%nprocs=48
%mem=350GB
%chk=3h-ptbu3-6cn06-c2-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.46579       -0.77493       -0.04812
O          0.02092       -2.87333       -0.19283
H          0.47038       -3.17439        0.62024
B         -1.43386       -3.37163       -0.13618
O         -1.49806       -4.21547        1.01338
O         -1.84000       -3.93302       -1.41779
O         -2.24924       -2.09155       -0.00499
H         -2.76226       -1.99466       -0.82927
O         -0.48828       -2.04202       -2.94342
H          0.26057       -2.17610       -2.32911
H         -1.07254       -2.78190       -2.63442
H          1.54796       -0.35877       -2.24970
H          4.02338       -0.17791       -2.33039
C          2.12066       -0.28730       -1.31204
C          3.50190       -0.18334       -1.36009
H          6.21189        0.06717       -1.15236
C          1.43135       -0.29121       -0.05781
C          4.27339       -0.07623       -0.16361
C          5.68699        0.04903       -0.18569
C          2.16535       -0.21166        1.12438
C          3.58719       -0.09990        1.10625
C          6.41707        0.14919        1.00331
H          1.65940       -0.23377        2.10298
C          4.35873       -0.00046        2.30332
C          5.73528        0.12197        2.26289
H          3.83623       -0.02140        3.27233
H          6.32141        0.19942        3.18954
H         -2.42372       -4.42735        1.21870
H         -1.51378       -4.84696       -1.48678
P         -1.30256        1.36079        0.05492
C         -0.13028        2.90004        0.28080
C          1.09031        2.82206       -0.66198
H          1.80202        2.04525       -0.34303
H          1.61669        3.79859       -0.61046
H          0.83578        2.63774       -1.71768
C          0.44079        2.90271        1.71292
H          1.22108        3.69074        1.76831
H          0.92972        1.94137        1.95664
H         -0.31088        3.13432        2.48858
C         -0.84744        4.24007        0.01795
H         -1.08741        4.38190       -1.05225
H         -1.77221        4.37413        0.60470
H         -0.15430        5.06003        0.30192
C         -2.32546        1.62002       -1.57733
C         -1.35753        2.00422       -2.71305
H         -0.51984        1.28328       -2.79103
H         -0.95290        3.02780       -2.61404
H         -1.91561        1.96246       -3.67173
C         -2.95001        0.27125       -1.99599
H         -3.51362        0.43633       -2.93861
H         -3.66766       -0.11849       -1.25253
H         -2.16487       -0.48524       -2.20869
C         -3.43857        2.67692       -1.46281
H         -3.06480        3.67695       -1.18223
H         -4.22506        2.38500       -0.74221
H         -3.92962        2.77454       -2.45445
C         -2.51015        1.31557        1.58416
C         -1.74845        0.62195        2.73629
H         -0.86772        1.18840        3.08483
H         -2.43869        0.50815        3.59902
H         -1.40911       -0.38884        2.42987
C         -3.72880        0.42512        1.26872
H         -3.42729       -0.59155        0.95612
H         -4.40024        0.86588        0.50871
H         -4.32189        0.32538        2.20245
C         -3.03048        2.68753        2.04828
H         -2.23502        3.35510        2.42553
H         -3.58888        3.21970        1.25573
H         -3.73642        2.52081        2.88951
C          7.84386        0.27929        0.96759
N          9.01368        0.38556        0.94613

