%chk=000261786.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261786

0 1
O -1.012957 0.420688 -2.674413
O 2.285852 -0.773145 2.043907
N -1.195175 0.457399 -0.370828
N 3.939629 -0.028964 0.623977
C -2.570644 0.074142 -0.223380
C -3.054242 -0.252942 1.072857
C 0.953736 0.933730 -1.409894
C 3.106232 0.634833 -0.336796
C 3.661066 1.654991 -1.155195
C 1.757484 0.272192 -0.476963
C -5.268802 -0.643483 0.118921
C -4.398875 -0.602930 1.221134
C -0.495636 0.569994 -1.582231
C -3.438753 0.029971 -1.325097
C 1.491097 1.930223 -2.230458
C 2.837147 2.281171 -2.098162
C -4.776808 -0.327140 -1.152898
C -2.162571 -0.233208 2.273286
C 5.091626 2.068550 -1.031673
C -6.700236 -1.026062 0.316507
C 3.469377 -0.694088 1.776737
C 4.560235 -1.285878 2.624441
H 1.341889 -0.530726 0.143480
H -0.682891 0.614744 0.502270
H -4.780495 -0.852793 2.209692
H 0.861331 2.421315 -2.975238
H -3.067214 0.269033 -2.328588
H 3.249664 3.058919 -2.741650
H -5.434409 -0.357818 -2.019610
H -1.284789 -0.884748 2.142231
H -1.803682 0.781301 2.496856
H -2.675301 -0.588610 3.177861
H 5.339635 2.373835 -0.004900
H 5.775206 1.261047 -1.329673
H 5.331623 2.928433 -1.674859
H 4.944263 0.029320 0.459507
H -7.195728 -0.360473 1.036942
H -7.281110 -0.983418 -0.613718
H -6.786386 -2.051249 0.703700
H 5.151659 -2.038841 2.086370
H 4.116131 -1.796571 3.497030
H 5.249022 -0.527844 3.019219


%chk=000261786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261786

0 1
O -1.156697 1.167308 -2.678152
O 2.187227 -0.921513 2.086462
N -1.234187 0.423508 -0.447355
N 3.827378 0.153270 0.784867
C -2.604116 0.070211 -0.286312
C -3.009904 -0.409963 1.001229
C 0.911949 1.106947 -1.409622
C 3.051300 0.742642 -0.257272
C 3.725260 1.572691 -1.208144
C 1.658589 0.509829 -0.365667
C -5.326108 -0.677859 0.148776
C -4.361410 -0.770983 1.185859
C -0.575832 0.900464 -1.578618
C -3.550951 0.173899 -1.336742
C 1.571719 1.918728 -2.362375
C 2.958299 2.140810 -2.251818
C -4.892477 -0.199590 -1.110312
C -2.015800 -0.529024 2.146432
C 5.218577 1.834431 -1.112870
C -6.770328 -1.081942 0.390964
C 3.398719 -0.618721 1.868857
C 4.534285 -1.074498 2.785663
H 1.212798 -0.166594 0.366728
H -0.661822 0.321352 0.392148
H -4.673052 -1.138450 2.172527
H 0.982429 2.353232 -3.175256
H -3.224272 0.546605 -2.308983
H 3.464081 2.774021 -2.989928
H -5.612632 -0.113754 -1.932927
H -1.176015 -1.214420 1.913631
H -1.576148 0.450387 2.423956
H -2.510936 -0.924373 3.048528
H 5.496624 2.328367 -0.160065
H 5.814654 0.902828 -1.198560
H 5.547603 2.499079 -1.927963
H 4.833161 0.328092 0.736778
H -7.217113 -0.509466 1.225898
H -7.390734 -0.908342 -0.505100
H -6.851966 -2.154347 0.652608
H 5.266683 -1.697078 2.239002
H 4.105720 -1.671040 3.603345
H 5.072647 -0.211843 3.220484


