%chk=000297258.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297258

0 1
O 1.798015 3.615294 0.292072
N 2.727184 0.192069 -0.287102
N -1.273839 1.748681 -0.482083
N 3.596239 2.215910 0.563974
C 1.576944 1.164402 -0.178698
C 0.912629 1.311512 -1.559411
C 0.545211 0.795445 0.903690
C -0.293596 2.260385 -1.498576
C -0.647131 1.765329 0.881116
C 2.269883 2.501026 0.226096
C 3.958037 0.796697 0.333497
C -2.530285 2.569830 -0.514040
C 2.526203 -1.213293 -0.135705
C -3.655535 1.895592 0.290898
C -4.045849 0.532684 -0.293553
C 3.468863 -2.024566 0.529587
C 1.418508 -1.821822 -0.769750
C -5.190199 -0.112230 0.496914
C 3.301083 -3.411515 0.550555
C 1.266750 -3.204522 -0.731958
C 2.204705 -4.009227 -0.072869
C -5.563791 -1.500110 -0.056995
C -4.559235 -2.494928 0.227735
C -3.722856 -3.329148 0.466320
H 1.643841 1.664642 -2.309975
H 0.577100 0.305641 -1.906332
H 0.169273 -0.236086 0.731916
H 1.009735 0.787451 1.906304
H 0.053292 3.297876 -1.280141
H -0.793605 2.279967 -2.490101
H -1.408830 1.427999 1.618301
H -0.314731 2.783544 1.189683
H 4.797150 0.698059 -0.396970
H 4.249031 0.313919 1.298760
H 4.299202 2.910674 0.768677
H -2.376312 3.605066 -0.137804
H -2.849183 2.662549 -1.576176
H -4.532903 2.570500 0.307151
H -3.344479 1.773254 1.347638
H -4.327643 0.641991 -1.357336
H -3.156832 -0.134517 -0.293476
H 4.328863 -1.592415 1.032694
H 0.686091 -1.207235 -1.303697
H -4.908726 -0.203070 1.564583
H -6.084280 0.539624 0.470927
H 4.036874 -4.030073 1.064528
H 0.408726 -3.664245 -1.223549
H 2.079154 -5.087962 -0.049684
H -5.731348 -1.437440 -1.157522
H -6.539848 -1.821490 0.375398
H -3.006546 -4.041715 0.670889


%chk=000297258-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297258

0 1
O 2.030743 3.663543 0.470517
N 2.488795 0.101787 0.181945
N -1.289970 1.954002 -0.513666
N 3.674715 1.995537 0.685486
C 1.514107 1.230246 0.074989
C 0.968171 1.400928 -1.381667
C 0.365977 1.117834 1.132051
C -0.231747 2.366443 -1.469333
C -0.789643 2.105066 0.875893
C 2.397587 2.457244 0.425400
C 3.841951 0.549661 0.560504
C -2.587957 2.632325 -0.755621
C 2.245755 -1.264065 -0.038500
C -3.775362 1.939961 -0.045131
C -3.913817 0.448784 -0.419972
C 3.316602 -2.203914 0.103123
C 0.961445 -1.779374 -0.405861
C -5.032032 -0.273750 0.359210
C 3.110803 -3.581382 -0.115532
C 0.775215 -3.158859 -0.622271
C 1.840584 -4.078343 -0.482474
C -5.074672 -1.805779 0.080875
C -3.851234 -2.507285 0.517693
C -2.823304 -3.077349 0.895358
H 1.788185 1.760899 -2.032146
H 0.655892 0.415721 -1.764468
H -0.039436 0.092946 1.114636
H 0.789268 1.286071 2.140822
H 0.107883 3.412926 -1.279865
H -0.645652 2.324160 -2.494515
H -1.605863 1.875049 1.583319
H -0.453274 3.151570 1.071696
H 4.594364 0.292735 -0.218413
H 4.173332 0.092791 1.519751
H 4.434670 2.625748 0.939846
H -2.555318 3.711380 -0.454995
H -2.768828 2.610031 -1.848646
H -4.701089 2.491879 -0.308483
H -3.668604 2.032712 1.054832
H -4.102672 0.359249 -1.510693
H -2.945317 -0.050225 -0.232662
H 4.319434 -1.867503 0.384029
H 0.100703 -1.118279 -0.526002
H -4.890919 -0.113412 1.446361
H -6.020729 0.154186 0.096289
H 3.956640 -4.269025 0.001929
H -0.222062 -3.511267 -0.911212
H 1.685138 -5.147927 -0.656023
H -5.222612 -1.975969 -1.004619
H -5.948938 -2.253508 0.593492
H -1.925903 -3.566198 1.229124


