%chk=000186547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186547

0 1
O -3.554420 -1.657697 1.425258
O -5.455395 -0.642393 -0.408352
C -3.323611 -1.592371 0.022339
C -4.063032 -0.420504 -0.668182
C -1.815365 -1.455286 -0.253350
C -1.280228 -0.056295 -0.112952
C -3.606966 0.932139 -0.106798
C -2.108535 1.037115 -0.049509
C 0.164851 0.120423 -0.058897
C 0.695063 1.446098 0.073502
C -1.561158 2.364604 0.092208
C -0.218198 2.562891 0.152017
C 1.061374 -0.956017 -0.133574
C 2.081167 1.648585 0.124940
C 2.450025 -0.758407 -0.082980
C 2.971681 0.567961 0.048165
C 3.376819 -1.864725 -0.159572
C 4.403748 0.752855 0.098254
C 4.721575 -1.649986 -0.108664
C 5.244891 -0.316598 0.022459
H -3.732144 -2.572036 -0.321148
H -3.905304 -0.467641 -1.770421
H -1.582474 -1.834107 -1.270513
H -1.286074 -2.134186 0.454457
H -4.032710 1.072615 0.911859
H -4.029803 1.756604 -0.714958
H -2.254250 3.203213 0.150843
H 0.202237 3.562162 0.259306
H 0.684255 -1.974390 -0.230460
H 2.472938 2.660505 0.226155
H -3.309016 -0.816369 1.864544
H -5.996359 0.073010 -0.793238
H 2.968332 -2.869455 -0.257795
H 4.785728 1.767741 0.198169
H 5.428915 -2.476039 -0.165045
H 6.325843 -0.190317 0.059333


%chk=000186547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186547

0 1
O -3.560496 -1.489240 1.548808
O -5.542739 -0.682826 -0.520338
C -3.359628 -1.565539 0.091769
C -4.102712 -0.451988 -0.669200
C -1.858361 -1.486145 -0.256613
C -1.292769 -0.070496 -0.114609
C -3.662246 0.918937 -0.128032
C -2.142104 1.045140 -0.044714
C 0.149890 0.118263 -0.055157
C 0.693364 1.465653 0.101301
C -1.586319 2.368038 0.107614
C -0.219118 2.576503 0.185573
C 1.063358 -0.961755 -0.155520
C 2.094221 1.658948 0.160485
C 2.467971 -0.770682 -0.099436
C 3.001569 0.575968 0.066390
C 3.391804 -1.872066 -0.200303
C 4.429706 0.757962 0.125623
C 4.765941 -1.659959 -0.139336
C 5.291138 -0.330279 0.025778
H -3.786630 -2.543409 -0.185007
H -3.815538 -0.531883 -1.742820
H -1.690741 -1.855694 -1.289153
H -1.325287 -2.182914 0.416669
H -4.123778 1.058822 0.871061
H -4.059348 1.731197 -0.768943
H -2.276613 3.218977 0.161236
H 0.186789 3.587940 0.304170
H 0.690728 -1.983339 -0.285570
H 2.485106 2.677495 0.280332
H -3.001245 -0.751386 1.906307
H -6.034918 0.054703 -0.962885
H 2.991951 -2.885629 -0.324809
H 4.827120 1.772368 0.251005
H 5.458630 -2.505176 -0.216222
H 6.375703 -0.182807 0.071945


