%chk=000224118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224118

0 1
O 2.071231 -2.670457 -0.075776
O -2.597528 -1.104528 -0.042673
O -7.589041 -1.268792 0.150904
O -7.157877 0.778519 -0.646287
N -1.992487 1.119224 0.055047
C 2.220320 0.884371 0.018283
C 1.440395 -0.313291 -0.009278
C 3.649868 0.517502 -0.001027
C 3.750788 -0.908742 -0.040280
C 2.372164 -1.507433 -0.047255
C 0.066176 -0.288852 -0.000132
C 1.596905 2.118199 0.055674
C -0.567655 0.984302 0.038875
C 0.190357 2.166052 0.066009
C 4.788838 1.301671 0.012591
C 4.979527 -1.536440 -0.065496
C 6.043762 0.654667 -0.013313
C 6.140658 -0.732821 -0.051503
C -4.371733 0.534904 0.038970
C -2.929042 0.060625 0.013679
C -5.319374 -0.659725 0.127281
C -6.726907 -0.249649 -0.179540
H -0.519716 -1.218201 -0.022948
H 2.171923 3.042251 0.076743
H -0.297252 3.138944 0.094925
H 4.731262 2.386265 0.042209
H 5.053747 -2.624239 -0.095496
H -2.339575 2.080610 0.089642
H 6.949834 1.261719 -0.003011
H 7.118488 -1.211814 -0.071069
H -4.552987 1.227607 0.888316
H -4.597791 1.129391 -0.878080
H -4.999817 -1.471263 -0.575643
H -5.261579 -1.149216 1.127186
H -8.539384 -1.050762 -0.050628


%chk=000224118-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224118

0 1
O 2.151207 -2.715395 -0.304317
O -2.686361 -1.214949 -0.211440
O -7.738099 -1.083474 0.491576
O -7.143720 0.514567 -1.083175
N -2.005233 1.019120 0.026712
C 2.248295 0.872227 0.054595
C 1.490035 -0.329014 -0.073930
C 3.693777 0.528638 0.035765
C 3.818759 -0.887271 -0.104654
C 2.443818 -1.495584 -0.180064
C 0.090438 -0.347790 -0.091130
C 1.575993 2.101257 0.169737
C -0.586837 0.902701 0.027015
C 0.161830 2.106902 0.155137
C 4.845231 1.330116 0.128262
C 5.071859 -1.515733 -0.154425
C 6.117108 0.697882 0.078574
C 6.234217 -0.706672 -0.061033
C -4.410238 0.536258 -0.133922
C -2.966731 0.013992 -0.100000
C -5.400965 -0.548798 0.318955
C -6.804661 -0.283750 -0.180238
H -0.469812 -1.279429 -0.190698
H 2.120759 3.045902 0.269420
H -0.370677 3.062863 0.243910
H 4.777173 2.418253 0.235904
H 5.139747 -2.603283 -0.262716
H -2.366582 1.972235 0.115882
H 7.024446 1.308370 0.149266
H 7.227233 -1.167027 -0.096740
H -4.520778 1.450767 0.479220
H -4.656008 0.826471 -1.174978
H -5.062587 -1.526096 -0.080299
H -5.421380 -0.666343 1.416218
H -8.644759 -0.917317 0.114512


