%chk=000251688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251688

0 1
O 1.216102 0.058203 1.770098
O 4.359620 2.660926 -0.470416
O -0.863639 -3.790756 -1.449016
O -2.960883 -1.181074 -1.014780
O -1.796724 -3.670218 0.586559
N -1.085042 -0.725734 0.224658
C 1.863156 -0.691429 -0.479339
C 2.615033 -0.401035 -1.644430
C 2.001816 0.178896 0.623122
C 3.466931 0.711583 -1.686986
C 3.569704 1.544437 -0.565182
C 0.979820 -1.857833 -0.479509
C 2.844281 1.287611 0.612065
C 2.496336 -1.274636 -2.849243
C -0.340209 -1.860146 -0.203517
C -2.973729 0.802724 0.350631
C -2.394113 -0.450576 -0.226260
C -1.111773 -3.148647 -0.257774
C 1.476139 -1.111700 2.588864
C -3.455407 1.783761 -0.526735
C -3.072280 0.977396 1.737018
C 5.157973 3.033576 -1.621815
C -4.023468 2.951736 -0.010818
C -3.646314 2.145963 2.245560
C -4.117771 3.132966 1.373232
H 4.031568 0.918625 -2.589501
H 1.465846 -2.798512 -0.771335
H 2.928830 1.940404 1.477639
H 2.995182 -0.858059 -3.733730
H 2.935040 -2.267533 -2.668281
H 1.440995 -1.438719 -3.126144
H -0.566176 -0.043587 0.802373
H 0.744125 -0.993029 3.397463
H 2.499964 -1.064282 2.971292
H 1.298371 -2.032722 2.027716
H -3.392764 1.628575 -1.605148
H -2.713495 0.202924 2.415840
H 5.664068 3.937630 -1.257271
H 4.511239 3.262653 -2.473652
H 5.880129 2.245874 -1.854154
H -4.397000 3.718317 -0.688240
H -3.727596 2.286065 3.322478
H -4.562771 4.043742 1.772897
H -1.401313 -4.624259 -1.546230


%chk=000251688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251688

0 1
O 0.891787 0.250131 1.447295
O 4.684165 2.539823 -0.358684
O -0.852270 -3.708281 -1.832045
O -3.148430 -0.922047 -1.229232
O -2.169104 -3.393836 0.058491
N -1.206432 -0.612570 0.018539
C 1.840026 -0.626113 -0.674501
C 2.886668 -0.514238 -1.653125
C 1.858612 0.325975 0.394296
C 3.840114 0.526083 -1.569888
C 3.792832 1.472770 -0.516143
C 0.841717 -1.698395 -0.826135
C 2.797037 1.362437 0.480524
C 2.964723 -1.486862 -2.817943
C -0.508859 -1.694483 -0.549482
C -3.154259 0.845373 0.441674
C -2.525777 -0.293825 -0.318541
C -1.287748 -2.967516 -0.719129
C 1.234516 -0.709954 2.522388
C -4.511233 1.137508 0.146227
C -2.472940 1.630690 1.410709
C 5.734300 2.706795 -1.368318
C -5.180086 2.187477 0.806642
C -3.143513 2.685310 2.067983
C -4.497498 2.965968 1.771230
H 4.608772 0.592105 -2.345852
H 1.202256 -2.624926 -1.284909
H 2.763988 2.074148 1.309154
H 3.782883 -1.213931 -3.504877
H 3.149864 -2.522956 -2.474064
H 2.022365 -1.505906 -3.394592
H -0.644702 -0.026814 0.662039
H 0.396582 -0.675987 3.234956
H 2.171227 -0.395916 3.016973
H 1.342652 -1.730695 2.111991
H -5.012831 0.520452 -0.606428
H -1.422519 1.445696 1.662936
H 6.297113 3.596279 -1.050442
H 5.301121 2.877748 -2.372535
H 6.408294 1.828937 -1.396394
H -6.228811 2.400058 0.571866
H -2.609360 3.288495 2.810537
H -5.014288 3.783994 2.285717
H -1.383155 -4.548901 -1.868912


