%chk=000190791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190791

0 1
O -5.619642 -0.964052 0.687274
O -3.901716 2.215416 0.806283
O -2.270488 -3.354467 -0.273876
O -6.293134 0.990173 1.438660
O 6.912581 1.336143 0.153882
O 5.303226 -2.170112 -0.493786
O 6.944119 -1.042935 0.334618
N -0.909435 -1.528280 -0.148261
N 1.379227 1.251685 0.086986
N 5.793694 -1.142749 -0.047628
C -4.302281 1.083051 0.037227
C -3.091148 0.168567 -0.012896
C -0.715468 -0.135049 -0.033370
C -3.302555 -1.182563 -0.105364
C 0.387017 -2.286291 -0.191837
C 1.416833 -1.194615 -0.098435
C -1.775185 0.723366 0.028940
C 0.746348 0.098356 -0.005284
C -2.202460 -2.143742 -0.180173
C -4.732717 1.507333 -1.382064
C -4.684959 -1.749204 -0.107638
C -5.479115 0.395859 0.777027
C 2.777750 -1.247473 -0.092608
C 3.514423 -0.016463 0.006998
C 2.771723 1.199969 0.096491
C -5.934350 2.441528 -1.383325
C 4.947343 0.056734 0.032304
C 3.441002 2.468896 0.205692
C 5.560909 1.312300 0.143851
C 4.805977 2.524043 0.227622
H 0.455888 -2.875994 -1.135416
H 0.437702 -3.012600 0.652599
H -1.642366 1.803972 0.137929
H -4.944259 0.607210 -1.993294
H -3.868887 2.012502 -1.866740
H -5.115193 -1.809969 -1.125746
H -4.744946 -2.743083 0.390233
H 3.318439 -2.202159 -0.172575
H -6.804106 2.009845 -0.868198
H -5.707514 3.397459 -0.894060
H -6.250322 2.673189 -2.408600
H -4.701281 2.726264 1.103880
H 2.824218 3.374006 0.270453
H 5.331264 3.475084 0.311817
H 7.285445 2.263148 0.213907


%chk=000190791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190791

0 1
O -5.612746 -0.889857 0.743978
O -3.965530 2.423254 0.653565
O -2.280461 -3.345400 -0.326132
O -6.091756 1.128777 1.707981
O 7.031296 1.296051 0.135987
O 5.494825 -2.017446 -0.974657
O 6.665197 -1.375683 0.876226
N -0.902787 -1.456594 -0.165348
N 1.405839 1.296311 0.113865
N 5.768165 -1.180995 -0.023935
C -4.303010 1.145271 0.041124
C -3.070554 0.247180 -0.002894
C -0.687817 -0.081628 -0.030515
C -3.281172 -1.128016 -0.123316
C 0.358895 -2.242972 -0.233071
C 1.411458 -1.161963 -0.119743
C -1.754863 0.801041 0.054704
C 0.765960 0.122922 -0.002667
C -2.176907 -2.078858 -0.215843
C -4.833591 1.399579 -1.414005
C -4.678774 -1.687470 -0.119947
C -5.403204 0.466939 0.899246
C 2.795455 -1.237643 -0.125244
C 3.538083 -0.009470 -0.001107
C 2.790779 1.235858 0.118289
C -6.092137 2.286416 -1.466793
C 4.969292 0.064462 0.045009
C 3.498962 2.473407 0.246693
C 5.643946 1.293848 0.162955
C 4.888858 2.505702 0.261311
H 0.400083 -2.809348 -1.181578
H 0.383207 -2.983897 0.587165
H -1.597824 1.871367 0.186361
H -5.019286 0.433906 -1.922022
H -4.002963 1.892972 -1.953098
H -5.129591 -1.726849 -1.129933
H -4.692481 -2.702816 0.304706
H 3.319997 -2.189597 -0.237225
H -6.958564 1.811416 -0.972657
H -5.904218 3.256075 -0.975172
H -6.369617 2.485314 -2.517193
H -4.678799 2.622904 1.323322
H 2.903338 3.386450 0.328108
H 5.420137 3.461522 0.346401
H 7.396480 2.211853 0.220600


