%chk=000276040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276040

0 1
O 5.621226 -0.601169 -0.182721
O 4.358432 1.271118 -0.592369
N -4.302593 0.316616 -0.019164
N 2.115604 -0.395131 -0.024444
N 3.423104 -0.815955 0.067977
C -4.716343 1.675588 -0.450305
C -5.397145 -0.616107 0.347944
C -2.960871 -0.057599 0.048399
C -2.591966 -1.378275 0.425532
C -1.930181 0.871288 -0.259886
C -4.771214 2.650284 0.726686
C -5.850503 -1.452782 -0.849389
C -0.234685 -0.818826 0.181792
C -1.253765 -1.739913 0.488905
C -0.598181 0.489904 -0.193382
C 1.166715 -1.248241 0.261662
C 6.850573 0.165283 -0.389748
C 4.425928 0.111029 -0.277183
C 7.146762 1.013784 0.828123
H -4.009646 2.052064 -1.227263
H -5.711853 1.610063 -0.944308
H -6.251853 -0.029009 0.753533
H -5.059758 -1.282706 1.176078
H -3.354159 -2.113769 0.665486
H -2.175700 1.889515 -0.549850
H -5.502581 2.339904 1.481297
H -3.800593 2.719614 1.236625
H -5.042307 3.657894 0.393572
H -5.018161 -2.028795 -1.275572
H -6.246178 -0.827118 -1.657685
H -6.633906 -2.162310 -0.562866
H -0.993753 -2.757957 0.781238
H 0.185621 1.215813 -0.434203
H 1.319763 -2.294736 0.568359
H 3.691336 -1.777416 0.308347
H 7.573573 -0.658141 -0.538511
H 6.738092 0.765142 -1.310906
H 7.116258 0.421828 1.751711
H 6.406188 1.821996 0.938209
H 8.135319 1.482527 0.761480


%chk=000276040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276040

0 1
O 5.683104 -0.623999 -0.136842
O 4.487169 1.361818 -0.622593
N -4.395147 0.308118 -0.010769
N 2.135635 -0.214720 -0.105943
N 3.438605 -0.684242 -0.024277
C -4.854914 1.635147 -0.468518
C -5.441968 -0.647605 0.402613
C -3.037882 -0.027997 0.029904
C -2.602427 -1.352493 0.363538
C -2.017427 0.942499 -0.260310
C -4.898537 2.698152 0.654983
C -5.905654 -1.589423 -0.734434
C -0.231650 -0.712317 0.112849
C -1.236531 -1.674672 0.405518
C -0.659810 0.605447 -0.222897
C 1.178653 -1.085057 0.162621
C 6.961846 0.110978 -0.333638
C 4.511415 0.156939 -0.295001
C 7.396689 0.816323 0.954690
H -4.213552 1.982544 -1.299232
H -5.867986 1.511068 -0.896093
H -6.306615 -0.063095 0.770003
H -5.082909 -1.237915 1.266052
H -3.331552 -2.139406 0.575339
H -2.290496 1.973449 -0.502506
H -5.576561 2.381931 1.468405
H -3.897411 2.855895 1.092144
H -5.262529 3.665122 0.260449
H -5.064753 -2.192767 -1.117816
H -6.317965 -1.009468 -1.579916
H -6.693021 -2.277196 -0.373355
H -0.941959 -2.700755 0.662807
H 0.103130 1.359168 -0.444673
H 1.402032 -2.137922 0.437677
H 3.658322 -1.658423 0.229221
H 7.671869 -0.676885 -0.633693
H 6.829073 0.834468 -1.157584
H 7.475650 0.098788 1.789947
H 6.676112 1.605940 1.226508
H 8.386553 1.287862 0.808025


