%chk=000222865.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222865

0 1
O -5.011258 1.162546 0.699952
O 5.665991 -0.000418 0.719902
C 0.172460 0.415449 0.312488
C -0.636750 -0.798028 -0.239064
C 1.634453 0.402179 -0.245173
C -2.048368 -0.712327 0.355121
C -2.762201 0.588389 -0.123205
C 2.284776 -0.955443 0.173921
C -0.543857 1.756903 0.036366
C 0.047462 -2.124947 0.132032
C -2.016572 1.781049 0.483881
C 1.495340 -2.159082 -0.368497
C -3.071820 -1.830602 0.075872
C 2.451177 1.533656 0.437052
C -4.199354 0.334423 0.378590
C 1.642944 0.597035 -1.768390
C 3.757464 -1.039992 -0.255732
C -4.432134 -1.174406 0.391313
C -2.884235 0.731669 -1.647150
C 3.937502 1.508322 0.078135
C 4.560601 0.139279 0.245064
H 0.237053 0.296374 1.422960
H -0.689513 -0.726099 -1.351363
H -1.935532 -0.652149 1.470539
H 2.258503 -1.007041 1.293272
H -0.490848 1.990926 -1.045876
H -0.002807 2.575506 0.548818
H -0.517707 -2.971705 -0.300882
H 0.022833 -2.276751 1.228132
H -2.087498 1.758812 1.587606
H -2.492369 2.732664 0.178301
H 1.979020 -3.102342 -0.050733
H 1.517210 -2.168167 -1.474658
H -2.891565 -2.717337 0.703034
H -3.024472 -2.172197 -0.971461
H 2.339257 1.460734 1.536967
H 2.031679 2.520386 0.159635
H 1.232029 1.573395 -2.048468
H 2.655222 0.538982 -2.180327
H 1.040772 -0.168009 -2.272652
H 3.843243 -1.089599 -1.360249
H 4.212274 -1.982235 0.114416
H -4.824338 -1.489286 1.374867
H -5.211517 -1.450470 -0.339305
H -3.481717 1.613880 -1.909525
H -1.899395 0.854551 -2.114578
H -3.355307 -0.142147 -2.109748
H 4.491584 2.245160 0.697128
H 4.089385 1.837512 -0.971031


%chk=000222865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222865

0 1
O -5.047429 1.184963 0.827078
O 5.670339 -0.033843 1.050472
C 0.172399 0.426816 0.214986
C -0.645918 -0.807499 -0.305870
C 1.667814 0.414928 -0.295604
C -2.067080 -0.723122 0.285610
C -2.810405 0.586469 -0.110783
C 2.301037 -0.953708 0.151361
C -0.567000 1.774834 -0.044300
C 0.050911 -2.137445 0.068048
C -2.038169 1.793625 0.458068
C 1.523962 -2.173183 -0.391623
C -3.104528 -1.846810 0.018425
C 2.472465 1.548542 0.413921
C -4.214181 0.319452 0.467170
C 1.737357 0.613984 -1.835052
C 3.817103 -1.051345 -0.176134
C -4.431917 -1.211452 0.524818
C -3.037271 0.744536 -1.649087
C 4.001435 1.503134 0.140505
C 4.602761 0.123844 0.398556
H 0.230251 0.302115 1.323005
H -0.716699 -0.759122 -1.412946
H -1.939822 -0.677864 1.393756
H 2.209394 -0.982958 1.261419
H -0.552218 2.008836 -1.126277
H -0.022274 2.596952 0.456278
H -0.504358 -2.989083 -0.370855
H 0.011885 -2.266055 1.171306
H -2.053786 1.744771 1.565673
H -2.526203 2.744831 0.174020
H 2.007472 -3.105455 -0.038082
H 1.577409 -2.192874 -1.499249
H -2.863269 -2.782875 0.550540
H -3.162143 -2.086944 -1.059913
H 2.303125 1.473703 1.507965
H 2.096842 2.539907 0.099685
H 1.390655 1.625064 -2.114643
H 2.767869 0.508781 -2.217342
H 1.114085 -0.115677 -2.380022
H 3.958726 -1.066769 -1.277169
H 4.244301 -1.989904 0.220730
H -4.636337 -1.483423 1.578858
H -5.330694 -1.496577 -0.051097
H -3.642673 1.649760 -1.835448
H -2.082396 0.853025 -2.190100
H -3.574117 -0.115961 -2.087412
H 4.539171 2.245241 0.756263
H 4.191218 1.760839 -0.922209


