%chk=000251115.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251115

0 1
O -1.993772 -1.059122 2.221793
O -4.377192 -2.237904 1.030097
O -5.511678 -0.854805 -1.229949
O -4.365838 1.628350 -2.003776
O -2.081633 2.440802 -0.890757
O -1.031090 2.044764 2.327408
O 6.816295 0.293512 -0.312829
C -2.081644 0.676122 0.696255
C -2.669040 -0.520870 1.168163
C -3.818559 -1.058648 0.543910
C -2.657925 1.307991 -0.408670
C -4.427910 -0.369839 -0.532253
C -3.838427 0.805499 -1.017244
C -0.897539 1.282503 1.396163
C 0.418391 0.873937 0.849402
C 2.905725 1.031128 0.893187
C 1.558463 1.368275 1.358641
C 3.974410 1.906388 1.198540
C 3.169110 -0.136335 0.160911
C 5.498301 0.445848 0.038533
C 5.264940 1.628757 0.775881
C 4.462603 -0.443515 -0.271823
C -2.606577 -2.138054 2.980289
C -4.121436 -3.378108 0.156856
C -6.676759 -1.198991 -0.423850
C -4.498827 0.982818 -3.301388
C 7.193498 -0.893082 -1.082560
C 8.668242 -0.722113 -1.278437
C 9.417292 -1.598474 -1.941029
H 0.392572 0.170065 0.020384
H 1.511710 2.091423 2.187975
H 3.779174 2.815978 1.770178
H 2.354344 -0.824480 -0.072293
H -2.640495 2.819927 -1.646756
H 6.097548 2.293257 0.996757
H 4.639495 -1.353728 -0.833035
H -1.988825 -2.142577 3.886891
H -2.517497 -3.069459 2.415962
H -3.655022 -1.911107 3.203016
H -4.628600 -4.191694 0.684131
H -3.046629 -3.556204 0.077655
H -4.564481 -3.199018 -0.828288
H -7.317320 -1.701122 -1.155930
H -7.129824 -0.271353 -0.060776
H -6.404037 -1.861549 0.406388
H -4.923676 1.785954 -3.912546
H -5.192534 0.136837 -3.219631
H -3.521337 0.664728 -3.668084
H 6.633317 -0.886110 -2.035529
H 6.943739 -1.791051 -0.488207
H 9.075324 0.189399 -0.827232
H 10.482603 -1.472586 -2.081153
H 9.038826 -2.503264 -2.394041


%chk=000251115-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251115

0 1
O -2.908772 -1.493416 2.491039
O -5.342814 -1.819012 1.137046
O -5.674711 -0.663019 -1.478663
O -3.513161 0.924270 -2.559940
O -1.241912 1.228226 -1.236892
O -0.900145 0.541656 2.744930
O 7.126604 0.129549 -0.191122
C -2.029770 -0.054986 0.699484
C -3.092401 -0.822486 1.267841
C -4.303742 -1.048510 0.562778
C -2.224509 0.450542 -0.612166
C -4.503494 -0.475942 -0.726004
C -3.443717 0.249764 -1.314991
C -0.792914 0.246250 1.508062
C 0.518887 0.158315 0.829830
C 3.053797 0.282575 1.020283
C 1.684366 0.349385 1.529770
C 4.140580 0.470853 1.928984
C 3.373004 0.040016 -0.346686
C 5.765888 0.166849 0.135444
C 5.474797 0.414325 1.501683
C 4.705688 -0.018161 -0.793456
C -3.513000 -0.823823 3.669942
C -5.048098 -3.272607 1.198790
C -6.945950 -0.265002 -0.823001
C -3.864492 0.098140 -3.741328
C 7.491459 -0.161934 -1.598585
C 8.992243 -0.247995 -1.661342
C 9.751542 0.432785 -2.553475
H 0.511651 -0.062573 -0.241306
H 1.568705 0.576409 2.600350
H 3.921621 0.662541 2.986172
H 2.565899 -0.099551 -1.073794
H -1.644093 1.546734 -2.095589
H 6.306634 0.557357 2.197634
H 4.908325 -0.199988 -1.852939
H -3.356253 -1.518993 4.509050
H -4.594047 -0.660178 3.504294
H -2.977300 0.123264 3.850825
H -5.926281 -3.729847 1.680261
H -4.140566 -3.446583 1.801987
H -4.920644 -3.678178 0.177342
H -7.731498 -0.510418 -1.553646
H -6.939083 0.822749 -0.623548
H -7.086443 -0.829493 0.112582
H -3.849706 0.793365 -4.594435
H -4.866641 -0.337432 -3.605993
H -3.114683 -0.703138 -3.885676
H 7.104936 0.634943 -2.264645
H 7.029128 -1.129846 -1.889036
H 9.456236 -0.931640 -0.938090
H 10.839282 0.310673 -2.588954
H 9.309368 1.132317 -3.273799


