%chk=000247345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247345

0 1
O 4.541095 2.418002 -1.258292
O 4.167165 4.138020 0.335142
O -2.378567 0.568805 -2.210707
O 2.096044 -2.474693 2.374828
O -0.348192 -4.250145 -1.539848
O 1.215244 -4.831431 0.837389
N -1.370099 0.886128 -0.201281
C -0.039038 0.532287 -0.772073
C 1.032426 1.541504 -0.399746
C -1.343927 1.410234 1.182742
C -0.511984 2.701515 1.235717
C 0.813990 2.551628 0.542815
C 0.305716 -0.882930 -0.317960
C 2.278745 1.408157 -1.072530
C 1.829033 3.496306 0.863836
C -2.487152 0.917916 -1.045505
C 3.249499 2.323413 -0.752137
C 3.026105 3.358648 0.206599
C -0.189755 -1.956192 -1.072791
C 1.059942 -1.113074 0.830808
C -3.786693 1.347160 -0.432858
C 1.363994 -2.435235 1.218790
C 0.108461 -3.265396 -0.683464
C 5.155066 3.564774 -0.585684
C 0.912628 -3.528240 0.450359
C -4.215455 2.671326 -0.584309
C -4.583830 0.409880 0.235591
C -5.448607 3.060265 -0.052729
C -5.815931 0.806414 0.763569
C -6.246847 2.129847 0.621247
C 2.440223 -3.766816 2.939124
C -1.078457 -5.342799 -0.917861
C 2.184017 -5.466426 -0.049040
H -0.143698 0.537775 -1.904310
H -0.892449 0.632210 1.844344
H -2.374280 1.592444 1.556333
H -0.370059 3.003187 2.293749
H -1.071366 3.534812 0.756512
H 2.448718 0.614855 -1.797737
H 1.660647 4.283905 1.591984
H -0.814383 -1.787587 -1.952682
H 1.441650 -0.291541 1.436452
H 5.382113 4.321728 -1.347723
H 5.996844 3.194144 0.013709
H -3.596788 3.389480 -1.122339
H -4.247540 -0.622482 0.335275
H -5.789834 4.087820 -0.169791
H -6.442525 0.081799 1.281589
H -7.208527 2.435274 1.031786
H 1.547610 -4.395010 3.037994
H 2.850755 -3.481445 3.914246
H 3.189091 -4.252607 2.308373
H -0.524428 -5.765811 -0.072037
H -1.168843 -6.056796 -1.743509
H -2.057879 -4.970578 -0.604090
H 1.791845 -5.497442 -1.071834
H 2.270391 -6.468671 0.380377
H 3.132876 -4.926211 -0.010913


%chk=000247345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247345

0 1
O 4.842592 2.376797 -1.138552
O 4.509870 4.183455 0.405531
O -2.241692 0.730351 -2.175421
O 2.199148 -2.720090 2.256781
O -0.386874 -4.143829 -1.723204
O 1.164541 -4.863184 0.596634
N -1.210724 1.081376 -0.115143
C 0.105877 0.693307 -0.707782
C 1.222595 1.668847 -0.329889
C -1.162628 1.641678 1.249419
C -0.330780 2.940272 1.246567
C 1.025204 2.735054 0.586533
C 0.414302 -0.773462 -0.351716
C 2.488014 1.480254 -0.964090
C 2.089452 3.639311 0.885950
C -2.337306 0.994499 -0.929391
C 3.504898 2.379727 -0.662747
C 3.309610 3.443483 0.245355
C -0.117397 -1.799822 -1.170679
C 1.149313 -1.119177 0.805484
C -3.700569 1.182893 -0.309011
C 1.379189 -2.473677 1.139581
C 0.102993 -3.151547 -0.841983
C 5.434591 3.639601 -0.625922
C 0.879420 -3.507027 0.298338
C -4.640737 1.999265 -0.986991
C -4.108563 0.464629 0.845089
C -5.956991 2.129708 -0.495048
C -5.432287 0.579094 1.324394
C -6.356353 1.420991 0.663108
C 1.699083 -3.681486 3.263519
C -1.382599 -5.067300 -1.132121
C 2.101802 -5.495863 -0.366182
H -0.057252 0.742058 -1.801517
H -0.706116 0.897187 1.931422
H -2.184310 1.846133 1.599317
H -0.200599 3.295341 2.286955
H -0.899811 3.724582 0.708018
H 2.649714 0.649932 -1.657069
H 1.947581 4.459076 1.596273
H -0.713209 -1.559462 -2.057110
H 1.590259 -0.352059 1.449980
H 5.512224 4.365920 -1.457219
H 6.404141 3.416252 -0.155173
H -4.331509 2.509898 -1.904916
H -3.402152 -0.207431 1.346501
H -6.673262 2.772087 -1.018983
H -5.742735 0.008905 2.207014
H -7.381400 1.514463 1.038857
H 0.769287 -3.297034 3.726706
H 2.495539 -3.740101 4.021021
H 1.516254 -4.668642 2.808915
H -0.965513 -5.584161 -0.249211
H -1.618184 -5.790052 -1.928098
H -2.295503 -4.508578 -0.851086
H 1.679771 -5.468663 -1.386609
H 2.217520 -6.535768 -0.023913
H 3.077070 -4.975901 -0.340990


