%chk=000253443.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253443

0 1
O -0.062980 -0.995510 -0.244692
O 4.146748 1.037368 0.117670
O -1.763514 2.357322 1.426307
N 2.072153 -0.057178 -0.107316
N 2.313603 2.229815 0.770997
C 0.100410 1.228121 0.564416
C -2.287802 0.447701 0.126398
C -1.347166 1.423701 0.769414
C 0.712997 0.051737 0.063332
C 0.975927 2.287366 0.917962
C -2.444116 0.438559 -1.265773
C -3.036395 -0.421110 0.929923
C 0.571836 -2.230512 -0.776253
C 2.815198 1.043152 0.251734
C -3.347418 -0.451137 -1.854238
C -3.932903 -1.313840 0.334393
C 4.777211 -0.194911 -0.427357
C -4.088530 -1.328803 -1.055424
C -0.623600 -3.140286 -0.943170
C 6.241763 0.177182 -0.425264
H 0.560758 3.222647 1.337369
H -1.864765 1.121825 -1.885478
H -2.922365 -0.397404 2.013695
H 1.068700 -1.963490 -1.723461
H 1.308879 -2.580742 -0.035728
H -3.477334 -0.456415 -2.934902
H -4.515978 -1.991273 0.955833
H 4.526317 -1.029471 0.248650
H 4.361088 -0.370392 -1.433464
H -4.793542 -2.018958 -1.516032
H -0.439997 -3.915621 -1.695592
H -0.904688 -3.633471 -0.003837
H -1.510937 -2.564431 -1.265153
H 6.861946 -0.644374 -0.803892
H 6.435197 1.063223 -1.048217
H 6.593499 0.428911 0.586550


%chk=000253443-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253443

0 1
O 0.133512 -1.354501 -0.010246
O 4.094843 1.191606 -0.036621
O -1.702890 1.495182 2.260641
N 2.124789 -0.099647 -0.061996
N 2.196240 2.169531 0.828781
C 0.071196 0.927244 0.770547
C -2.424516 0.354942 0.267599
C -1.374395 0.934680 1.165940
C 0.794748 -0.170935 0.210557
C 0.865885 2.062357 1.086952
C -2.233580 0.219812 -1.132308
C -3.676834 0.001112 0.837046
C 0.914286 -2.508578 -0.553777
C 2.757504 1.069617 0.243137
C -3.277873 -0.262108 -1.949040
C -4.713184 -0.498510 0.023983
C 4.785484 0.021278 -0.655405
C -4.516733 -0.629864 -1.372410
C -0.074955 -3.661590 -0.684131
C 6.242057 0.435974 -0.832579
H 0.390791 2.922132 1.570127
H -1.277968 0.509730 -1.582228
H -3.813481 0.132221 1.915573
H 1.352425 -2.209486 -1.523125
H 1.740484 -2.730710 0.145259
H -3.130712 -0.348039 -3.031314
H -5.673001 -0.779534 0.470905
H 4.669617 -0.850102 0.014684
H 4.290597 -0.213097 -1.615587
H -5.325163 -1.010452 -2.006954
H 0.439585 -4.548680 -1.096583
H -0.499154 -3.929471 0.298141
H -0.905809 -3.392432 -1.358221
H 6.813448 -0.392727 -1.289298
H 6.322309 1.319313 -1.488291
H 6.700645 0.683030 0.139642


