%chk=000268669.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268669

0 1
O 0.531027 1.793852 0.181182
O 2.420658 1.291470 -0.910060
O 1.336181 -2.622145 0.359735
N 2.935844 -1.538300 -0.831616
C -0.417514 -0.382391 0.506613
C -1.613301 -1.307864 0.206968
C -0.745369 1.130978 0.549600
C 0.726247 -0.467304 -0.534612
C -2.532100 -0.734399 -0.886332
C -1.774593 1.634559 -0.460723
C -2.978133 0.696534 -0.569427
C -2.392352 -1.594087 1.496142
C 1.361147 0.916889 -0.477808
C 1.673698 -1.628798 -0.260536
H 0.002390 -0.685387 1.502304
H -1.192087 -2.284189 -0.157498
H -0.935831 1.498739 1.576320
H 0.299007 -0.618214 -1.562565
H -3.418813 -1.386569 -1.005895
H -2.011822 -0.759194 -1.862752
H -1.291445 1.750540 -1.453236
H -2.101937 2.655899 -0.182594
H -3.665989 1.062724 -1.356097
H -3.561567 0.712325 0.372201
H -1.764472 -2.107667 2.235202
H -2.775241 -0.679583 1.960377
H -3.251683 -2.246477 1.302081
H 3.615958 -2.260907 -0.641492
H 3.297093 -0.675533 -1.226985


%chk=000268669-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268669

0 1
O 0.578120 1.800283 0.337163
O 2.524810 1.302225 -0.812209
O 1.260101 -2.742420 0.118411
N 2.955757 -1.465762 -0.844434
C -0.416415 -0.398213 0.509056
C -1.637504 -1.327126 0.248449
C -0.758880 1.117612 0.562189
C 0.729761 -0.435823 -0.535113
C -2.563440 -0.768242 -0.866102
C -1.731338 1.601996 -0.528792
C -2.983610 0.696602 -0.605272
C -2.413151 -1.576154 1.566970
C 1.404286 0.942947 -0.387828
C 1.678772 -1.652352 -0.374652
H 0.028574 -0.689239 1.480166
H -1.226545 -2.300735 -0.077462
H -1.081110 1.446924 1.562694
H 0.322323 -0.495250 -1.566293
H -3.456375 -1.416953 -0.948870
H -2.049132 -0.820234 -1.848942
H -1.215074 1.581180 -1.509488
H -2.004792 2.655013 -0.336608
H -3.646106 1.056637 -1.414350
H -3.566252 0.767967 0.333888
H -1.762133 -2.068045 2.312348
H -2.794733 -0.640309 2.017446
H -3.280465 -2.238089 1.388606
H 3.614476 -2.242083 -0.785540
H 3.265075 -0.526857 -1.126935


