    2.58153600
 C                 -1.17510400    2.94193900    1.81774000
 C                 -1.98696400    5.14162100   -0.51870800
 C                 -1.19338900    4.01240700   -0.28601600
 C                  0.09594300    3.87939300   -0.85810400
 C                  0.59456000    4.97111200   -1.60107900
 H                  1.59624600    4.91950200   -2.02490100
 C                 -0.18347900    6.11841800   -1.81880400
 H                  0.22779800    6.94482100   -2.40046700
 C                 -1.48429100    6.19518300   -1.29800200
 H                 -2.10040100    7.07806300   -1.47604200
 C                 -0.07423100   -1.17892500    2.03626200
 C                  0.94667500   -1.76665400    1.26522800
 H                  1.12627900   -1.41510700    0.24874000
 C                  1.72394600   -2.80752700    1.79592900
 H                  2.51327000   -3.24782300    1.18922400
 C                  1.47173800   -3.28184400    3.09322900
 H                  2.07749900   -4.09231000    3.50432200
 C                  0.43067500   -2.72375700    3.85635200
 H                  0.21968100   -3.10053500    4.85923500
 C                 -0.34617800   -1.68230700    3.32768800
 H                 -1.16449200   -1.26349800    3.91478200
 C                 -2.78602800   -0.33071800    1.77467200
 C                 -3.18078800   -1.66625000    1.54219100
 H                 -2.50155300   -2.35267200    1.03798300
 C                 -4.44665200   -2.10464500    1.95280200
 H                 -4.74594800   -3.13704300    1.76653800
 C                 -5.33601700   -1.21610000    2.58057100
 H                 -6.32396900   -1.56108200    2.89139500
 C                 -4.95407900    0.11763500    2.79606900
 H                 -5.63919700    0.81488000    3.28285700
 C                 -3.68258000    0.56107800    2.39751800
 H                 -3.39098100    1.59336300    2.59272900
 C                  1.95403800    2.40195700    0.87915500
 C                  2.18146900    3.63376800    1.52232400
 H                  1.75978800    4.55267400    1.11408800
 C                  2.94201900    3.67449300    2.70146200
 H                  3.10306700    4.62983500    3.20475800
 C                  3.48891200    2.49497200    3.23540900
 H                  4.07663500    2.53356100    4.15469100
 C                  3.27474700    1.26793400    2.58618200
 H                  3.69860600    0.34526300    2.98669300
 C                  2.50673300    1.22243600    1.41399300
 H                  2.35144400    0.27304500    0.90896600
 C                  2.36182200    2.37509200   -1.97880300
 C                  3.68014900    1.98738600   -1.65798100
 H                  3.94334900    1.70950200   -0.63885700
 C                  4.67173900    1.94241000   -2.65160300
 H                  5.68196600    1.62820400   -2.38264200
 C                  4.36736700    2.29948300   -3.97393100
 H                  5.13909400    2.26486600   -4.74534600
 C                  3.06306600    2.71258000   -4.29697200
 H                  2.81639900    3.01116500   -5.31768100
 C                  2.06742800    2.74633900   -3.31078300
 H                  1.07049100    3.09376800   -3.57565600
 O                 -1.71953200    3.00803600    0.53008300
 P                 -1.07587500    0.16958700    1.29286200
 P                  1.02332100    2.28645700   -0.70245000
 H                 -1.32756000    5.07049700    2.15450300
 H                 -2.97782600    5.19207100   -0.06622300
 Pd                -0.53898700    0.56682100   -0.95643000
 C                 -1.20665900   -2.21545900   -2.24122100
 C                 -2.05212500   -0.96395400   -2.07794800
 H                 -1.70527300   -2.84550400   -3.00974200
 H                 -0.21587100   -1.95961700   -2.63723000
 O                 -1.10492600   -2.92319300   -1.00526500
 C                 -1.72089700    0.22035000   -2.79560800
 C                 -0.40944700    0.60299700   -3.16201800
 H                 -2.50483300    0.97174700   -2.91767300
 H                 -0.31440100    1.57358000   -3.64419500
 H                  0.38674400   -0.11449000   -3.37544300
 C                 -3.44126800   -1.10923400   -1.58917200
 C                 -4.19671800    0.04387000   -1.18697600
 C                 -4.06694600   -2.35728200   -1.54723800
 C                 -5.52170700   -0.05698800   -0.81452100
 H                 -3.69682000    1.01194300   -1.14395700
 C                 -5.42726000   -2.49601000   -1.15762700
 H                 -3.51232700   -3.26006900   -1.80010600
 C                 -6.18261700   -1.32217600   -0.79256200
 H                 -6.07450600    0.83019200   -0.49791300
 H                 -0.34512900   -3.54318000   -1.12007700
 C                  3.47094855   -2.17575343   -4.27422929
 C                  2.87636542   -2.77734187   -3.19562309
 H                  2.88619844   -1.52143035   -4.92684956
 H                  4.53403188   -2.28152110   -4.50114663
 H                  1.79919569   -2.61028353   -3.07422496
 C                  3.41273625   -3.68583218   -2.20823973
 C                  2.48649719   -4.34381033   -1.33799766
 H                  2.96457095   -4.97273373   -0.54193871
 C                  4.84856916   -3.95396084   -2.05301681
 C                  5.84096792   -2.98018452   -2.26169036
 C                  5.29792845   -5.27128756   -1.68138582
 C                  7.22781121   -3.26489877   -2.12382951
 H                  5.55007713   -1.96571424   -2.53963605
 C                  6.63489562   -5.57681759   -1.51518492
 H                  4.55494703   -6.05950601   -1.56847157
 C                  7.64702514   -4.59505031   -1.73708956
 H                  6.93472042   -6.59315532   -1.24969690
 O                  1.22522509   -4.26891641   -1.35656968
 H                 -7.21248465   -1.39804794   -0.51235481
 H                 -5.88662956   -3.46212776   -1.13535401
 H                  8.68329973   -4.83502473   -1.62112730
 H                  7.95547317   -2.50154496   -2.30465829

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

pd 0
SDD








