%chk=000186444.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186444

0 1
O 3.519086 -2.612865 -1.599516
O -0.035908 -1.314980 -0.355226
O -0.615937 -0.902067 1.799780
O -1.267325 2.813221 -1.569184
O -0.213219 1.991217 0.218966
C 2.333507 -0.846923 -0.404198
C 2.452814 0.326722 0.579297
C 3.687838 -1.570116 -0.608742
C 3.286175 1.487262 0.021201
C 1.268533 -1.851318 0.048775
C 3.036726 2.773155 0.823355
C 4.211138 -2.314069 0.611028
C 3.863675 3.942401 0.294897
C -0.871430 -0.842107 0.623206
C -2.135129 -0.361642 -0.026539
C -2.262374 0.921020 -0.584562
C -3.218559 -1.248236 -0.051128
C -3.478878 1.303547 -1.172464
C -4.429113 -0.856297 -0.632157
C -4.558459 0.417073 -1.193996
C -1.142767 1.893972 -0.547567
H 2.002953 -0.440138 -1.395736
H 2.871000 -0.014075 1.545061
H 1.426668 0.692519 0.821523
H 4.444668 -0.852361 -0.998852
H 4.362056 1.232118 0.041355
H 3.033658 1.663928 -1.041775
H 1.321759 -2.799569 -0.521206
H 1.278487 -2.045788 1.134898
H 3.267890 2.602097 1.892621
H 1.954726 3.024233 0.788539
H 5.231571 -2.679246 0.436806
H 3.601250 -3.201111 0.828725
H 4.221470 -1.676331 1.501817
H 3.225710 -2.242382 -2.450485
H 3.668863 4.854271 0.870629
H 4.938422 3.738427 0.359508
H 3.633614 4.160013 -0.753542
H -3.119000 -2.244585 0.384723
H -3.570896 2.299287 -1.617581
H -5.272088 -1.549143 -0.646737
H -5.501034 0.720434 -1.651008
H -0.529642 3.483629 -1.560711


%chk=000186444-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186444

0 1
O 3.660036 -2.263737 -1.947095
O -0.051309 -1.182657 -0.526316
O -0.663438 -1.064482 1.729300
O -1.388825 1.790530 -2.943944
O -0.098265 1.649219 -1.023644
C 2.385938 -0.714370 -0.458460
C 2.466410 0.365024 0.653236
C 3.746405 -1.424284 -0.726080
C 3.265731 1.627580 0.257907
C 1.287732 -1.759427 -0.184008
C 3.246664 2.709710 1.362008
C 4.220013 -2.377867 0.378116
C 4.035753 3.978965 0.975680
C -0.900239 -0.841689 0.517066
C -2.205669 -0.295338 0.006790
C -2.337215 0.636459 -1.065207
C -3.371703 -0.808080 0.625030
C -3.631635 0.985612 -1.530151
C -4.655085 -0.441936 0.166584
C -4.785264 0.445289 -0.925547
C -1.160075 1.365018 -1.623804
H 2.101150 -0.195351 -1.400639
H 2.891023 -0.078269 1.577518
H 1.437620 0.681786 0.901870
H 4.514187 -0.637345 -0.882723
H 4.320675 1.371943 0.025666
H 2.825342 2.050050 -0.668747
H 1.393665 -2.624218 -0.859569
H 1.267928 -2.082863 0.871391
H 3.662305 2.284773 2.298755
H 2.193650 2.977356 1.581832
H 5.203304 -2.798965 0.108640
H 3.515775 -3.218973 0.499960
H 4.316768 -1.852189 1.343854
H 3.389507 -1.687286 -2.707158
H 4.000183 4.738012 1.778849
H 5.099382 3.742921 0.780909
H 3.620777 4.437956 0.058315
H -3.253939 -1.503405 1.461912
H -3.717343 1.696064 -2.356597
H -5.545370 -0.852802 0.654088
H -5.777084 0.726440 -1.294390
H -0.602966 2.320021 -3.247398


