%chk=000295321.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295321

0 1
O -3.364259 1.523878 -1.449582
O 3.369144 1.535113 -1.426651
N -2.696630 0.015881 0.159499
N 2.696046 0.025645 0.178784
C -3.900214 -0.781454 0.189781
C 3.902148 -0.767503 0.217568
C -4.586579 -0.922272 1.420240
C -4.361357 -1.438566 -0.973305
C 4.373349 -1.423631 -0.942032
C 4.580720 -0.905318 1.452684
C -1.209236 1.839291 -0.449558
C 1.206404 1.843506 -0.441161
C 0.000319 1.151452 -0.598392
C -2.527899 1.145248 -0.652464
C 2.528824 1.153997 -0.634905
C -5.723850 -1.736682 1.475786
C -5.512954 -2.237967 -0.883520
C 5.527060 -2.219017 -0.844083
C 5.720379 -1.715785 1.516310
C -6.184858 -2.387417 0.328451
C 6.191316 -2.365527 0.372449
C -4.115697 -0.220790 2.653901
C -3.664577 -1.296289 -2.283192
C 3.684883 -1.284470 -2.256638
C 4.099157 -0.204830 2.682782
C -1.216022 3.211524 -0.163004
C 1.206423 3.215749 -0.154580
C -0.006502 3.895290 -0.010771
H -2.022668 -0.189162 0.894583
H 2.017901 -0.181321 0.909476
H 0.003079 0.091285 -0.857514
H -6.258532 -1.857669 2.415680
H -5.884084 -2.744120 -1.773294
H 5.905890 -2.724356 -1.731070
H 6.249141 -1.834455 2.459841
H -7.075529 -3.012476 0.382099
H 7.083744 -2.987496 0.432419
H -3.186457 -0.661091 3.039049
H -3.934833 0.847904 2.466881
H -4.852583 -0.273728 3.467906
H -3.807836 -0.269858 -2.679072
H -2.581929 -1.454089 -2.195731
H -4.038100 -1.990426 -3.045104
H 2.602250 -1.446152 -2.176366
H 3.827083 -0.257713 -2.652054
H 4.066031 -1.977592 -3.015691
H 3.168946 -0.648223 3.061996
H 3.915759 0.863114 2.493961
H 4.830798 -0.254704 3.501698
H -2.166714 3.743394 -0.075692
H 2.154623 3.750928 -0.060665
H -0.009121 4.963949 0.205367


%chk=000295321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295321

0 1
O -3.604083 1.807278 -1.119299
O 3.607494 1.823854 -1.086999
N -2.600321 0.067941 0.092399
N 2.599817 0.076384 0.109640
C -3.740328 -0.795319 0.243875
C 3.741880 -0.782860 0.268379
C -4.095063 -1.192888 1.568970
C -4.450490 -1.277335 -0.894498
C 4.464203 -1.258392 -0.865113
C 4.086285 -1.183428 1.595299
C -1.232442 1.979930 -0.617747
C 1.230599 1.985105 -0.607300
C 0.000202 1.282731 -0.534197
C -2.576831 1.292191 -0.584097
C 2.577683 1.303290 -0.562118
C -5.188022 -2.071567 1.743799
C -5.550442 -2.143374 -0.669314
C 5.565755 -2.120502 -0.632778
C 5.181393 -2.057994 1.777152
C -5.922122 -2.539259 0.631780
C 5.927516 -2.518907 0.670327
C -3.326692 -0.668903 2.770549
C -4.048572 -0.915633 -2.308247
C 4.073259 -0.894522 -2.281389
C 3.304957 -0.666787 2.791692
C -1.225721 3.386811 -0.794641
C 1.219407 3.391967 -0.784091
C -0.004261 4.087435 -0.875130
H -1.801482 -0.129797 0.699675
H 1.796276 -0.126914 0.708809
H 0.002269 0.185389 -0.506236
H -5.471223 -2.377511 2.757591
H -6.108693 -2.518919 -1.534723
H 6.133238 -2.491031 -1.494339
H 5.456715 -2.366060 2.792469
H -6.773279 -3.212883 0.779146
H 6.780191 -3.189376 0.823196
H -2.285728 -1.052558 2.807141
H -3.269353 0.435628 2.764905
H -3.813588 -0.979287 3.709834
H -4.359087 0.117659 -2.548520
H -2.950908 -0.953057 -2.439701
H -4.509339 -1.605072 -3.035692
H 2.976995 -0.936553 -2.422697
H 4.381230 0.140821 -2.515967
H 4.543610 -1.579863 -3.006570
H 2.265326 -1.054884 2.817677
H 3.243116 0.437512 2.789399
H 3.784690 -0.978451 3.734235
H -2.188120 3.900249 -0.888330
H 2.180416 3.909454 -0.869353
H -0.005938 5.173258 -1.015750


