%chk=000257792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257792

0 1
O -2.882808 -0.605392 1.771235
O -3.779200 0.521682 0.059503
N -1.090735 0.854353 -1.053444
C 0.963956 -2.247581 0.340042
C 2.483869 -2.199061 0.123022
C 0.177539 -1.969866 -0.948729
C 2.988491 -0.802381 -0.266723
C 2.887744 0.212334 0.880959
C -1.285264 -1.594831 -0.678339
C 2.933338 1.664834 0.382042
C -1.396121 -0.187433 -0.052115
C 1.706205 2.046407 -0.458381
C 0.439469 2.226196 0.387784
C -0.839274 2.208119 -0.467103
C -2.808604 -0.024249 0.527624
H 0.678035 -3.233628 0.751378
H 0.685107 -1.503856 1.116584
H 2.770860 -2.922499 -0.664581
H 2.995035 -2.539723 1.044000
H 0.664946 -1.142424 -1.513046
H 0.216822 -2.852995 -1.613005
H 2.396616 -0.434147 -1.135772
H 4.034275 -0.867879 -0.618729
H -1.859517 -1.639724 -1.624456
H -1.748286 -2.337757 0.002295
H 1.945947 0.047708 1.443495
H 3.705106 0.041672 1.605946
H 3.026283 2.347756 1.247848
H 3.848995 1.820966 -0.220947
H -0.653862 -0.111038 0.798769
H 1.913915 2.972586 -1.024908
H 1.525792 1.256824 -1.222550
H 0.388086 1.424259 1.154772
H 0.488747 3.178314 0.948905
H -1.697574 2.577158 0.137203
H -0.728957 2.912410 -1.322843
H -1.836719 0.909565 -1.758161
H -3.784156 -0.531380 2.182627


%chk=000257792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257792

0 1
O -3.287592 -0.731379 1.618479
O -3.882234 0.585871 -0.200092
N -1.085537 0.846593 -0.904868
C 0.993451 -2.216334 0.375504
C 2.527105 -2.217300 0.132071
C 0.152133 -1.948571 -0.896813
C 3.109992 -0.842655 -0.295077
C 3.044450 0.249325 0.806227
C -1.334814 -1.630210 -0.610306
C 3.044178 1.700043 0.252307
C -1.528624 -0.209004 0.012298
C 1.733216 2.094873 -0.479914
C 0.507469 2.252158 0.451366
C -0.842153 2.185167 -0.304478
C -3.003076 -0.046863 0.426672
H 0.693175 -3.191598 0.809988
H 0.754709 -1.458072 1.147468
H 2.765643 -2.969447 -0.648328
H 3.037980 -2.554970 1.057521
H 0.571148 -1.095909 -1.460504
H 0.208642 -2.835379 -1.560076
H 2.573130 -0.490930 -1.196357
H 4.165345 -0.977945 -0.606573
H -1.917127 -1.677746 -1.552730
H -1.764144 -2.381604 0.080399
H 2.135949 0.103633 1.422590
H 3.900530 0.119595 1.498685
H 3.222118 2.411260 1.085580
H 3.899308 1.817330 -0.445132
H -0.926539 -0.158017 0.936226
H 1.893499 3.046442 -1.027026
H 1.485107 1.333502 -1.243728
H 0.522371 1.466156 1.232518
H 0.560479 3.218481 0.993025
H -1.668270 2.495610 0.378920
H -0.826624 2.918255 -1.133686
H -1.704825 0.900191 -1.724483
H -4.255466 -0.635254 1.834528


