%chk=000274188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274188

0 1
O 2.638584 -0.380351 -0.945768
O -2.100066 0.718898 0.051155
O 5.816283 2.056509 -0.093850
O 1.596714 1.751595 1.581832
O 3.928826 -2.099203 -1.670688
O -0.754422 1.326926 -1.705251
N 2.869204 3.379889 0.610272
N 4.304850 0.575453 0.793528
N -0.765663 2.518073 0.316684
C 4.088735 2.975509 1.330740
C 0.662748 -1.731805 -0.691853
C 1.470697 -0.906722 -1.652462
C 4.810539 -0.554568 -0.002162
C -4.077385 -0.520922 -0.181199
C 0.484800 3.233878 0.008243
C 4.820748 1.852625 0.576366
C -2.715484 -0.335218 -0.779768
C 1.674554 2.686079 0.798860
C 3.790454 -1.129217 -0.968290
C 0.091273 -2.941357 -1.110797
C 0.465202 -1.281683 0.622350
C -4.256594 -1.424066 0.877290
C -5.171006 0.206010 -0.674305
C -0.680562 -3.692125 -0.218942
C -0.301460 -2.039498 1.510552
C -1.139366 1.481628 -0.560687
C -5.527070 -1.607104 1.429580
C -6.439332 0.018622 -0.118147
C -0.877491 -3.243633 1.090950
C -6.618804 -0.888186 0.931701
H 4.777300 3.849335 1.421920
H 3.835333 2.655036 2.371956
H 0.943923 0.028100 -1.952713
H 1.803895 -1.464301 -2.547060
H 5.727994 -0.248032 -0.578726
H 5.138695 -1.373997 0.687466
H 0.688238 3.181677 -1.094937
H 0.323280 4.314295 0.249931
H 2.996932 4.052770 -0.140089
H -2.055277 -1.218171 -0.670768
H -2.729271 -0.007598 -1.835815
H 3.361446 0.456534 1.192435
H 0.254580 -3.303978 -2.124834
H 0.916810 -0.339261 0.949081
H -0.953167 2.375050 1.316246
H -3.403117 -1.977330 1.270500
H -5.032471 0.919333 -1.485783
H -1.121345 -4.633237 -0.544427
H -0.450336 -1.689045 2.531165
H -5.666296 -2.308759 2.250346
H -7.288461 0.581883 -0.502057
H -1.469579 -3.836026 1.785788
H -7.608111 -1.032714 1.362843


%chk=000274188-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274188

0 1
O 2.641963 -0.423754 -0.891856
O -2.313222 1.116481 -0.104272
O 6.068689 2.106718 0.013256
O 1.696213 1.846502 1.580621
O 3.976702 -2.308713 -1.252918
O -0.737716 1.411957 -1.836647
N 2.985022 3.469388 0.531710
N 4.349951 0.727705 0.806273
N -0.622079 2.602680 0.185795
C 4.213590 3.129960 1.276966
C 0.703956 -1.955214 -0.640713
C 1.491494 -1.087029 -1.602341
C 4.833830 -0.477663 0.139837
C -4.272987 -0.315191 -0.247654
C 0.622340 3.276792 -0.135570
C 4.977028 1.944997 0.639554
C -2.981486 0.053256 -0.934097
C 1.803487 2.790960 0.733684
C 3.798130 -1.181907 -0.741333
C 0.401242 -3.297931 -0.974183
C 0.245490 -1.425505 0.594989
C -4.372433 -1.522839 0.487182
C -5.405858 0.533456 -0.337587
C -0.360418 -4.101929 -0.094883
C -0.504165 -2.232676 1.478399
C -1.178253 1.686205 -0.684867
C -5.584420 -1.878424 1.121540
C -6.615753 0.183695 0.300341
C -0.813944 -3.571129 1.134766
C -6.708175 -1.025461 1.030392
H 4.886933 4.000362 1.279199
H 3.923249 2.883289 2.313518
H 0.901522 -0.228952 -1.964701
H 1.889549 -1.675423 -2.446415
H 5.702142 -0.190667 -0.482874
H 5.194861 -1.232518 0.864377
H 0.840516 3.061103 -1.198771
H 0.515998 4.374422 -0.026842
H 3.055032 4.149334 -0.228343
H -2.288390 -0.803145 -1.002972
H -3.136631 0.470042 -1.945001
H 3.422045 0.721577 1.253499
H 0.775479 -3.718941 -1.914660
H 0.493452 -0.393699 0.872501
H -0.989559 2.634065 1.137454
H -3.498275 -2.180959 0.561762
H -5.335901 1.469212 -0.905163
H -0.584485 -5.140862 -0.361519
H -0.847096 -1.817650 2.432817
H -5.652226 -2.816544 1.683601
H -7.485593 0.845789 0.225147
H -1.391380 -4.197239 1.824837
H -7.648961 -1.300382 1.520567


