%nprocshared=20
%mem=46GB
%chk=Pd_lnr_anther_3_SP.chk
#p b3lyp/genecp empiricaldispersion=gd3bj

Pd_lnr_anther_3_SP

1 1
 C                 -1.98465600    0.54292900   -0.27372100
 C                 -3.65566700    2.04801400   -0.33792600
 C                 -2.78506800    2.36814400   -1.33152300
 N                 -1.75993300    1.43647400   -1.27306300
 N                 -3.14462500    0.92854100    0.30462600
 C                 -0.56486900    1.40867700   -2.13870600
 H                 -0.76216100    0.75608200   -2.99379600
 H                 -0.41736500    2.42591500   -2.50958700
 C                  0.63970500    0.92832900   -1.36062100
 C                  1.26570900    1.77861400   -0.43990800
 C                  1.10171700   -0.38656000   -1.53073300
 C                  2.32977800    1.30469800    0.33001200
 H                  0.89255300    2.78569800   -0.30259500
 C                  2.19849800   -0.86595300   -0.76949600
 H                  0.73143800   -1.01581300   -2.33486000
 C                  2.80186000   -0.02971800    0.18443300
 O                  3.75400400   -0.53669400    1.01335900
 O                  2.95246300    2.02588100    1.28554800
 O                  2.52284400   -2.15620400   -1.00742100
 C                  2.52542100    3.36539600    1.52478400
 H                  1.47790400    3.39134200    1.84730600
 H                  3.16341300    3.73774900    2.32579500
 H                  2.65543700    3.98656900    0.63109300
 C                  5.06510100    0.05616800    0.97370900
 H                  5.05338400    1.06334100    1.39165700
 H                  5.69711000   -0.59469900    1.57881000
 H                  5.44113800    0.08208500   -0.05578100
 C                  3.86359900   -2.63811200   -0.81654300
 H                  3.90576900   -3.57490700   -1.37350200
 H                  4.58918900   -1.93218000   -1.23326600
 H                  4.07534900   -2.81190900    0.23829800
 C                 -3.72042100    0.31152900    1.50703000
 H                 -2.90207600    0.18917500    2.21937800
 H                 -4.41989900    1.03561700    1.93055500
 C                 -4.42036500   -1.02238800    1.24669700
 H                 -4.72598200   -1.39974300    2.23030000
 H                 -5.34015800   -0.85430000    0.67551800
 C                 -3.55681200   -2.07686100    0.53258700
 H                 -4.01057400   -3.06152400    0.71504100
 H                 -3.59926900   -1.93283200   -0.55245200
 C                 -2.10572500   -2.11972000    0.98383200
 H                 -1.61762800   -3.06359100    0.68299000
 H                 -1.97897300   -1.96759500    2.06167600
 H                 -4.57353000    2.51836900   -0.02218100
 H                 -2.79902400    3.16540000   -2.05784300
 Pd                -0.73968400   -0.95622500    0.03589500

C H O N
cc-pVTZ
****
@/home/eapaloo/electrocyreact/cc-pVTZ_Pd_Basis_set.gbs/N





























