%nprocs=48
%mem=350GB
%chk=3e-pcy3-99-lig.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
P         -0.12489        0.05817        1.05663
C         -1.27725       -1.30902        0.44625
C         -1.33232       -1.60027       -1.06173
H         -0.33498       -1.95854       -1.40019
H         -1.54438       -0.67280       -1.63402
C         -2.37882       -2.67711       -1.38956
H         -2.38627       -2.88563       -2.48054
C         -2.12273       -3.96544       -0.59733
H         -1.15644       -4.40886       -0.92936
H         -2.90477       -4.72175       -0.81975
C         -2.05567       -3.68861        0.90999
H         -1.82530       -4.62118        1.46735
H         -3.05625       -3.35203        1.26401
H         -3.39157       -2.28765       -1.13893
C         -1.02007       -2.60407        1.24123
H         -0.00364       -2.99016        0.99741
H         -1.01490       -2.38403        2.32954
H         -2.28110       -0.93871        0.75987
C         -0.65940        1.53487        0.01009
C         -2.16012        1.82962        0.19400
H         -2.77115        0.97030       -0.15165
C         -2.59171        3.09861       -0.55619
H         -2.48466        2.92499       -1.65091
H         -3.66966        3.29692       -0.37665
C         -1.74640        4.31355       -0.15643
H         -2.05224        5.20881       -0.73787
H         -1.93727        4.55446        0.91378
C         -0.25181        4.02994       -0.34673
H         -0.03918        3.89509       -1.43147
H          0.35602        4.89822       -0.01507
H         -2.37432        1.94892        1.28090
H         -0.47902        1.32168       -1.06738
C          0.17728        2.76659        0.41169
H          1.25786        2.57257        0.24736
H          0.05955        2.93155        1.50653
C          1.53916       -0.45039        0.29163
C          2.69516       -0.04530        1.22988
H          2.74762        1.06602        1.28404
H          2.47791       -0.38839        2.26271
C          4.04393       -0.59491        0.74574
H          4.85981       -0.26056        1.42105
C          4.33767       -0.17965       -0.70123
H          4.47050        0.92534       -0.74337
C          3.19026       -0.58047       -1.63647
H          3.39581       -0.23950       -2.67349
H          3.12426       -1.69139       -1.68030
H          5.29555       -0.62189       -1.04771
H          4.02328       -1.70680        0.80797
C          1.84449       -0.01701       -1.15319
H          1.88576        1.09314       -1.20427
H          1.03278       -0.32822       -1.84004
H          1.48938       -1.56483        0.30337

