%chk=000298043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298043

0 1
O 1.782928 0.731242 0.581547
O 0.884125 1.557584 -1.356845
N -0.438210 0.655806 0.379563
C 3.546058 -0.064550 -0.919488
C 3.155592 1.018199 0.087403
C 3.482653 -1.484364 -0.345879
C 3.697250 -2.539661 -1.438238
C 3.964533 1.025713 1.385710
C 3.648903 -3.961494 -0.861218
C 3.973975 2.398104 2.049348
C 3.858663 -5.017163 -1.944451
C 0.742783 1.041519 -0.268743
C -1.755475 0.817659 -0.150812
C -2.863428 0.364460 0.664779
C -4.176642 0.518424 0.147215
C -1.975558 1.381926 -1.392446
C -2.699870 -0.226281 1.956909
C -4.375282 1.105730 -1.141531
C -3.299472 1.523104 -1.883824
C -5.293161 0.079353 0.930730
C -3.786099 -0.638751 2.687824
C -5.102806 -0.483645 2.166798
H 2.869234 0.013861 -1.799971
H 4.560477 0.147844 -1.310090
H 3.118607 2.017194 -0.403411
H 2.498986 -1.636611 0.143612
H 4.239648 -1.607753 0.451600
H 4.667815 -2.372416 -1.943125
H 2.927133 -2.429962 -2.226687
H 5.001147 0.691649 1.181629
H 3.535248 0.273321 2.083038
H 4.419571 -4.075801 -0.074140
H 2.675878 -4.130391 -0.359272
H 2.953936 2.745353 2.260489
H 4.513940 2.372940 3.003126
H 4.456074 3.155363 1.420375
H 3.821362 -6.028517 -1.524565
H 4.830113 -4.902265 -2.438388
H 3.087785 -4.956490 -2.721423
H -0.347089 0.231514 1.310725
H -1.142606 1.727568 -2.014844
H -1.695060 -0.348750 2.363526
H -5.390420 1.213415 -1.517149
H -3.438775 1.972551 -2.867883
H -6.294855 0.203592 0.521104
H -3.660118 -1.088196 3.671220
H -5.947792 -0.819129 2.766655


%chk=000298043-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298043

0 1
O 1.720340 0.655010 0.493269
O 0.824528 1.700934 -1.424181
N -0.520054 0.726998 0.277452
C 3.537266 -0.204582 -0.969574
C 3.116505 0.921913 -0.004319
C 3.612637 -1.616870 -0.347014
C 3.864962 -2.711388 -1.408454
C 3.983309 1.068046 1.255901
C 3.978049 -4.131086 -0.807437
C 3.644659 2.325740 2.081732
C 4.205829 -5.220203 -1.878207
C 0.671349 1.090185 -0.336444
C -1.845724 0.969212 -0.168065
C -2.936131 0.476672 0.654035
C -4.295649 0.727127 0.214649
C -2.112646 1.662957 -1.359617
C -2.744423 -0.245399 1.880225
C -4.533178 1.440093 -1.005578
C -3.458111 1.892607 -1.769976
C -5.387852 0.252297 1.014634
C -3.829165 -0.696054 2.637564
C -5.166999 -0.444959 2.202718
H 2.828043 -0.209702 -1.820240
H 4.526407 0.069543 -1.391622
H 3.075098 1.878041 -0.562210
H 2.665023 -1.831966 0.186076
H 4.419663 -1.656958 0.412219
H 4.794715 -2.477374 -1.969035
H 3.042063 -2.694203 -2.153243
H 5.042303 1.100632 0.930479
H 3.869706 0.163210 1.881823
H 4.809727 -4.151528 -0.073563
H 3.054593 -4.358861 -0.236660
H 2.591838 2.301371 2.413719
H 4.285629 2.397615 2.978970
H 3.791281 3.246132 1.485693
H 4.282891 -6.225739 -1.425130
H 5.138187 -5.031310 -2.443316
H 3.372135 -5.239422 -2.605210
H -0.392328 0.235278 1.162137
H -1.279884 2.024818 -1.965398
H -1.738750 -0.467090 2.257788
H -5.565937 1.620825 -1.324010
H -3.635610 2.437050 -2.703712
H -6.409836 0.449826 0.669737
H -3.653860 -1.245077 3.569015
H -6.010897 -0.801560 2.802882


