%chk=000291226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291226

0 1
O 1.120444 3.273217 0.184900
N -4.898410 0.101440 -0.367625
N 4.817423 -0.169561 0.368945
N -0.096476 2.610452 0.102288
C -0.795475 -0.923573 -0.071375
C 0.669944 -0.964920 -0.001812
C -1.218254 0.445420 -0.037669
C 1.158830 0.379945 0.074929
C -0.003281 1.316400 0.055606
C -2.548848 0.795941 -0.085381
C 2.504526 0.659588 0.148867
C -1.744180 -1.927498 -0.157036
C 1.566501 -2.018505 0.000222
C -3.525623 -0.240737 -0.174037
C 3.429151 -0.427876 0.150660
C -3.105181 -1.585114 -0.203144
C 2.943149 -1.747362 0.071444
C -5.894711 -0.956895 -0.041431
C -5.327050 1.428189 0.157787
C 5.760209 -1.246670 -0.043992
C 5.310012 1.171017 -0.056324
H -2.840613 1.845080 -0.069836
H 2.846279 1.692571 0.218547
H -1.447738 -2.974176 -0.186234
H 1.219742 -3.048293 -0.054841
H -3.835107 -2.388250 -0.276084
H 3.632396 -2.588891 0.077404
H -5.904190 -1.247701 1.020513
H -6.903224 -0.608543 -0.318123
H -5.689664 -1.854885 -0.650873
H -4.708517 2.223215 -0.296605
H -5.258483 1.516089 1.253176
H -6.368412 1.623093 -0.145992
H 5.512793 -2.177685 0.496120
H 6.785114 -0.970034 0.252536
H 5.753229 -1.455160 -1.125094
H 6.358763 1.292439 0.259737
H 5.247835 1.344271 -1.141815
H 4.728827 1.958074 0.457413
H 0.836769 4.248286 0.214827


%chk=000291226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291226

0 1
O 1.160829 3.267345 0.149504
N -4.945742 0.082195 -0.010479
N 4.861250 -0.158142 0.012912
N -0.143318 2.597579 0.117660
C -0.802428 -0.946491 -0.029416
C 0.671390 -0.975333 -0.025551
C -1.228927 0.417036 0.023527
C 1.163311 0.372275 0.030579
C -0.013460 1.282126 0.063969
C -2.581030 0.780758 0.030932
C 2.537446 0.661066 0.044700
C -1.780925 -1.957725 -0.075078
C 1.596854 -2.033207 -0.066623
C -3.581814 -0.246049 -0.016099
C 3.482864 -0.418453 0.001707
C -3.151116 -1.613533 -0.068784
C 2.983683 -1.760479 -0.053359
C -5.957049 -0.977025 -0.066467
C -5.359943 1.488351 0.035448
C 5.817717 -1.266802 -0.048719
C 5.346070 1.224865 0.080700
H -2.850502 1.838554 0.072123
H 2.861647 1.700168 0.086431
H -1.495879 -3.015256 -0.116594
H 1.257902 -3.074596 -0.109234
H -3.892272 -2.416682 -0.106151
H 3.682173 -2.601200 -0.085419
H -5.882830 -1.667244 0.799703
H -6.962007 -0.525859 -0.052012
H -5.870814 -1.584945 -0.991426
H -4.984851 2.059542 -0.839042
H -4.995512 1.997229 0.951694
H -6.460051 1.546934 0.030999
H 5.718536 -1.950619 0.820412
H 6.844109 -0.866605 -0.047539
H 5.690137 -1.871721 -0.970662
H 6.447771 1.226540 0.090651
H 5.011551 1.824962 -0.790673
H 4.996085 1.740435 0.998554
H 0.897647 4.222406 0.187722


