%chk=000257060.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257060

0 1
O 2.753649 -0.213892 1.946382
O 3.103872 1.117091 -1.072008
N 1.773473 -1.584418 0.375535
N 0.929468 1.515598 -0.421274
N 4.149463 -1.302162 0.448543
N 2.754323 2.716205 0.558920
C -0.437690 -0.620928 -0.448648
C -0.797379 -1.798557 -1.424179
C 0.407376 -1.163822 0.747183
C 0.402974 0.414956 -1.255942
C -1.712733 0.014649 0.101432
C -1.604365 -1.326476 -2.638959
C -1.555605 -2.929110 -0.719750
C -2.312807 1.104665 -0.551538
C -2.330322 -0.489063 1.258980
C -3.483194 1.683710 -0.055091
C -3.500627 0.090595 1.756322
C 2.872498 -0.951736 0.971251
C 2.313275 1.710853 -0.339026
C -4.081237 1.181327 1.103668
H 0.171968 -2.217495 -1.798442
H -0.109595 -2.043160 1.204218
H 0.472584 -0.384928 1.548366
H -0.221744 0.864582 -2.066076
H 1.252996 -0.093722 -1.773142
H -1.070964 -0.575312 -3.230288
H -1.825676 -2.164717 -3.310709
H -2.568289 -0.893654 -2.342138
H -1.697942 -3.783680 -1.391313
H -2.553214 -2.607491 -0.394790
H -1.021010 -3.296496 0.164678
H 1.876346 -2.192176 -0.427762
H 0.280733 1.961535 0.218553
H -1.870389 1.509596 -1.463578
H -1.908449 -1.345220 1.785116
H -3.930326 2.529770 -0.575590
H -3.961340 -0.312138 2.657673
H -4.991084 1.633431 1.492668
H 4.915772 -0.783960 0.873250
H 4.244863 -1.328323 -0.561806
H 3.763586 2.763450 0.668982
H 2.270461 2.825524 1.440630


%chk=000257060-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257060

0 1
O 1.830882 -3.355586 1.108257
O 3.023875 1.412728 -0.367285
N 2.007248 -1.117136 0.408333
N 0.741295 1.882760 -0.644933
N 3.862360 -2.544480 0.296992
N 2.194607 3.484117 0.284934
C -0.314885 -0.434568 -0.398111
C -0.555649 -1.752790 -1.255650
C 0.646777 -0.757094 0.806328
C 0.412972 0.610377 -1.310932
C -1.645156 0.146298 0.135392
C -1.382270 -1.523979 -2.547352
C -1.198183 -2.904928 -0.442700
C -2.435037 1.040008 -0.643406
C -2.152775 -0.213536 1.415266
C -3.664058 1.551966 -0.170097
C -3.380616 0.294780 1.894149
C 2.516123 -2.389323 0.635657
C 2.028852 2.211908 -0.252444
C -4.145366 1.183220 1.105757
H 0.461192 -2.087137 -1.552747
H 0.260842 -1.603715 1.395047
H 0.682452 0.128982 1.470738
H -0.190042 0.838543 -2.205509
H 1.359431 0.171022 -1.667003
H -0.913443 -0.811730 -3.250728
H -1.490439 -2.483244 -3.086087
H -2.399247 -1.160902 -2.310094
H -1.359270 -3.774403 -1.107027
H -2.182999 -2.610749 -0.034647
H -0.544452 -3.245605 0.378029
H 2.615400 -0.339443 0.097351
H -0.041399 2.486656 -0.386934
H -2.104877 1.333110 -1.646675
H -1.592453 -0.903805 2.052560
H -4.246476 2.232247 -0.802408
H -3.739961 -0.007758 2.884418
H -5.098477 1.576724 1.476129
H 4.274060 -3.460559 0.448644
H 4.435450 -1.784581 -0.063725
H 3.126151 3.727280 0.611281
H 1.461258 4.189226 0.301533


