%nprocs=48
%mem=350GB
%chk=3g-ptbu2cy-99-lig.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
P          0.74565       -0.00253        0.76488
C          1.34131       -1.62100       -0.09367
C          1.51548       -1.60116       -1.61933
H          1.83561       -2.60652       -1.97301
H          2.29785       -0.88388       -1.93612
H          0.58010       -1.34559       -2.15038
C          0.32197       -2.70622        0.30880
H          0.15449       -2.71744        1.40565
H          0.71224       -3.70568        0.01853
H         -0.65852       -2.57715       -0.18729
C          2.68382       -1.99796        0.56988
H          2.98335       -3.01834        0.24526
H          3.50404       -1.30966        0.29494
H          2.59804       -2.00093        1.67517
C          1.62000        1.52243       -0.03237
C          1.18789        1.91017       -1.45509
H          1.37324        1.10422       -2.18976
H          0.11549        2.18318       -1.50349
H          1.76257        2.80259       -1.78860
C          3.14283        1.30943        0.00333
H          3.65718        2.26614       -0.23308
H          3.47964        0.56393       -0.74322
H          3.48861        0.98060        1.00448
C          1.28185        2.68506        0.92590
H          0.19279        2.89390        0.96559
H          1.62220        2.47024        1.95845
H          1.78201        3.61571        0.57989
C         -1.06078        0.29637        0.24948
C         -2.01582       -0.23073        1.34328
H         -1.64557        0.07958        2.34220
H         -2.00014       -1.34281        1.34218
C         -3.45543        0.25425        1.12294
H         -4.12422       -0.16310        1.90527
C         -3.96842       -0.11118       -0.27533
H         -4.04665       -1.21916       -0.35681
H         -4.99375        0.28557       -0.43176
C         -3.01991        0.40354       -1.36452
H         -3.37934        0.09871       -2.37039
H         -3.02291        1.51740       -1.35685
H         -3.48635        1.36102        1.24405
C         -1.58167       -0.09481       -1.14689
H         -1.57292       -1.20070       -1.25269
H         -0.92189        0.29878       -1.94317
H         -1.11162        1.40907        0.30934

