%chk=000272089.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272089

0 1
O 1.934725 2.430287 0.080467
O 0.250425 0.922113 -0.351551
O 2.967752 -1.292324 0.693981
O 4.949949 0.978382 -0.602606
O 5.173026 -0.872860 0.721034
O -0.565792 -1.829656 0.143467
O -0.936559 -0.956506 2.205258
O -7.397284 -0.239468 -0.720397
O -6.376208 0.924082 -2.232313
N -6.391660 0.203358 -1.248813
C 2.571381 1.271969 -0.509555
C 1.475658 0.181846 -0.515422
C 3.839322 1.026771 0.319026
C 3.940293 -0.304771 1.111453
C 1.612023 -0.815763 0.653344
C 0.516174 2.206158 0.285215
C 5.568600 -0.340321 -0.585668
C 0.818217 -2.118728 0.471775
C -0.256702 3.255427 -0.483663
C 0.239220 2.124796 1.772589
C 7.066368 -0.154081 -0.554151
C 5.004787 -1.200888 -1.694613
C -1.332480 -1.182551 1.087264
C -2.650125 -0.843980 0.473590
C -3.831297 -1.309040 1.066714
C -2.675984 -0.038940 -0.673272
C -5.061198 -0.967479 0.501425
C -3.903132 0.307618 -1.240968
C -5.083010 -0.162240 -0.646831
H 2.862490 1.577872 -1.543496
H 1.364350 -0.326260 -1.495314
H 4.040709 1.917749 0.962786
H 3.938540 -0.250166 2.213414
H 1.340048 -0.318944 1.619865
H 0.859220 -2.742475 1.383216
H 1.146041 -2.702790 -0.408922
H 0.038417 3.265546 -1.542603
H -1.337223 3.075686 -0.441612
H -0.058069 4.259752 -0.085121
H -0.784516 2.427525 2.023315
H 0.360880 1.096467 2.155747
H 0.924434 2.772946 2.335470
H 7.558345 -1.018091 -0.084700
H 7.483920 -0.022833 -1.559700
H 7.340433 0.735611 0.033333
H 4.949371 -0.648096 -2.639836
H 5.611811 -2.099928 -1.857906
H 3.989891 -1.548347 -1.439605
H -3.792183 -1.928954 1.965632
H -1.730774 0.314377 -1.111514
H -6.001389 -1.318193 0.942596
H -3.952635 0.934137 -2.138825


%chk=000272089-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272089

0 1
O 1.980692 2.154419 0.896308
O 0.214808 1.044678 -0.226241
O 3.007740 -1.421167 0.334225
O 4.761334 0.652839 -0.977697
O 5.298113 -0.974331 0.671128
O -0.622158 -1.754283 -0.316986
O -1.084009 -1.381128 1.937463
O -7.595824 0.496988 -0.033773
O -6.971455 0.321534 -2.220598
N -6.729784 0.238587 -0.955425
C 2.569208 1.389365 -0.228460
C 1.478634 0.321811 -0.505483
C 3.941958 0.891923 0.229801
C 3.978846 -0.484015 0.937758
C 1.625575 -0.898289 0.433209
C 0.532499 2.261272 0.606798
C 5.749691 -0.415896 -0.654229
C 0.772388 -2.116582 0.042409
C 0.223167 3.503578 -0.237770
C -0.222807 2.200529 1.931751
C 7.140048 0.180554 -0.436526
C 5.663124 -1.489122 -1.736915
C -1.447317 -1.369609 0.735464
C -2.805567 -0.965541 0.260764
C -3.790105 -0.670128 1.239133
C -3.115299 -0.861104 -1.119572
C -5.081914 -0.275061 0.848082
C -4.403735 -0.466467 -1.525164
C -5.366568 -0.180293 -0.532312
H 2.704917 2.040465 -1.113943
H 1.461543 0.005616 -1.561887
H 4.408342 1.661552 0.876827
H 3.833050 -0.447730 2.032375
H 1.405148 -0.583973 1.473272
H 0.760877 -2.849552 0.866638
H 1.175437 -2.574496 -0.874076
H 0.862405 3.537974 -1.136250
H -0.829832 3.478514 -0.566247
H 0.391210 4.419867 0.354135
H -1.307488 2.292769 1.751510
H -0.033222 1.243505 2.443825
H 0.097790 3.030357 2.585073
H 7.832567 -0.599492 -0.076229
H 7.527961 0.591643 -1.383929
H 7.098714 0.987814 0.313484
H 5.902808 -1.051668 -2.721745
H 6.379931 -2.300449 -1.523983
H 4.644465 -1.906713 -1.759352
H -3.521333 -0.755175 2.296545
H -2.340465 -1.082849 -1.856818
H -5.862725 -0.042695 1.576436
H -4.674779 -0.374545 -2.579802


