%chk=000190618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190618

0 1
O 1.388802 -3.247398 0.107585
O 1.088713 1.706981 0.177507
O -0.948373 -0.659510 0.632913
O 4.478951 -1.279448 -0.485174
O -0.816736 -2.060796 -2.280977
O -2.466151 -1.255743 2.189660
O -1.876225 0.234581 -1.607076
O -5.253349 3.498716 -1.184543
C 2.174570 -1.126519 1.311295
C 2.861634 0.125178 0.763645
C 1.196439 -1.853386 0.294208
C 2.104835 0.866238 -0.378825
C 0.939015 -0.789635 2.208113
C -0.004637 -1.551345 1.264033
C 4.296250 -0.044552 0.206073
C 4.547377 1.199328 -0.727550
C 3.148850 1.813297 -0.997935
C 1.067712 -1.287741 -1.085160
C 3.149228 -2.071016 1.993702
C 1.469564 -0.055522 -1.398206
C 5.223569 0.771629 -2.032074
C 5.438762 2.202703 0.016104
C 0.367059 -2.197550 -2.053586
C -2.227628 -0.561116 1.230694
C -3.017653 0.439670 0.542361
C -4.068425 1.100543 1.254928
C -2.782938 0.814811 -0.808748
C -4.796147 2.117103 0.648915
C -3.507571 1.850849 -1.428478
C -4.378886 0.715899 2.658512
C -4.496856 2.483576 -0.679627
H 2.928716 0.856098 1.615910
H 0.713520 0.284833 2.286581
H 0.983105 -1.178112 3.231362
H -0.529308 -2.432555 1.668327
H 5.057089 -0.126145 1.011069
H 2.971214 1.990036 -2.070125
H 3.039102 2.813561 -0.530203
H 3.918569 -2.427828 1.283385
H 3.679944 -1.572064 2.813617
H 2.654866 -2.951647 2.419649
H 1.320886 0.375261 -2.390528
H 5.532920 1.636113 -2.628500
H 6.118625 0.167169 -1.829888
H 4.565646 0.156990 -2.654888
H 5.586061 3.115659 -0.573246
H 5.005545 2.505178 0.975722
H 6.434082 1.788277 0.214020
H 1.746914 -3.678553 0.917821
H 0.253721 1.192507 0.342503
H 3.781080 -1.415549 -1.159578
H 0.981972 -2.986179 -2.510204
H -5.592884 2.640560 1.172223
H -3.282961 2.110368 -2.457293
H -4.532169 -0.376349 2.754929
H -3.544240 0.953067 3.337811
H -5.275282 1.207984 3.056530
H -1.451741 -0.634675 -1.244569
H -5.012444 3.723874 -2.122126


%chk=000190618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190618

0 1
O 1.105365 -2.911828 0.739906
O 1.673307 2.106712 0.282225
O -0.859919 0.056850 1.525438
O 4.006794 -1.678777 -0.858393
O -0.612954 -1.461652 -2.496207
O -2.485702 -1.582164 1.852802
O -1.251470 2.139071 0.229612
O -5.726489 3.216792 -1.212317
C 2.391612 -0.765340 1.524868
C 3.197960 0.203158 0.622194
C 1.121048 -1.457059 0.828836
C 2.377017 0.999586 -0.435076
C 1.416484 -0.035248 2.527999
C 0.212461 -0.839441 1.981309
C 4.362583 -0.407094 -0.209157
C 4.771142 0.737168 -1.212057
C 3.439509 1.541553 -1.441094
C 0.769291 -0.969897 -0.556868
C 3.313825 -1.775153 2.233650
C 1.334261 0.139851 -1.117745
C 5.352074 0.177293 -2.528432
C 5.831462 1.643444 -0.528435
C -0.305553 -1.709440 -1.298923
C -2.214131 -0.441446 1.413590
C -3.093819 0.541680 0.759558
C -4.510450 0.269609 0.652842
C -2.584880 1.767005 0.181282
C -5.344592 1.187484 -0.005919
C -3.442968 2.667529 -0.483529
C -5.149220 -0.980090 1.230517
C -4.814824 2.371909 -0.573827
H 3.643409 0.966953 1.291736
H 1.323325 1.040984 2.318772
H 1.636998 -0.191021 3.596752
H -0.227047 -1.613531 2.633842
H 5.218254 -0.686413 0.428371
H 3.090693 1.445115 -2.486548
H 3.591807 2.617337 -1.238361
H 3.800156 -2.446989 1.506311
H 4.099257 -1.237323 2.796581
H 2.763596 -2.383587 2.979974
H 0.975769 0.446786 -2.111601
H 5.629254 1.006487 -3.206644
H 6.255184 -0.430390 -2.337416
H 4.627900 -0.471824 -3.049517
H 6.093759 2.493543 -1.185372
H 5.463392 2.064045 0.425854
H 6.759533 1.078535 -0.321382
H 1.448052 -3.305350 1.580048
H 0.975830 2.504900 -0.304807
H 3.109249 -1.610919 -1.275695
H -0.826116 -2.505242 -0.723481
H -6.417779 1.000618 -0.095163
H -3.009265 3.580289 -0.905863
H -4.742666 -1.894760 0.765269
H -4.945614 -1.082518 2.310788
H -6.240320 -0.954447 1.074159
H -0.748425 1.440179 0.774044
H -5.275104 4.014181 -1.586699


