%nprocs=48
%mem=350GB
%chk=3m-cyjohnphos-6cne12-etrxt.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.83936        0.42783       -1.08616
O          0.58444       -0.74044       -2.67878
H          1.38504       -1.30259       -2.63180
H          2.66383        3.15964       -1.75398
H          6.12869        3.18510       -1.85473
H          6.12861        3.59025       -0.10754
C          5.48964        3.26591       -0.95227
C          3.10932        2.44364       -2.47233
H          2.28795        1.97518       -3.05218
H          3.74246        3.02094       -3.17456
H          4.73043        4.05195       -1.12096
H          5.42618        1.04186       -3.30939
C          3.91645        1.34848       -1.76212
C          4.83989        1.92487       -0.61364
C          4.62589        0.47426       -2.79301
H          3.90189        0.13191       -3.55965
O          1.50800        1.73648        0.46640
O          3.92377        2.11892        0.47059
H          1.60916        2.63319        0.08637
H          5.46966       -0.08089        0.01905
B          2.91900        1.08871        0.41831
C          5.91500        0.91285       -0.18172
O          3.02722        0.50067       -0.98855
H          5.07384       -0.41775       -2.31851
H          6.71354        0.79936       -0.94139
H          6.37544        1.27272        0.75879
P         -1.33243        0.09498       -0.63315
H         -1.98926        2.19184       -5.04240
C         -2.50147        1.94011       -4.10172
H         -0.75681        0.96063       -3.25075
C         -1.80761        1.25216       -3.09779
C         -3.83697        2.31168       -3.89507
H         -4.38937        2.86596       -4.66902
C         -2.43578        0.90478       -1.88008
C         -4.47501        1.96304       -2.69792
C         -3.80661        1.24173       -1.68429
H         -5.53025        2.23144       -2.53652
C         -4.59105        0.88610       -0.46586
C         -5.07364        1.90391        0.38500
H         -4.85903        2.95503        0.13933
C         -5.78544        1.58516        1.55061
H         -5.83726       -1.82725        1.23999
H         -4.57649       -1.25405       -0.83767
C         -5.61278       -0.77465        1.00987
C         -4.89588       -0.45597       -0.15309
C         -6.04608        0.24364        1.87367
H         -6.59914       -0.00725        2.79124
H         -6.13556        2.39081        2.21367
H         -1.90042        3.96592        2.44996
H         -2.33777        2.74179        0.29689
H         -0.63671        2.58243        0.80835
C         -2.01464        2.86146        2.45630
C         -1.67601        2.30015        1.06950
H         -3.08498        2.65487        2.68328
C         -1.13357        2.22974        3.54042
H         -0.06999        2.49450        3.34733
H         -1.38965        2.64104        4.53928
C         -1.78330        0.76473        1.04700
H         -2.84493        0.47847        1.20269
C         -1.27681        0.70443        3.53437
C         -0.94138        0.10919        2.16002
H          0.13686        0.25784        1.94851
H         -2.32105        0.43334        3.81072
H         -0.61576        0.24442        4.29831
H         -1.11936       -0.98438        2.18157
H         -0.08221       -4.65609        0.34485
H         -0.15920       -2.21996        0.85775
H          0.26390       -2.46114       -0.84807
C         -0.95249       -4.06273       -0.00489
C         -0.55560       -2.58442       -0.10928
H         -1.73763       -4.17862        0.77635
C         -1.47804       -4.59683       -1.34216
H         -0.65022       -4.58861       -2.08610
H         -1.80027       -5.65447       -1.24165
C         -1.74471       -1.73226       -0.59723
H         -2.56947       -1.80858        0.14853
C         -2.62957       -3.73209       -1.87049
C         -2.23620       -2.25129       -1.96111
H         -1.41008       -2.10637       -2.68946
H         -3.50697       -3.83798       -1.19121
H         -2.96284       -4.09224       -2.86635
H         -3.08948       -1.64804       -2.33318
C          2.86990       -0.07024        1.53757
C          2.80965       -1.41991        1.19837
C          2.74802        0.27790        2.91985
C          2.53671       -0.67967        3.89878
C          2.43091       -2.06094        3.55222
C          2.58634       -2.43847        2.16761
C          2.47578       -3.81705        1.81574
C          2.21408       -4.78544        2.76781
C          2.05521       -4.41116        4.14171
C          2.16862       -3.06840        4.51786
H          2.80766        1.34044        3.20505
H          2.43539       -0.39076        4.95716
H          2.90824       -1.71315        0.14033
H          2.04812       -2.78566        5.57436
H          2.59738       -4.10119        0.75874
H          2.12499       -5.84467        2.48792
C          1.77707       -5.41584        5.12547
N          1.54536       -6.24437        5.92562

