%chk=000233415.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233415

0 1
O 0.653596 2.682123 -0.000288
O -4.702722 -2.209879 -0.000067
O -5.613682 -0.247719 0.000882
N -4.646897 -0.991139 0.000368
C 1.766523 0.580634 -0.000126
C 2.340140 0.177514 1.221404
C 2.341201 0.178951 -1.221633
C 4.040753 -1.058562 -0.000103
C 3.470703 -0.647506 1.214213
C 3.471750 -0.646089 -1.214428
C 0.575618 1.473723 -0.000145
C -0.776366 0.798079 -0.000008
C 1.740871 0.629309 2.512063
C 1.743025 0.632235 -2.512274
C 5.241263 -1.946659 -0.000123
C -0.899150 -0.597594 -0.000552
C -1.922160 1.608851 0.000636
C -2.164279 -1.188770 -0.000435
C -3.192349 1.031632 0.000765
C -3.299306 -0.366353 0.000231
H 3.914552 -0.964945 2.154619
H 3.916405 -0.962437 -2.154821
H 2.277497 0.246431 3.390488
H 0.693852 0.308498 2.611527
H 1.752830 1.729466 2.589541
H 1.754762 1.732503 -2.588319
H 2.280572 0.250627 -3.390686
H 0.696184 0.311290 -2.613124
H 4.940869 -3.005702 -0.001512
H 5.878077 -1.791260 -0.881996
H 5.876731 -1.793192 0.883054
H -0.005503 -1.229190 -0.001080
H -1.806732 2.699196 0.001018
H -2.277860 -2.278354 -0.000855
H -4.095767 1.651390 0.001265


%chk=000233415-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233415

0 1
O 0.654949 2.707413 -0.003092
O -4.813179 -2.243227 0.003760
O -5.745103 -0.161623 0.003046
N -4.727771 -0.955413 0.002915
C 1.774107 0.554738 -0.001167
C 2.355876 0.162041 1.237631
C 2.358989 0.165056 -1.239452
C 4.117453 -1.057628 -0.000179
C 3.520825 -0.640953 1.214742
C 3.523812 -0.638078 -1.215581
C 0.550508 1.445385 -0.001740
C -0.813133 0.797832 -0.000406
C 1.755779 0.610540 2.560440
C 1.762081 0.616642 -2.562649
C 5.351834 -1.942266 0.000279
C -0.961501 -0.614657 0.000510
C -1.967603 1.627921 -0.000236
C -2.243599 -1.197802 0.001592
C -3.254024 1.062903 0.000848
C -3.368921 -0.346240 0.001756
H 3.974655 -0.941513 2.167426
H 3.979947 -0.936452 -2.167851
H 2.330777 0.211028 3.412223
H 0.708358 0.270748 2.674319
H 1.748103 1.713061 2.642134
H 1.754350 1.719350 -2.641614
H 2.339273 0.219318 -3.413972
H 0.715017 0.276891 -2.679943
H 5.072844 -3.013952 -0.001836
H 5.977070 -1.764857 -0.892050
H 5.974403 -1.767677 0.895021
H -0.069485 -1.249442 0.000301
H -1.823977 2.713070 -0.000982
H -2.388911 -2.280945 0.002294
H -4.158805 1.675888 0.001012


