%chk=000182492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182492

0 1
O 1.341110 1.363036 -0.829337
O 4.315182 2.186399 -0.509589
O 5.933150 0.577266 0.145836
O -4.097088 2.284855 0.441903
O -5.780359 0.136359 -0.325272
O -0.973767 1.999465 2.111002
O -1.199962 3.001294 0.131094
N 0.365727 -2.660563 -0.524882
C 0.575958 -1.184603 -0.375119
C 2.037365 -0.796325 -0.208773
C 1.161761 -3.422707 0.477204
C 3.016228 -1.714692 0.177878
C 2.676590 -3.158807 0.417452
C -0.247053 -0.669021 0.835554
C 2.386536 0.565898 -0.469338
C 4.379184 -1.339797 0.326221
C 0.642202 -3.111739 -1.920962
C -1.693904 -0.448266 0.494075
C 3.715858 0.933699 -0.322920
C 4.687201 -0.023110 0.071094
C -2.277531 0.839535 0.532198
C -2.491389 -1.543012 0.145764
C 5.734230 1.984083 -0.223374
C -3.653420 1.001278 0.270503
C -3.850329 -1.391254 -0.147439
C -4.439083 -0.130783 -0.083165
C -1.474332 2.047331 0.822160
C 1.635136 2.757969 -1.122871
C -5.440346 2.622212 0.005922
C -6.578471 -0.945168 -0.863083
H 0.183199 -0.679027 -1.302563
H 0.956522 -4.505964 0.348214
H 0.770898 -3.145207 1.483878
H 3.135709 -3.768177 -0.390847
H 3.149279 -3.511555 1.357255
H 0.224093 0.261540 1.222304
H -0.177062 -1.385438 1.682734
H 5.135833 -2.055927 0.625492
H -0.081562 -2.627452 -2.597440
H 0.480072 -4.197831 -1.993880
H 1.656706 -2.885414 -2.282545
H -2.036611 -2.537090 0.090022
H 5.995658 2.596799 0.648961
H 6.298368 2.168122 -1.146798
H -4.435945 -2.268434 -0.414951
H 2.156768 2.820416 -2.080795
H 2.225032 3.209699 -0.319562
H 0.619369 3.186622 -1.167911
H -0.442043 2.806302 2.339004
H -5.462863 3.703248 0.188043
H -6.172837 2.087928 0.622174
H -5.565202 2.385927 -1.054917
H -7.547826 -0.452201 -1.010319
H -6.659745 -1.755527 -0.132785
H -6.165792 -1.291993 -1.814602


%chk=000182492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182492

0 1
O 1.355443 1.559760 -0.317997
O 4.378277 2.263307 0.025896
O 6.019149 0.550969 0.317550
O -4.343976 2.152469 0.456665
O -5.901272 -0.061271 -0.177307
O -1.003798 2.141550 2.076337
O -1.528298 2.953239 -0.027814
N 0.324341 -2.528006 -0.619767
C 0.547775 -1.099883 -0.271846
C 2.039390 -0.743337 -0.120471
C 1.140502 -3.437406 0.219102
C 3.035501 -1.740627 0.057523
C 2.663512 -3.220235 0.037818
C -0.265944 -0.701212 1.011938
C 2.405846 0.643152 -0.174787
C 4.410778 -1.387528 0.194794
C 0.412303 -2.808314 -2.068469
C -1.751158 -0.526792 0.734776
C 3.764423 0.971534 -0.045203
C 4.734093 -0.035387 0.136201
C -2.379266 0.754347 0.659482
C -2.554318 -1.662120 0.473211
C 5.835020 1.975078 -0.044313
C -3.759577 0.878982 0.356920
C -3.924666 -1.553332 0.153372
C -4.541275 -0.283624 0.097641
C -1.624697 2.039425 0.824873
C 1.629598 2.856121 -0.977147
C -4.866060 2.731721 -0.799548
C -6.749969 -1.241985 -0.350301
H 0.142636 -0.486810 -1.098795
H 0.869349 -4.481999 -0.022403
H 0.870271 -3.267010 1.278539
H 2.987838 -3.660386 -0.927537
H 3.219581 -3.761703 0.827646
H 0.158808 0.225109 1.423253
H -0.117650 -1.487664 1.775468
H 5.180104 -2.151019 0.338407
H -0.348288 -2.208986 -2.599838
H 0.189867 -3.876604 -2.246640
H 1.405528 -2.581632 -2.525310
H -2.073245 -2.644268 0.489338
H 6.357191 2.605590 0.690041
H 6.185499 2.133756 -1.083735
H -4.504483 -2.462047 -0.035640
H 2.012260 2.688952 -2.001256
H 2.360468 3.447967 -0.401488
H 0.648917 3.353175 -1.005737
H -0.483396 2.990695 2.105300
H -5.320470 3.690229 -0.506563
H -5.626573 2.069006 -1.247980
H -4.029025 2.909246 -1.499944
H -7.762878 -0.844689 -0.511787
H -6.738550 -1.879483 0.554904
H -6.439033 -1.839825 -1.229472


