%chk=000222146.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222146

0 1
O 3.186871 -1.179923 -0.559080
O 0.197265 2.154721 0.171747
O -3.923908 -1.011725 -1.165258
O 3.853026 0.867411 0.149162
O 0.849544 1.075340 -1.706704
O -4.785645 -0.832993 1.607662
O 2.402503 -1.118857 2.872678
N 1.536725 0.739460 1.848893
C 1.504968 0.170989 0.488949
C 0.765339 -1.184710 0.404832
C -0.712720 -1.085482 0.650986
C -1.643169 -1.137378 -0.409354
C 2.990761 0.034110 0.023910
C 0.837615 1.155628 -0.503307
C -1.168271 -0.980252 1.975761
C -3.015628 -1.029567 -0.104681
C -1.231823 -1.322087 -1.829976
C -3.454604 -0.871530 1.225315
C -2.524081 -0.860343 2.272737
C 2.010641 0.029500 2.966573
C 4.531343 -1.490326 -1.065464
C -0.500900 3.182215 -0.614905
C 1.981519 0.814738 4.245667
C 4.760760 -0.770913 -2.375830
C 0.503812 4.157465 -1.184310
C -4.686843 -2.246495 -1.274673
C -5.595346 0.175437 0.944261
H 0.981984 -1.648553 -0.585406
H 1.235715 -1.887054 1.140634
H 1.201632 1.702279 1.942485
H -0.445630 -0.993528 2.793161
H -0.567818 -0.512153 -2.177671
H -2.101194 -1.323408 -2.508379
H -0.697585 -2.270088 -1.978078
H -2.875822 -0.767696 3.298128
H 4.453696 -2.588163 -1.170573
H 5.266804 -1.218516 -0.287832
H -1.152062 3.618751 0.164515
H -1.099693 2.673899 -1.392080
H 0.982848 1.198221 4.491542
H 2.674721 1.668319 4.219805
H 2.299498 0.172785 5.084913
H 5.674476 -1.118723 -2.871590
H 3.923374 -0.920527 -3.071174
H 4.858920 0.315083 -2.223879
H 0.008520 5.020011 -1.646935
H 1.186609 4.538457 -0.413426
H 1.127618 3.683943 -1.958919
H -5.243118 -2.429363 -0.348882
H -5.356283 -2.033356 -2.113890
H -4.012726 -3.076219 -1.502622
H -5.490150 0.115358 -0.145701
H -6.606529 -0.091912 1.268524
H -5.303761 1.161020 1.316242


%chk=000222146-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222146

0 1
O 3.229566 -1.144994 -0.617138
O 0.296792 2.232504 0.186033
O -4.075839 -1.238192 -1.184702
O 3.829722 0.881953 0.361310
O 0.864409 0.994866 -1.703660
O -4.954013 -0.844373 1.526359
O 2.814873 -0.984130 2.742406
N 1.425701 0.661379 1.891063
C 1.472046 0.120283 0.526400
C 0.703060 -1.247661 0.380120
C -0.796438 -1.153448 0.634475
C -1.742312 -1.252711 -0.435664
C 2.982344 -0.002222 0.110995
C 0.862313 1.142551 -0.463041
C -1.266886 -1.011937 1.965505
C -3.127688 -1.150183 -0.128856
C -1.322117 -1.520046 -1.872353
C -3.577740 -0.934067 1.204218
C -2.641158 -0.892775 2.254666
C 2.135616 0.076434 2.920643
C 4.634722 -1.326075 -1.108984
C -0.316102 3.292529 -0.683865
C 2.065453 0.790904 4.263538
C 4.838285 -0.588355 -2.434209
C 0.749292 4.293451 -1.134027
C -4.904796 -2.465312 -1.146982
C -5.662024 0.309388 0.927059
H 0.917259 -1.627022 -0.628992
H 1.185311 -1.933036 1.099077
H 0.922990 1.541616 2.019326
H -0.543317 -1.001157 2.786376
H -0.600574 -0.768296 -2.235569
H -2.203337 -1.507171 -2.531593
H -0.834935 -2.510186 -1.963239
H -3.007545 -0.771803 3.278811
H 4.724672 -2.418246 -1.218445
H 5.322491 -0.961948 -0.326408
H -1.076838 3.748689 -0.031200
H -0.797459 2.791763 -1.541328
H 1.270001 1.554576 4.309691
H 3.036429 1.280057 4.459226
H 1.903466 0.048108 5.061941
H 5.848309 -0.807769 -2.827577
H 4.095448 -0.911647 -3.183226
H 4.751165 0.501680 -2.293617
H 0.271631 5.102225 -1.717450
H 1.260641 4.746804 -0.267892
H 1.500908 3.804501 -1.775560
H -5.465551 -2.528726 -0.196852
H -5.597586 -2.380527 -1.998617
H -4.267135 -3.361798 -1.268156
H -5.579216 0.294442 -0.174256
H -6.712442 0.201985 1.238672
H -5.248068 1.256428 1.324049


