%chk=000218980.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218980

0 1
O -0.298873 0.916507 2.862319
O 1.269095 0.221908 0.724754
N -2.659300 0.311368 0.192261
C -2.653828 -0.015697 -1.277118
C -4.012337 0.828138 0.598258
C -4.160540 -0.172646 -1.651679
C -4.968948 0.080880 -0.373066
C -1.486879 1.028275 0.744673
C -2.003800 1.069111 -2.157305
C -1.902099 -1.346270 -1.457129
C -4.166757 2.353384 0.426327
C -4.276852 0.442484 2.060503
C -0.823120 0.110932 1.801068
C 0.298593 -0.756921 1.206690
C 2.441787 -0.239728 0.170728
C 2.774737 -1.585786 0.003959
C 3.294986 0.806394 -0.230788
C 4.013970 -1.894506 -0.587294
C 4.519087 0.477197 -0.815494
C 4.877931 -0.873049 -0.993880
C 4.393204 -3.328729 -0.772558
C 5.460024 1.551746 -1.255315
H -4.368976 -1.174713 -2.059397
H -4.447988 0.539330 -2.442905
H -5.882277 0.660746 -0.571816
H -5.298221 -0.874788 0.071419
H -0.744257 1.300323 -0.038944
H -1.770134 1.983720 1.243953
H -2.494842 2.039164 -2.028860
H -2.056904 0.804559 -3.217405
H -0.942267 1.202816 -1.911921
H -1.854403 -1.641743 -2.508119
H -2.394186 -2.149311 -0.895693
H -0.870843 -1.276516 -1.078687
H -4.014820 2.654147 -0.615204
H -3.441875 2.901670 1.039271
H -5.163289 2.688094 0.727709
H -3.602419 0.970345 2.745523
H -4.118932 -0.630496 2.221938
H -5.302642 0.680967 2.354758
H -1.576430 -0.529595 2.319674
H -0.060576 -1.354836 0.343076
H 0.780490 -1.391804 1.967272
H 0.507673 1.394510 2.562825
H 2.112939 -2.382340 0.317180
H 2.989410 1.835802 -0.078742
H 5.832722 -1.116350 -1.448901
H 3.648743 -3.862891 -1.380016
H 4.456750 -3.848910 0.194334
H 5.364080 -3.452349 -1.269466
H 5.060527 2.561414 -1.094166
H 6.412790 1.490079 -0.709287
H 5.693578 1.462762 -2.326021


%chk=000218980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218980

0 1
O -0.066021 1.772530 2.797640
O 1.227325 0.504540 0.681095
N -2.498919 0.558011 0.128184
C -2.402723 0.524489 -1.381287
C -3.914776 0.354038 0.584221
C -3.772319 -0.107924 -1.808641
C -4.421104 -0.627584 -0.505500
C -1.614538 1.450833 0.891702
C -2.237311 1.927655 -2.040041
C -1.212674 -0.368913 -1.817089
C -4.769569 1.661807 0.589561
C -3.979149 -0.287104 1.990073
C -0.766018 0.751636 1.996615
C 0.237006 -0.272014 1.458713
C 2.341819 -0.174412 0.151870
C 2.537711 -1.568477 0.254554
C 3.284206 0.643360 -0.519774
C 3.696106 -2.158428 -0.319703
C 4.436431 0.069258 -1.094427
C 4.631069 -1.336312 -0.986333
C 3.911387 -3.659084 -0.208718
C 5.458202 0.932521 -1.815520
H -3.626095 -0.908833 -2.554375
H -4.414204 0.661244 -2.276625
H -5.524170 -0.656766 -0.559006
H -4.059681 -1.645253 -0.267776
H -0.905027 1.947639 0.204994
H -2.171670 2.263422 1.405610
H -3.006762 2.633644 -1.679435
H -2.338312 1.838839 -3.137971
H -1.242102 2.365322 -1.838436
H -1.131470 -0.403506 -2.920300
H -1.350180 -1.400106 -1.444287
H -0.258321 0.022742 -1.420557
H -4.876646 2.083323 -0.425273
H -4.312977 2.434692 1.235285
H -5.782690 1.457955 0.983453
H -3.671565 0.422993 2.780066
H -3.326717 -1.177436 2.039011
H -5.015416 -0.601234 2.215397
H -1.429424 0.240666 2.712776
H -0.273418 -1.008559 0.810432
H 0.751788 -0.783154 2.295497
H 0.718492 2.066160 2.263493
H 1.808592 -2.204799 0.766419
H 3.098601 1.720955 -0.580714
H 5.525820 -1.790099 -1.430567
H 3.071773 -4.220328 -0.660485
H 3.984076 -3.977090 0.848595
H 4.838641 -3.971791 -0.718441
H 5.151748 1.992225 -1.837419
H 6.447083 0.876955 -1.322391
H 5.597595 0.598549 -2.860868


