%chk=000258872.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258872

0 1
O -5.328109 1.020827 -0.846932
O -5.262980 -1.603484 0.189833
N -1.754393 0.779888 -0.028398
N 1.132423 0.615339 -0.202421
C -0.870896 1.726207 0.730980
C -1.075275 0.375067 -1.304299
C 0.459532 1.022428 1.071032
C 0.255300 -0.328374 -0.972805
C -3.085787 1.404549 -0.302088
C -4.120275 0.289810 -0.553194
C 2.493775 0.152757 -0.072374
C -4.332844 -0.603423 0.677967
C 3.254319 0.057835 -1.260302
C 3.112889 -0.116572 1.160196
C 4.597846 -0.295803 -1.204846
C 4.466595 -0.462494 1.204815
C 5.220365 -0.559195 0.029174
C 6.667058 -0.932038 0.069613
C -5.659887 -2.555014 1.192266
H -1.385051 2.005709 1.675161
H -0.664071 2.665549 0.172245
H -0.885730 1.235507 -1.983348
H -1.738681 -0.333632 -1.845347
H 1.121003 1.736882 1.608333
H 0.264461 0.161299 1.747628
H 0.057258 -1.265572 -0.406628
H 0.766523 -0.614260 -1.916480
H -3.412521 2.009413 0.572408
H -3.095759 2.103267 -1.167972
H -3.875772 -0.328972 -1.445957
H -4.786117 -0.057078 1.520333
H -3.393244 -1.088330 0.997224
H 2.789330 0.283445 -2.218735
H 2.554546 -0.065265 2.090933
H -6.093025 0.400848 -0.836870
H 5.175490 -0.363327 -2.125449
H 4.932570 -0.662061 2.168394
H 6.868101 -1.821218 -0.544082
H 7.296627 -0.118022 -0.317275
H 7.018579 -1.155806 1.084671
H -4.792461 -3.112183 1.558315
H -6.339699 -3.215808 0.639974
H -6.184513 -2.055593 2.011910


%chk=000258872-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258872

0 1
O -5.395795 1.119888 -0.781548
O -5.520702 -1.503355 0.085128
N -1.748772 0.762942 0.003407
N 1.131039 0.412286 -0.091055
C -0.845960 1.610856 0.818368
C -1.065734 0.408651 -1.266249
C 0.463291 0.869482 1.142445
C 0.230962 -0.363528 -0.976098
C -3.080948 1.383122 -0.204828
C -4.162866 0.349692 -0.560971
C 2.514433 0.087567 -0.046135
C -4.384802 -0.685512 0.546402
C 3.229135 -0.244732 -1.237897
C 3.258349 0.119674 1.169766
C 4.607559 -0.522692 -1.205404
C 4.644830 -0.150727 1.181865
C 5.353632 -0.479923 0.002809
C 6.844515 -0.772147 0.019501
C -5.949226 -2.489295 1.073773
H -1.354349 1.867279 1.766051
H -0.595106 2.565808 0.290241
H -0.825699 1.326169 -1.861413
H -1.730090 -0.229123 -1.876136
H 1.130943 1.569582 1.674530
H 0.238473 0.016018 1.825379
H -0.033961 -1.336641 -0.500734
H 0.737895 -0.582400 -1.928597
H -3.388059 1.886483 0.731171
H -3.071621 2.162547 -1.004178
H -3.898186 -0.196608 -1.492078
H -4.646952 -0.179396 1.501874
H -3.478023 -1.305335 0.693695
H 2.712756 -0.258501 -2.203325
H 2.760816 0.333844 2.120044
H -6.134681 0.455062 -0.801166
H 5.120217 -0.766887 -2.144940
H 5.181264 -0.116363 2.138710
H 7.068510 -1.772367 -0.398004
H 7.410437 -0.035577 -0.583091
H 7.247873 -0.741226 1.046788
H -5.133886 -3.205563 1.307154
H -6.795680 -3.033615 0.626123
H -6.278331 -2.002335 2.016222


