%chk=000247217.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247217

0 1
O 1.837046 -1.004867 -1.050410
O 1.938859 0.232695 0.918638
O -1.956960 -0.755738 -1.015407
O -1.878967 0.266074 1.057439
O 4.971854 1.502868 -1.096240
O -5.198968 -1.273499 -0.573762
O 5.449257 1.083810 0.971726
O -5.116904 -0.342250 1.375935
N 4.889412 0.837715 -0.079925
N -4.798011 -0.431820 0.206421
C 0.046889 0.762704 -0.553247
C -0.071798 -1.278410 0.462274
C 1.073820 -0.329410 -0.061395
C -1.102804 -0.191138 -0.035531
C 0.167890 2.070251 0.203966
C 0.062731 0.956842 -2.056698
C -0.075524 -1.457803 1.967179
C -0.179759 -2.591766 -0.285699
C 3.094748 -0.388732 -1.374283
C 3.147157 -0.511920 1.139372
C -3.007379 0.089156 -1.505997
C -2.931844 1.192408 0.754424
C 4.025995 -0.447149 -0.134812
C -3.862155 0.667720 -0.359331
C 5.002475 -1.615104 -0.195708
C -4.784851 1.773446 -0.867736
H -0.521748 2.832032 -0.169608
H 1.188016 2.473537 0.125059
H -0.023282 1.926957 1.279149
H 0.115813 -0.010555 -2.580844
H 0.926658 1.552034 -2.375845
H -0.841333 1.471298 -2.405681
H 0.602470 -2.254034 2.287978
H -1.086224 -1.711570 2.322183
H 0.216703 -0.532187 2.485370
H -1.115099 -3.110062 -0.034371
H 0.659492 -3.256268 -0.055328
H -0.184754 -2.436187 -1.375302
H 2.928096 0.648650 -1.724626
H 3.454467 -1.014581 -2.211249
H 2.903874 -1.557377 1.400739
H 3.599382 0.008136 2.008606
H -3.580768 -0.612562 -2.150474
H -2.564111 0.900563 -2.115500
H -2.492129 2.165540 0.471804
H -3.449543 1.272538 1.735800
H 5.638670 -1.671048 0.700351
H 4.460917 -2.570403 -0.273120
H 5.670714 -1.560255 -1.066641
H -4.217146 2.610047 -1.296032
H -5.465946 1.413701 -1.653866
H -5.410700 2.190771 -0.064345


%chk=000247217-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247217

0 1
O 2.034704 -0.973532 -1.111561
O 1.815521 0.318924 0.879342
O -2.133285 -0.768591 -1.059392
O -1.731737 0.316076 1.040360
O 5.349226 1.510969 -0.760640
O -5.264289 -1.263801 -0.205272
O 5.417144 1.124301 1.482764
O -4.840452 -0.330776 1.824364
N 5.001009 0.863404 0.296070
N -4.707518 -0.387604 0.549586
C 0.030990 0.682611 -0.828620
C -0.065275 -1.338375 0.240045
C 1.078437 -0.338560 -0.202497
C -1.115267 -0.229190 -0.165767
C 0.163443 2.129599 -0.320296
C 0.040722 0.633151 -2.370490
C -0.081610 -1.715432 1.732784
C -0.156789 -2.606815 -0.634135
C 3.285084 -0.200134 -1.232169
C 3.025835 -0.422093 1.258337
C -3.198965 0.177734 -1.406307
C -2.810678 1.285446 0.812660
C 4.064128 -0.367486 0.103953
C -3.886176 0.754416 -0.153680
C 4.984047 -1.606173 0.114042
C -4.920871 1.842017 -0.514374
H -0.579620 2.788046 -0.809321
H 1.165659 2.525117 -0.562877
H 0.041396 2.187553 0.772641
H -0.088923 -0.388312 -2.759231
H 0.998554 1.027196 -2.755758
H -0.765271 1.266611 -2.783611
H 0.676308 -2.494894 1.936775
H -1.071014 -2.123958 1.999942
H 0.110918 -0.844650 2.377808
H -1.090997 -3.146191 -0.402409
H 0.702192 -3.265254 -0.417605
H -0.151818 -2.385609 -1.712000
H 3.084098 0.866175 -1.435511
H 3.827208 -0.640374 -2.081265
H 2.789156 -1.478973 1.479351
H 3.416330 0.070698 2.161040
H -3.910021 -0.397034 -2.017222
H -2.801173 1.030617 -1.994313
H -2.415424 2.229992 0.388988
H -3.236409 1.474692 1.808937
H 5.432450 -1.761507 1.110524
H 4.377703 -2.490499 -0.148595
H 5.794145 -1.505429 -0.629120
H -4.422392 2.675875 -1.039193
H -5.703324 1.432463 -1.176449
H -5.402406 2.242358 0.394765


